smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cc1cccc([C@@H]2CCCN2C(=O)Cc2ccc([O-])c(F)c2)c1C ZINC000449930412 1032131454 /nfs/dbraw/zinc/13/14/54/1032131454.db2.gz VSRIOXOSDQKZOY-SFHVURJKSA-N -1 3 327.399 4.054 20 0 EIADHM C[C@H](NCc1cc(=O)[n-]c(C2CC2)n1)c1cccc(Cl)c1Cl ZINC000459381070 1032234562 /nfs/dbraw/zinc/23/45/62/1032234562.db2.gz CEHAIFZKIVAMTK-VIFPVBQESA-N -1 3 338.238 4.217 20 0 EIADHM COc1ccc(SCc2cc(=O)oc3c(C)c([O-])ccc23)cc1 ZINC000007790669 1032300719 /nfs/dbraw/zinc/30/07/19/1032300719.db2.gz PJSOJMCARWPOMK-UHFFFAOYSA-N -1 3 328.389 4.108 20 0 EIADHM O=C(Nc1ccc(Cl)cc1[O-])c1cnc(-c2ccsc2)s1 ZINC000532838204 1032342445 /nfs/dbraw/zinc/34/24/45/1032342445.db2.gz TXTJGTHHMVUJAA-UHFFFAOYSA-N -1 3 336.825 4.483 20 0 EIADHM CC(C)(C)c1noc2ncc(C(=O)Nc3ccc(Cl)cc3[O-])cc21 ZINC000532836476 1032341025 /nfs/dbraw/zinc/34/10/25/1032341025.db2.gz ARILRNPUUJORJV-UHFFFAOYSA-N -1 3 345.786 4.132 20 0 EIADHM O=C(Nc1ccc(Cl)cc1[O-])c1cccn1Cc1cccs1 ZINC000532837123 1032343103 /nfs/dbraw/zinc/34/31/03/1032343103.db2.gz LNVDZTVVZNMBQW-UHFFFAOYSA-N -1 3 332.812 4.209 20 0 EIADHM O=C(Nc1ccc(Cl)cc1[O-])c1cnc(-c2ccccc2)s1 ZINC000532839006 1032345019 /nfs/dbraw/zinc/34/50/19/1032345019.db2.gz FTEJUNJZKFCLID-UHFFFAOYSA-N -1 3 330.796 4.421 20 0 EIADHM C[C@]1(CNC(=O)c2cc3sccc3c([O-])c2)CCOC2(CCC2)C1 ZINC000924285527 1018796418 /nfs/dbraw/zinc/79/64/18/1018796418.db2.gz CIYGWKRTEIUGDY-SFHVURJKSA-N -1 3 345.464 4.076 20 0 EIADHM O=C1c2ccccc2N[C@H](c2ccc([O-])c(F)c2)N1Cc1ccccc1 ZINC000339387368 1018830883 /nfs/dbraw/zinc/83/08/83/1018830883.db2.gz JDCKLKZIFADSIR-FQEVSTJZSA-N -1 3 348.377 4.298 20 0 EIADHM Cc1ccc2c(c1)SCCCN2C(=O)c1ccc(C)c(C)c1[O-] ZINC001625788310 1019058770 /nfs/dbraw/zinc/05/87/70/1019058770.db2.gz SOZZJNDFZQKGSQ-UHFFFAOYSA-N -1 3 327.449 4.460 20 0 EIADHM CC[C@H](C)c1nc(C)c(CC(=O)Nc2ccc(Cl)cc2[O-])c(C)n1 ZINC000654966386 1019066597 /nfs/dbraw/zinc/06/65/97/1019066597.db2.gz XUERCSFWTOUAGN-JTQLQIEISA-N -1 3 347.846 4.147 20 0 EIADHM COc1ccccc1-c1ccc(CNCc2cccc(C(=O)[O-])c2)cc1 ZINC000683176800 1019116735 /nfs/dbraw/zinc/11/67/35/1019116735.db2.gz RXOLDGNSLZGKHY-UHFFFAOYSA-N -1 3 347.414 4.350 20 0 EIADHM CCc1onc(C)c1[N-]C(=O)c1cc(F)c(C(F)(F)F)c(F)c1 ZINC000683211678 1019392556 /nfs/dbraw/zinc/39/25/56/1019392556.db2.gz IGMRMEWCCFEUIT-UHFFFAOYSA-N -1 3 334.244 4.095 20 0 EIADHM Cc1c(C(=O)Nc2cc(Cl)ccc2[O-])cnn1-c1cccc(C)c1 ZINC000521338363 1019961180 /nfs/dbraw/zinc/96/11/80/1019961180.db2.gz FHJQDNVCEDTZTQ-UHFFFAOYSA-N -1 3 341.798 4.100 20 0 EIADHM C[C@@H](NC(=O)c1c[n-]c2ccccc2c1=O)c1cccc2ccccc21 ZINC000032698925 1020480896 /nfs/dbraw/zinc/48/08/96/1020480896.db2.gz UDFORQKTCATAGH-CQSZACIVSA-N -1 3 342.398 4.172 20 0 EIADHM CSc1ccc([O-])c(C(=O)N(Cc2ccccc2F)CC2CC2)c1 ZINC001167246355 1020662914 /nfs/dbraw/zinc/66/29/14/1020662914.db2.gz LPQCSSXZYSALQS-UHFFFAOYSA-N -1 3 345.439 4.306 20 0 EIADHM O=C(Nc1cc(Br)ccc1[O-])c1cc2cc(F)ccc2[nH]1 ZINC000340316747 1020755735 /nfs/dbraw/zinc/75/57/35/1020755735.db2.gz IMTJNUFRPDLNBX-UHFFFAOYSA-N -1 3 349.159 4.027 20 0 EIADHM [O-]c1ccc(F)c(CNCc2nc3cc(Cl)ccc3s2)c1F ZINC000510305783 1021094723 /nfs/dbraw/zinc/09/47/23/1021094723.db2.gz RMUZUIAHMUKQKW-UHFFFAOYSA-N -1 3 340.782 4.223 20 0 EIADHM COc1cccc(C(=O)N2Cc3ccccc3-c3ccccc32)c1[O-] ZINC000612665909 1021264652 /nfs/dbraw/zinc/26/46/52/1021264652.db2.gz DCOXCDBMYWBLFH-UHFFFAOYSA-N -1 3 331.371 4.228 20 0 EIADHM Cc1cccc(S(=O)(=O)[N-]c2ccc(N3CCC(C)CC3)cc2)c1 ZINC000096659637 1032973577 /nfs/dbraw/zinc/97/35/77/1032973577.db2.gz LZLRVJNCTCVZKO-UHFFFAOYSA-N -1 3 344.480 4.032 20 0 EIADHM CC(C)(C)C[C@H]1CCN(C(=O)c2cc(=O)c3ccccc3[n-]2)C1(C)C ZINC000413986289 1021581899 /nfs/dbraw/zinc/58/18/99/1021581899.db2.gz JJWFNCONAIEVLP-CQSZACIVSA-N -1 3 340.467 4.205 20 0 EIADHM Nc1cc(Br)cc(F)c1Nc1cccc([O-])c1Cl ZINC001210855404 1021808366 /nfs/dbraw/zinc/80/83/66/1021808366.db2.gz YWUACQZBIACPBF-UHFFFAOYSA-N -1 3 331.572 4.273 20 0 EIADHM CCN(CCOc1cccc(C(=O)[O-])c1)Cc1ccc(Cl)s1 ZINC000580440315 1022027131 /nfs/dbraw/zinc/02/71/31/1022027131.db2.gz BQJOUNZRENFNTE-UHFFFAOYSA-N -1 3 339.844 4.001 20 0 EIADHM O=C(N[C@@H](c1ccco1)c1ccccc1)c1cc([O-])ccc1Cl ZINC000377868568 1022062748 /nfs/dbraw/zinc/06/27/48/1022062748.db2.gz JKNZLEYXXNCRQO-QGZVFWFLSA-N -1 3 327.767 4.158 20 0 EIADHM CCC(C)(C)C1CCC(CC(=O)N2CCCc3c(=O)[n-]cnc32)CC1 ZINC000893205258 1022698151 /nfs/dbraw/zinc/69/81/51/1022698151.db2.gz SAIPVGAZDAJSDJ-UHFFFAOYSA-N -1 3 345.487 4.094 20 0 EIADHM CC(C)[C@@H]1CN(C(=O)c2cc([O-])ccc2Cl)c2ccccc2N1 ZINC000431864089 1022761176 /nfs/dbraw/zinc/76/11/76/1022761176.db2.gz VIEWGXOUFYVXFJ-INIZCTEOSA-N -1 3 330.815 4.143 20 0 EIADHM CC(C)(C)[C@H]1CCCN1Cc1coc(-c2ccc(C(=O)[O-])cc2)n1 ZINC000581017583 1022802385 /nfs/dbraw/zinc/80/23/85/1022802385.db2.gz UXXCTCMCTLUCPR-MRXNPFEDSA-N -1 3 328.412 4.050 20 0 EIADHM CC[C@H](C)Oc1cc(C)ccc1CNCc1c(F)ccc([O-])c1F ZINC000511602516 1023141710 /nfs/dbraw/zinc/14/17/10/1023141710.db2.gz BIBKYIKBUPIXSY-ZDUSSCGKSA-N -1 3 335.394 4.446 20 0 EIADHM CC(C)[C@@H](CC(F)(F)F)[N-]C(=O)C(F)(F)c1ccccc1F ZINC000782944072 1023186208 /nfs/dbraw/zinc/18/62/08/1023186208.db2.gz DWVVOSUHYXUYBF-LLVKDONJSA-N -1 3 327.268 4.011 20 0 EIADHM CC(C)[C@@H](CC(F)(F)F)[N-]C(=O)C(F)(F)c1ccc(F)cc1 ZINC000782949066 1023192740 /nfs/dbraw/zinc/19/27/40/1023192740.db2.gz IIDQLZWOEPVAAL-LLVKDONJSA-N -1 3 327.268 4.011 20 0 EIADHM O=C(Nc1ccc([O-])c(-c2nc3ccccc3s2)c1)c1cc[nH]c1 ZINC000179934664 1023223088 /nfs/dbraw/zinc/22/30/88/1023223088.db2.gz LKPIGVLRLUOSAX-UHFFFAOYSA-N -1 3 335.388 4.249 20 0 EIADHM CC(=O)c1cccc(-c2noc(C=C([O-])c3ccccc3Cl)n2)c1 ZINC001211647477 1023226384 /nfs/dbraw/zinc/22/63/84/1023226384.db2.gz RGVBUQXCVTVGNP-UHFFFAOYSA-N -1 3 340.766 4.018 20 0 EIADHM CCC1(CC)CCCN(C(=O)c2cc(=O)c3ccccc3[n-]2)CC1 ZINC000276282672 1023280470 /nfs/dbraw/zinc/28/04/70/1023280470.db2.gz VQZKBMILKWPLEM-UHFFFAOYSA-N -1 3 326.440 4.373 20 0 EIADHM CC(C)Sc1c(Cl)cccc1NC([O-])=NO[C@H]1CCCCO1 ZINC000160939107 1023340587 /nfs/dbraw/zinc/34/05/87/1023340587.db2.gz YUHOVQNLKDRZHE-ZDUSSCGKSA-N -1 3 344.864 4.420 20 0 EIADHM CC(C)Sc1c(Cl)cccc1NC(=O)[N-]O[C@H]1CCCCO1 ZINC000160939107 1023340595 /nfs/dbraw/zinc/34/05/95/1023340595.db2.gz YUHOVQNLKDRZHE-ZDUSSCGKSA-N -1 3 344.864 4.420 20 0 EIADHM CC(C)c1cc(C(=O)Nc2cccc([O-])c2F)nn1-c1ccccc1 ZINC000129396069 1023353282 /nfs/dbraw/zinc/35/32/82/1023353282.db2.gz UDKZRXQMFXXMCO-UHFFFAOYSA-N -1 3 339.370 4.093 20 0 EIADHM Cc1nc2c(s1)[C@H](NC(=O)c1cc([O-])c3ccccc3c1)CCC2 ZINC000377067465 1023361618 /nfs/dbraw/zinc/36/16/18/1023361618.db2.gz NAXAGTIYPLYMTH-MRXNPFEDSA-N -1 3 338.432 4.118 20 0 EIADHM O=C(Oc1ccccc1OC(F)(F)F)c1cccc(Cl)c1[O-] ZINC001267651533 1023574809 /nfs/dbraw/zinc/57/48/09/1023574809.db2.gz WSXDLZMICWPESB-UHFFFAOYSA-N -1 3 332.661 4.163 20 0 EIADHM CC(C)c1cccc2c1CCN(C(=O)c1cc(=O)c3ccccc3[n-]1)C2 ZINC000276631589 1023809692 /nfs/dbraw/zinc/80/96/92/1023809692.db2.gz PQUONUNQMHKQNW-UHFFFAOYSA-N -1 3 346.430 4.262 20 0 EIADHM CC[C@@H](C)Oc1ccc([N-]S(=O)(=O)c2ccc(C)cc2C)cc1 ZINC000511696565 1023829441 /nfs/dbraw/zinc/82/94/41/1023829441.db2.gz CFYJYOSQLQWGCR-OAHLLOKOSA-N -1 3 333.453 4.282 20 0 EIADHM Cc1cc(=O)[n-]c(C(C)(C)NCc2c(C)cc(C(C)(C)C)cc2C)n1 ZINC000660744686 1024042576 /nfs/dbraw/zinc/04/25/76/1024042576.db2.gz DSFCTIUKAYDPAF-UHFFFAOYSA-N -1 3 341.499 4.430 20 0 EIADHM Cc1cc(=O)[n-]c(C(C)(C)NCc2csc(C3CCCCC3)n2)n1 ZINC000660748129 1024047599 /nfs/dbraw/zinc/04/75/99/1024047599.db2.gz ZDXYGWVNFKNFGA-UHFFFAOYSA-N -1 3 346.500 4.020 20 0 EIADHM C[C@H](NCc1cccc([O-])c1Cl)c1cccc(OC(F)F)c1 ZINC000293974251 1024733589 /nfs/dbraw/zinc/73/35/89/1024733589.db2.gz DFGVBXPMCQHOJO-JTQLQIEISA-N -1 3 327.758 4.498 20 0 EIADHM COc1cc(F)c(NC(=O)c2cc3sccc3c([O-])c2)cc1F ZINC001137534683 1024815732 /nfs/dbraw/zinc/81/57/32/1024815732.db2.gz GXTKIMWJFUEOOZ-UHFFFAOYSA-N -1 3 335.331 4.146 20 0 EIADHM O=C(Nc1ccc(Br)cc1[O-])[C@H](c1ccccc1)C1CC1 ZINC000535736602 1024905569 /nfs/dbraw/zinc/90/55/69/1024905569.db2.gz YGFOZJRSBGHLQA-MRXNPFEDSA-N -1 3 346.224 4.287 20 0 EIADHM CCC1(c2ccccc2)CN(C(=O)CCCc2ccc([O-])c(F)c2)C1 ZINC000458210433 1024945315 /nfs/dbraw/zinc/94/53/15/1024945315.db2.gz DYRATFATENNYPG-UHFFFAOYSA-N -1 3 341.426 4.044 20 0 EIADHM C/C(=C/c1c(Cl)cccc1Cl)C(=O)[N-]OCc1cccnc1 ZINC000588473473 1025054394 /nfs/dbraw/zinc/05/43/94/1025054394.db2.gz FNYBRPPBIJFSHW-FLIBITNWSA-N -1 3 337.206 4.040 20 0 EIADHM CCCCCC[C@H](CC)CN(C)C(=O)c1cc2c(cc1[O-])OCO2 ZINC001167824639 1025587410 /nfs/dbraw/zinc/58/74/10/1025587410.db2.gz TZWYKSHBDSGVKW-AWEZNQCLSA-N -1 3 335.444 4.190 20 0 EIADHM [O-]c1cccc(CNc2cnn(C3CCCC3)c2)c1Br ZINC000722375207 1025717331 /nfs/dbraw/zinc/71/73/31/1025717331.db2.gz NRKHTSNCCUJTCS-UHFFFAOYSA-N -1 3 336.233 4.078 20 0 EIADHM CC(C)(C(=O)Nc1ccc([O-])c(C(F)(F)F)c1)c1cccc(F)c1 ZINC000426609145 1025776845 /nfs/dbraw/zinc/77/68/45/1025776845.db2.gz WWNKZGOBRGUSFQ-UHFFFAOYSA-N -1 3 341.304 4.466 20 0 EIADHM Cc1cc(C)c(S(=O)(=O)[N-]c2ccc(OC(F)F)cc2)c(C)c1 ZINC000014236598 1025819282 /nfs/dbraw/zinc/81/92/82/1025819282.db2.gz FHVSLXAHTLNXKT-UHFFFAOYSA-N -1 3 341.379 4.014 20 0 EIADHM O=C(c1ccc([O-])cc1)C1CCN(Cc2ccccc2Cl)CC1 ZINC000261369460 1025823523 /nfs/dbraw/zinc/82/35/23/1025823523.db2.gz XBYHFJBIQWOIFC-UHFFFAOYSA-N -1 3 329.827 4.141 20 0 EIADHM CC(C)(C(=O)NCc1ncccc1[O-])c1ccc(-c2ccccc2)cc1 ZINC000473639476 1025966271 /nfs/dbraw/zinc/96/62/71/1025966271.db2.gz IJNZXBRDSRASIT-UHFFFAOYSA-N -1 3 346.430 4.048 20 0 EIADHM Cc1ccc([C@H]2C[C@H](C)N(C(=O)c3cc(=O)c4ccccc4[n-]3)C2)cc1 ZINC000279080998 1026058380 /nfs/dbraw/zinc/05/83/80/1026058380.db2.gz SOLWMEVLQUXWDD-RDJZCZTQSA-N -1 3 346.430 4.267 20 0 EIADHM CCOc1cc(-c2nc3ccccc3n2CCOC)cc(Cl)c1[O-] ZINC000048880400 1026068617 /nfs/dbraw/zinc/06/86/17/1026068617.db2.gz UWHXBETVJSXFBE-UHFFFAOYSA-N -1 3 346.814 4.107 20 0 EIADHM O=S(=O)([N-][C@@H]1CCc2c1cccc2Cl)c1ccc(Cl)s1 ZINC000049336199 1026166244 /nfs/dbraw/zinc/16/62/44/1026166244.db2.gz GCGNVKYEZBJFLG-LLVKDONJSA-N -1 3 348.276 4.021 20 0 EIADHM Cc1cccc2nc(-c3cc(F)cc(Br)c3)[n-]c(=O)c12 ZINC000467102803 1026216487 /nfs/dbraw/zinc/21/64/87/1026216487.db2.gz UKYXLBNCUYUMFZ-UHFFFAOYSA-N -1 3 333.160 4.212 20 0 EIADHM COc1ccc(SCCCC(=O)Nc2cccc([O-])c2F)cc1 ZINC000548701760 1026298629 /nfs/dbraw/zinc/29/86/29/1026298629.db2.gz HZGFHDVFLAIRKC-UHFFFAOYSA-N -1 3 335.400 4.051 20 0 EIADHM Cc1oc(CN(C)[C@@H](C)CCSc2ccccc2)cc1C(=O)[O-] ZINC000563283009 1026335146 /nfs/dbraw/zinc/33/51/46/1026335146.db2.gz VZXFIAGNFDHNMI-ZDUSSCGKSA-N -1 3 333.453 4.289 20 0 EIADHM O=C(Nc1ncc(Cc2ccccc2)s1)c1cc([O-])ccc1Cl ZINC000550249575 1026420866 /nfs/dbraw/zinc/42/08/66/1026420866.db2.gz VXPXBGMHIUGFHZ-UHFFFAOYSA-N -1 3 344.823 4.345 20 0 EIADHM O=C(Nc1cc(Br)ccc1[O-])c1sccc1Cl ZINC000583491351 1026453702 /nfs/dbraw/zinc/45/37/02/1026453702.db2.gz RWBJNIYMYZVQMA-UHFFFAOYSA-N -1 3 332.606 4.122 20 0 EIADHM O=C([O-])C[C@@H](NCc1cnc(-c2ccccc2)s1)c1ccsc1 ZINC000426689423 1026491036 /nfs/dbraw/zinc/49/10/36/1026491036.db2.gz VEZPYNDNLNTQFN-OAHLLOKOSA-N -1 3 344.461 4.177 20 0 EIADHM CC(C)COc1ccc(CN[C@H](C(=O)[O-])c2cccc(Cl)c2)cc1 ZINC000426737811 1026520099 /nfs/dbraw/zinc/52/00/99/1026520099.db2.gz QLFJMZBBFLKYFD-SFHVURJKSA-N -1 3 347.842 4.290 20 0 EIADHM CC1(C)CCC[C@H]([N-]S(=O)(=O)c2cccc(Cl)c2Cl)C1 ZINC001211543804 1026547515 /nfs/dbraw/zinc/54/75/15/1026547515.db2.gz OXNVOJLZVSYZHB-JTQLQIEISA-N -1 3 336.284 4.241 20 0 EIADHM Cc1cc(C(F)(F)F)ccc1CN[C@H](C(=O)[O-])c1ccc(F)cc1 ZINC000426773544 1026553967 /nfs/dbraw/zinc/55/39/67/1026553967.db2.gz KGWLXTOMAXWFKR-HNNXBMFYSA-N -1 3 341.304 4.068 20 0 EIADHM Cc1cc([C@H](NCc2ccc(OC(C)C)cc2)C(=O)[O-])ccc1Cl ZINC000426804740 1026570943 /nfs/dbraw/zinc/57/09/43/1026570943.db2.gz WFZYAZAWHZOKRE-SFHVURJKSA-N -1 3 347.842 4.351 20 0 EIADHM Cc1ncc(CNC(=O)Nc2c(C(C)C)cccc2C(C)C)c(=O)[n-]1 ZINC000344881174 1026691494 /nfs/dbraw/zinc/69/14/94/1026691494.db2.gz MDEWMYBTBSAZOF-UHFFFAOYSA-N -1 3 342.443 4.059 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)c1cc(-c2ccc(Cl)cc2)c[nH]1 ZINC000427062475 1026706069 /nfs/dbraw/zinc/70/60/69/1026706069.db2.gz RZTMAOWQGLFQEM-UHFFFAOYSA-N -1 3 344.773 4.110 20 0 EIADHM Cc1ncc(CNC(=O)Nc2ccc(C(C)C)cc2C(C)C)c(=O)[n-]1 ZINC000344919844 1026707848 /nfs/dbraw/zinc/70/78/48/1026707848.db2.gz FMSZAJFEGWAGIU-UHFFFAOYSA-N -1 3 342.443 4.059 20 0 EIADHM COCc1cccc(C=C(Cc2ccccc2)c2nccc(=O)[n-]2)c1 ZINC000432701684 1026801381 /nfs/dbraw/zinc/80/13/81/1026801381.db2.gz BPEQFWBOHDDUQY-XMHGGMMESA-N -1 3 332.403 4.112 20 0 EIADHM COc1c(C)cc(C=C(Cc2ccccc2)c2nccc(=O)[n-]2)cc1C ZINC000432703285 1026803009 /nfs/dbraw/zinc/80/30/09/1026803009.db2.gz LHGVUIGSBYQBTB-XMHGGMMESA-N -1 3 346.430 4.179 20 0 EIADHM O=c1ccnc(C(=Cc2cccc(Cl)c2F)Cc2ccccc2)[n-]1 ZINC000432706152 1026805877 /nfs/dbraw/zinc/80/58/77/1026805877.db2.gz KTYPYEKDCZVOHY-NTCAYCPXSA-N -1 3 340.785 4.346 20 0 EIADHM O=C([O-])c1ccoc1CN1CCCCC[C@H]1/C=C\c1cccs1 ZINC000582671548 1026924701 /nfs/dbraw/zinc/92/47/01/1026924701.db2.gz QRIRXFKGQVUKOM-DANTVBBOSA-N -1 3 331.437 4.497 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@@H]3CC[C@H]4CCC[C@@H]4C3)nc2)n1 ZINC000608090888 1027012376 /nfs/dbraw/zinc/01/23/76/1027012376.db2.gz QPYQXEJNNVXWDX-CKEIUWERSA-N -1 3 338.455 4.187 20 0 EIADHM O=C(Nc1ccc([O-])c(C(F)(F)F)c1)c1cc(-c2ccccc2)[nH]n1 ZINC000440991540 1027177173 /nfs/dbraw/zinc/17/71/73/1027177173.db2.gz RCYQFSAMHHYBKS-UHFFFAOYSA-N -1 3 347.296 4.053 20 0 EIADHM [O-]c1cccc(CNC[C@H](OC2CCCC2)C(F)(F)F)c1Cl ZINC000657587620 1027214401 /nfs/dbraw/zinc/21/44/01/1027214401.db2.gz FTGULEZIYIUKMK-ZDUSSCGKSA-N -1 3 337.769 4.025 20 0 EIADHM Cc1ccc(C)c(OCCCCC(=O)[N-]OCc2ccccc2)c1 ZINC000303028556 1027458097 /nfs/dbraw/zinc/45/80/97/1027458097.db2.gz QOJOACTYXWSXSO-UHFFFAOYSA-N -1 3 327.424 4.101 20 0 EIADHM O=C([O-])CC[C@H]1CCCCN1Cc1coc(-c2ccc(Cl)cc2)n1 ZINC000392045883 1027463615 /nfs/dbraw/zinc/46/36/15/1027463615.db2.gz MRAQLTPISBMPMT-MRXNPFEDSA-N -1 3 348.830 4.214 20 0 EIADHM O=c1nc(COc2ccccc2)[n-]c2scc(-c3ccccc3)c21 ZINC000041864303 1027557854 /nfs/dbraw/zinc/55/78/54/1027557854.db2.gz WGVGPUBHYVRJDH-UHFFFAOYSA-N -1 3 334.400 4.231 20 0 EIADHM O=C([N-]c1c(F)cccc1F)c1cc(Br)c(F)cc1F ZINC000192045953 1027895772 /nfs/dbraw/zinc/89/57/72/1027895772.db2.gz KIRPCDFJCSIDNW-UHFFFAOYSA-N -1 3 348.093 4.258 20 0 EIADHM [O-]c1cccc(CN(Cc2ccccc2)C[C@H]2CCCO2)c1Cl ZINC000507750913 1027978848 /nfs/dbraw/zinc/97/88/48/1027978848.db2.gz WAAUGUSZKQFFDC-QGZVFWFLSA-N -1 3 331.843 4.227 20 0 EIADHM [O-]c1cccc(CN(Cc2ccccc2)C[C@@H]2CCCO2)c1Cl ZINC000507750911 1027979159 /nfs/dbraw/zinc/97/91/59/1027979159.db2.gz WAAUGUSZKQFFDC-KRWDZBQOSA-N -1 3 331.843 4.227 20 0 EIADHM CCc1ccc(C(=O)N(C)[C@@H](C)c2nc3ccccc3s2)c([O-])c1 ZINC000188626136 1028011149 /nfs/dbraw/zinc/01/11/49/1028011149.db2.gz OTQAZPGOORGPEN-LBPRGKRZSA-N -1 3 340.448 4.398 20 0 EIADHM CCc1ccc(C(=O)N2CC=C(c3c[nH]c4ccccc43)CC2)c([O-])c1 ZINC000188847721 1028028894 /nfs/dbraw/zinc/02/88/94/1028028894.db2.gz AEEFMDNUFDEHOH-UHFFFAOYSA-N -1 3 346.430 4.365 20 0 EIADHM O=C([O-])[C@H](NCc1cccc(-c2ccccc2)c1)c1cccc(F)c1 ZINC000426813109 1028090106 /nfs/dbraw/zinc/09/01/06/1028090106.db2.gz VEGZQKPQYDFNAU-HXUWFJFHSA-N -1 3 335.378 4.408 20 0 EIADHM CN(C(=O)NCc1ccc([O-])c(F)c1)[C@H]1CCC[C@H]1c1ccccc1 ZINC000458426861 1028238090 /nfs/dbraw/zinc/23/80/90/1028238090.db2.gz UBGUFYSVYVDMLU-WMZOPIPTSA-N -1 3 342.414 4.009 20 0 EIADHM Cc1ccc([O-])c(CN2CCC[C@@]2(c2ccccc2)C(F)(F)F)n1 ZINC000428395936 1028427810 /nfs/dbraw/zinc/42/78/10/1028427810.db2.gz AYCSWZBVBYQLFQ-QGZVFWFLSA-N -1 3 336.357 4.149 20 0 EIADHM Cc1nn(C(C)C)cc1C=C(Cc1ccccc1)c1nccc(=O)[n-]1 ZINC000346674931 1028596404 /nfs/dbraw/zinc/59/64/04/1028596404.db2.gz WEEQFNVBXZPYRQ-SFQUDFHCSA-N -1 3 334.423 4.051 20 0 EIADHM CCn1c2ccccc2nc1[C@H]1CCCN1C(=O)c1ccc(C)cc1[O-] ZINC000157317538 1028801970 /nfs/dbraw/zinc/80/19/70/1028801970.db2.gz XVQNCVKTYKHCJE-GOSISDBHSA-N -1 3 349.434 4.048 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1ccn(-c2ccc(Cl)cc2)n1 ZINC000536057798 1028833007 /nfs/dbraw/zinc/83/30/07/1028833007.db2.gz PUNRIOOWWYTUCI-UHFFFAOYSA-N -1 3 348.189 4.137 20 0 EIADHM O=C(c1cc([O-])ccc1Cl)N1CC=C(c2c(F)cccc2F)CC1 ZINC000346998232 1028836761 /nfs/dbraw/zinc/83/67/61/1028836761.db2.gz RURFQGGTQOOPKS-UHFFFAOYSA-N -1 3 349.764 4.253 20 0 EIADHM Cc1cc(=O)[n-]c([C@@H](C)N[C@H](c2ccc(Cl)cc2F)C(C)C)n1 ZINC000192774989 1029387783 /nfs/dbraw/zinc/38/77/83/1029387783.db2.gz LMMBKRCIOSDFBG-BZNIZROVSA-N -1 3 337.826 4.331 20 0 EIADHM CC(=O)c1cccc(NC(=O)c2ccccc2COC(C)(C)C)c1[O-] ZINC000584055967 1029577643 /nfs/dbraw/zinc/57/76/43/1029577643.db2.gz YOOPYKYFCOVZFZ-UHFFFAOYSA-N -1 3 341.407 4.162 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(NCC[C@@H]3CCC(F)(F)C3)nc2)n1 ZINC000897239748 1029605665 /nfs/dbraw/zinc/60/56/65/1029605665.db2.gz NXWRZJGHKSQTRB-LBPRGKRZSA-N -1 3 348.397 4.044 20 0 EIADHM CC(C)N(Cc1csc(-c2ccc(C(=O)[O-])cc2)n1)CC1CC1 ZINC000565104714 1029624533 /nfs/dbraw/zinc/62/45/33/1029624533.db2.gz VMIKAPYFAJCROC-UHFFFAOYSA-N -1 3 330.453 4.129 20 0 EIADHM CC1(C)CN([C@H](C(=O)[O-])c2cccc(Cl)c2)CC[C@H]1C(F)(F)F ZINC000584178023 1029661187 /nfs/dbraw/zinc/66/11/87/1029661187.db2.gz XQOJQGKWLMMIAK-OLZOCXBDSA-N -1 3 349.780 4.376 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(NC[C@@H]3CCCC[C@@H]3C)nc2)n1 ZINC000301183063 1029682709 /nfs/dbraw/zinc/68/27/09/1029682709.db2.gz RBEOGYOFTRDDFF-KBPBESRZSA-N -1 3 326.444 4.045 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N3CCC(CC(C)C)CC3)nc2)n1 ZINC000301631605 1029777065 /nfs/dbraw/zinc/77/70/65/1029777065.db2.gz CSHGFFHJFHDLIX-UHFFFAOYSA-N -1 3 340.471 4.069 20 0 EIADHM Fc1cccnc1C[N-]c1nc(-c2cc(Cl)cc(Cl)c2)no1 ZINC000301803915 1029811623 /nfs/dbraw/zinc/81/16/23/1029811623.db2.gz UOVZBEZZQWVJJY-UHFFFAOYSA-N -1 3 339.157 4.190 20 0 EIADHM O=C(Nc1cccc([O-])c1F)c1ccc(OCc2ccccc2)cc1 ZINC000128271622 1029888608 /nfs/dbraw/zinc/88/86/08/1029888608.db2.gz PFWLZBDABFKRJX-UHFFFAOYSA-N -1 3 337.350 4.363 20 0 EIADHM CC(C)c1ncc(C(=O)[N-]c2nc(-c3cccs3)ns2)s1 ZINC000182132601 1029948031 /nfs/dbraw/zinc/94/80/31/1029948031.db2.gz UIRXMURUEYBLDU-UHFFFAOYSA-N -1 3 336.467 4.099 20 0 EIADHM O=C([O-])c1ccccc1OCCN1CCC[C@H]1c1cccc(Cl)c1 ZINC000183914468 1030042211 /nfs/dbraw/zinc/04/22/11/1030042211.db2.gz IZXNCDMPBOXXQC-KRWDZBQOSA-N -1 3 345.826 4.254 20 0 EIADHM CCOc1ccc([C@H](C)NCc2ccc(C(=O)[O-])cc2)cc1OCC ZINC000262956005 1030105254 /nfs/dbraw/zinc/10/52/54/1030105254.db2.gz BHQSOKWRLCXAMC-AWEZNQCLSA-N -1 3 343.423 4.033 20 0 EIADHM C[C@H]1CC(C(=O)[O-])C[C@H](C)N1CCc1cc(Cl)cc(Cl)c1 ZINC000530173130 1030192562 /nfs/dbraw/zinc/19/25/62/1030192562.db2.gz CRTFCTLAUXDXBM-QWRGUYRKSA-N -1 3 330.255 4.110 20 0 EIADHM C[C@@H]1CC(C(=O)[O-])C[C@@H](C)N1CCc1cccc(Cl)c1Cl ZINC000530178121 1030198202 /nfs/dbraw/zinc/19/82/02/1030198202.db2.gz YNXDKCYWRUFMBH-GHMZBOCLSA-N -1 3 330.255 4.110 20 0 EIADHM C[C@@H]1C[C@@H](C(=O)[O-])C[C@H](C)N1Cc1csc(-c2ccc(F)cc2)n1 ZINC000530178465 1030201353 /nfs/dbraw/zinc/20/13/53/1030201353.db2.gz JEPPJCRNZXYMGH-DABQJJPHSA-N -1 3 348.443 4.023 20 0 EIADHM O=c1[n-]c(CSC2(CO)CCCCC2)nc2c3ccccc3oc21 ZINC000451055798 1030206164 /nfs/dbraw/zinc/20/61/64/1030206164.db2.gz FQYLLGMGDVIOFW-UHFFFAOYSA-N -1 3 344.436 4.010 20 0 EIADHM C[C@H]1c2c(F)cccc2CCN1C(=O)CCCc1ccc([O-])c(F)c1 ZINC000527045997 1030425472 /nfs/dbraw/zinc/42/54/72/1030425472.db2.gz NTJAEYJDIWWWFO-ZDUSSCGKSA-N -1 3 345.389 4.139 20 0 EIADHM CN(C)c1cccc([C@@H]2CCCN2Cc2c(F)ccc([O-])c2F)c1 ZINC000508646721 1030547491 /nfs/dbraw/zinc/54/74/91/1030547491.db2.gz UQPRUXGDNDCRJP-KRWDZBQOSA-N -1 3 332.394 4.074 20 0 EIADHM CC(C)Sc1ccccc1[N-]C(=O)c1cc(-c2ccncc2)on1 ZINC000122054056 1030612754 /nfs/dbraw/zinc/61/27/54/1030612754.db2.gz SYPZFMIFMHQOFH-UHFFFAOYSA-N -1 3 339.420 4.489 20 0 EIADHM O=C(Nc1cc(F)ccc1[O-])c1ccc(COc2ccccc2)cc1 ZINC000530658150 1030630828 /nfs/dbraw/zinc/63/08/28/1030630828.db2.gz RNRSBHDTNVTDFG-UHFFFAOYSA-N -1 3 337.350 4.363 20 0 EIADHM Cc1ccc2cccc(S(=O)(=O)[N-]c3cccc(C)c3Cl)c2n1 ZINC000530771373 1030703970 /nfs/dbraw/zinc/70/39/70/1030703970.db2.gz XYDKWSWHHSHPRV-UHFFFAOYSA-N -1 3 346.839 4.306 20 0 EIADHM CCS[C@H]1CCC[C@@H](NC(=O)c2cc([O-])c3ccccc3c2)C1 ZINC000527467680 1030707507 /nfs/dbraw/zinc/70/75/07/1030707507.db2.gz PERNNFVJPBIELH-CVEARBPZSA-N -1 3 329.465 4.340 20 0 EIADHM [O-]c1cc(Br)cnc1O[C@@H]1CCc2cc(Cl)ccc21 ZINC001228956935 1030744461 /nfs/dbraw/zinc/74/44/61/1030744461.db2.gz SLEVNOZNXFJSOS-CYBMUJFWSA-N -1 3 340.604 4.269 20 0 EIADHM C[C@H]([N-]S(=O)(=O)c1c(F)cccc1F)c1cccc2ccccc21 ZINC000007308751 1030783063 /nfs/dbraw/zinc/78/30/63/1030783063.db2.gz HRKXCQITPOQAHA-LBPRGKRZSA-N -1 3 347.386 4.158 20 0 EIADHM C[C@@H]1C[C@H](C(=O)[O-])CCN1CCSc1cc(Cl)ccc1Cl ZINC000235356572 1030839297 /nfs/dbraw/zinc/83/92/97/1030839297.db2.gz KGHSELMFVCYIFM-GHMZBOCLSA-N -1 3 348.295 4.271 20 0 EIADHM Cc1nc([C@@H](C)N(C)C[C@H](C)C(=O)[O-])oc1-c1ccc(Cl)cc1 ZINC000263392905 1030843450 /nfs/dbraw/zinc/84/34/50/1030843450.db2.gz YZPYRDKUFXGUKN-CMPLNLGQSA-N -1 3 336.819 4.017 20 0 EIADHM O=C([O-])[C@H]1CCN(Cc2c(Cl)cccc2Oc2ccccc2)C1 ZINC000263420582 1030862556 /nfs/dbraw/zinc/86/25/56/1030862556.db2.gz OTIPCAZQXUOBCE-ZDUSSCGKSA-N -1 3 331.799 4.039 20 0 EIADHM O=C(Cc1ccc([O-])c(F)c1)N1CCCCC[C@H]1c1ccccc1 ZINC000448734716 1031019365 /nfs/dbraw/zinc/01/93/65/1031019365.db2.gz HRBGXPHAAMLZQA-SFHVURJKSA-N -1 3 327.399 4.218 20 0 EIADHM O=C(Cc1ccc([O-])c(F)c1)N1CCC[C@@H]1c1cccc(Cl)c1 ZINC000448740546 1031025235 /nfs/dbraw/zinc/02/52/35/1031025235.db2.gz VIDHHOTYMADCPV-MRXNPFEDSA-N -1 3 333.790 4.091 20 0 EIADHM Cc1cc(Nc2cc(Br)cc(F)c2[O-])cc(C)c1O ZINC001211916833 1031069767 /nfs/dbraw/zinc/06/97/67/1031069767.db2.gz JJSTXJFWOOPPFO-UHFFFAOYSA-N -1 3 326.165 4.360 20 0 EIADHM CCN(C(=O)Cc1ccc([O-])c(F)c1)[C@@H](C)c1cc2ccccc2o1 ZINC000448779838 1031088428 /nfs/dbraw/zinc/08/84/28/1031088428.db2.gz HRLBENWZGBHNPO-ZDUSSCGKSA-N -1 3 341.382 4.430 20 0 EIADHM O=C(c1cc(Oc2ccccc2)ccc1[O-])N1CCC(CF)CC1 ZINC000452591951 1031139795 /nfs/dbraw/zinc/13/97/95/1031139795.db2.gz CIHJSGLLTPZPMC-UHFFFAOYSA-N -1 3 329.371 4.006 20 0 EIADHM CCc1ccc([O-])c(C(=O)Nc2ccc(Oc3nccc(C)n3)cc2)c1 ZINC000531483766 1031306759 /nfs/dbraw/zinc/30/67/59/1031306759.db2.gz NGUBTZDWJLTZAL-UHFFFAOYSA-N -1 3 349.390 4.098 20 0 EIADHM O=C(NC[C@H]1CCCC[C@@H]1C(F)(F)F)c1cc([O-])ccc1Cl ZINC000685772684 1031480493 /nfs/dbraw/zinc/48/04/93/1031480493.db2.gz DSKQDIGIXUDQIH-SKDRFNHKSA-N -1 3 335.753 4.144 20 0 EIADHM Cc1cc(Cl)ccc1C(=O)Nc1ccc(Br)cc1[O-] ZINC000532007844 1031949533 /nfs/dbraw/zinc/94/95/33/1031949533.db2.gz JAJWAPLJKAKCLQ-UHFFFAOYSA-N -1 3 340.604 4.369 20 0 EIADHM Cc1cc(Cl)ccc1C(=O)Nc1cc(Br)ccc1[O-] ZINC000532013139 1031978627 /nfs/dbraw/zinc/97/86/27/1031978627.db2.gz SAKLPTPZOAWUOT-UHFFFAOYSA-N -1 3 340.604 4.369 20 0 EIADHM [O-]c1cccc(CN2CCC[C@]3(C2)OCc2ccccc23)c1Cl ZINC000512683366 1033702214 /nfs/dbraw/zinc/70/22/14/1033702214.db2.gz QTORPBFUZZAVGP-LJQANCHMSA-N -1 3 329.827 4.067 20 0 EIADHM Cc1cc(F)cc2c(=O)c(C(=O)Nc3ccc(Cl)c(F)c3)c[n-]c12 ZINC000433305631 1034198184 /nfs/dbraw/zinc/19/81/84/1034198184.db2.gz QJCPCCNAGWNKSD-UHFFFAOYSA-N -1 3 348.736 4.020 20 0 EIADHM COc1ccccc1-c1nc(C(=O)[N-]c2c(F)cccc2F)cs1 ZINC000058609974 1034784186 /nfs/dbraw/zinc/78/41/86/1034784186.db2.gz RULUEEJXZAXKPT-UHFFFAOYSA-N -1 3 346.358 4.349 20 0 EIADHM CC(C)n1c2ccccc2nc1[C@@H]1CCCN1CCCCC(=O)[O-] ZINC000262301904 1034898936 /nfs/dbraw/zinc/89/89/36/1034898936.db2.gz ZXBPSNDAMKRWAB-KRWDZBQOSA-N -1 3 329.444 4.009 20 0 EIADHM Cc1ccc2oc([N-][C@@H](c3nccn3C)c3cccc(F)c3)nc2c1 ZINC000513650162 1035080401 /nfs/dbraw/zinc/08/04/01/1035080401.db2.gz JYRGALXUFKZJEH-QGZVFWFLSA-N -1 3 336.370 4.210 20 0 EIADHM O=c1nc(-c2ccncn2)[n-]c2scc(-c3ccccc3Cl)c21 ZINC000345345831 1035203405 /nfs/dbraw/zinc/20/34/05/1035203405.db2.gz MSDRLIKDKYXBIJ-UHFFFAOYSA-N -1 3 340.795 4.174 20 0 EIADHM CC1=C(C)CN(Cc2nc(=O)c3c(-c4ccco4)csc3[n-]2)CC1 ZINC000280693620 1035321289 /nfs/dbraw/zinc/32/12/89/1035321289.db2.gz HVUJZBQRAZJJQA-UHFFFAOYSA-N -1 3 341.436 4.199 20 0 EIADHM CCCNc1ccc(CNCc2cccc([O-])c2Br)cc1 ZINC000419700458 1035401374 /nfs/dbraw/zinc/40/13/74/1035401374.db2.gz XMPBRHABOWKPIF-UHFFFAOYSA-N -1 3 349.272 4.266 20 0 EIADHM CCS[C@H]1CCC[C@@H](NC(=O)CCCc2ccc([O-])c(F)c2)C1 ZINC000469145409 1035437453 /nfs/dbraw/zinc/43/74/53/1035437453.db2.gz FQCYIFJRUGOGHN-CABCVRRESA-N -1 3 339.476 4.035 20 0 EIADHM Cc1nc(C(C)C)ccc1C(=O)Nc1cc(Br)ccc1[O-] ZINC000490678542 1035597434 /nfs/dbraw/zinc/59/74/34/1035597434.db2.gz ZTMKOCRUKARFEY-UHFFFAOYSA-N -1 3 349.228 4.234 20 0 EIADHM Cc1cccc(C(=O)Nc2cccc(COCc3ccco3)c2)c1[O-] ZINC000195645510 1035875966 /nfs/dbraw/zinc/87/59/66/1035875966.db2.gz UPQPZEGXGWWCLZ-UHFFFAOYSA-N -1 3 337.375 4.263 20 0 EIADHM [O-]c1ccc(F)c(CNc2ncc(Cc3ccccc3)s2)c1F ZINC000571013418 1035919193 /nfs/dbraw/zinc/91/91/93/1035919193.db2.gz OBSWVODSXHXCAC-UHFFFAOYSA-N -1 3 332.375 4.330 20 0 EIADHM O=C(Cc1c[nH]c2cccc(Cl)c12)Nc1cc(Cl)ccc1[O-] ZINC000485502419 1035957768 /nfs/dbraw/zinc/95/77/68/1035957768.db2.gz IEJGWYDNIOEIFQ-UHFFFAOYSA-N -1 3 335.190 4.362 20 0 EIADHM CC[C@H]1CCc2c(sc3nc(-c4ccnc(Cl)c4)[n-]c(=O)c23)C1 ZINC000055494640 1036071696 /nfs/dbraw/zinc/07/16/96/1036071696.db2.gz PQUMYISTSNRKAK-VIFPVBQESA-N -1 3 345.855 4.215 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@@H]3CCc4cc(C)ccc43)nc2)n1 ZINC000597924935 1036388907 /nfs/dbraw/zinc/38/89/07/1036388907.db2.gz AYVGSLGDNRZNKJ-GOSISDBHSA-N -1 3 346.434 4.214 20 0 EIADHM CC(C)[C@]1(C(=O)[O-])CCN(Cc2csc(C3CCCCC3)n2)C1 ZINC000572048834 1036402722 /nfs/dbraw/zinc/40/27/22/1036402722.db2.gz ISCQLOWSLSPMCY-SFHVURJKSA-N -1 3 336.501 4.124 20 0 EIADHM C[C@@H](/N=C/c1cc(Br)ccc1[O-])c1ccc(C#N)cc1 ZINC000032069094 1036454019 /nfs/dbraw/zinc/45/40/19/1036454019.db2.gz IJUKARZWEKKHJC-VURRPDKYSA-N -1 3 329.197 4.206 20 0 EIADHM Cc1nc(C(C)C)oc1C(=O)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000486101654 1036472604 /nfs/dbraw/zinc/47/26/04/1036472604.db2.gz BFJVQPDAZSFUCB-UHFFFAOYSA-N -1 3 328.290 4.083 20 0 EIADHM Cc1ccc(-c2nsc([N-]C(=O)c3cc(F)cc(F)c3)n2)s1 ZINC000589358480 1036764810 /nfs/dbraw/zinc/76/48/10/1036764810.db2.gz NWVQJZGRHRDGRD-UHFFFAOYSA-N -1 3 337.376 4.106 20 0 EIADHM CCCC[C@@H](C)N(C)C(=O)c1c[n-]c(=NC(=O)OC(C)(C)C)s1 ZINC000908305508 1036834661 /nfs/dbraw/zinc/83/46/61/1036834661.db2.gz OXFFIAYUYNCYEY-LLVKDONJSA-N -1 3 341.477 4.141 20 0 EIADHM O=C(N=c1cc(-c2cccc(Cl)c2)[n-][nH]1)c1coc2ccccc12 ZINC000603547373 1036886060 /nfs/dbraw/zinc/88/60/60/1036886060.db2.gz OTCPBNVKPODSNW-UHFFFAOYSA-N -1 3 337.766 4.151 20 0 EIADHM CC(=O)c1cc(F)c([N-]C(=O)c2csc(CC(C)C)n2)c(F)c1 ZINC000271970413 1037067643 /nfs/dbraw/zinc/06/76/43/1037067643.db2.gz DNZARZBTAKVBQX-UHFFFAOYSA-N -1 3 338.379 4.075 20 0 EIADHM CO[C@H](C)c1cccc(NCc2cc(=O)oc3c(C)c([O-])ccc23)c1 ZINC000171091070 1037103255 /nfs/dbraw/zinc/10/32/55/1037103255.db2.gz OZCHUNGXYLHYNK-CYBMUJFWSA-N -1 3 339.391 4.127 20 0 EIADHM O=C(Nc1cccc(Cl)c1[O-])c1cn[nH]c1-c1ccc(Cl)cc1 ZINC000604266516 1037321581 /nfs/dbraw/zinc/32/15/81/1037321581.db2.gz PSCBYGBNNLHMMM-UHFFFAOYSA-N -1 3 348.189 4.341 20 0 EIADHM CC(C)CC[C@H](NC(=O)c1cc(=O)c2ccccc2[n-]1)C(C)(C)C ZINC000604364433 1037353484 /nfs/dbraw/zinc/35/34/84/1037353484.db2.gz WASNIMYMGRYMMS-SFHVURJKSA-N -1 3 328.456 4.109 20 0 EIADHM CCCc1ccccc1[N-]S(=O)(=O)c1ccc(OC)c(C)c1C ZINC000604971467 1037595226 /nfs/dbraw/zinc/59/52/26/1037595226.db2.gz QMTJAZFADVCIIR-UHFFFAOYSA-N -1 3 333.453 4.065 20 0 EIADHM C[C@@H]1CCN([C@@H](C(=O)[O-])c2ccc(Cl)c(Cl)c2)CC1(C)C ZINC000573616241 1037601877 /nfs/dbraw/zinc/60/18/77/1037601877.db2.gz ICXAPEKQDKFABR-QMTHXVAHSA-N -1 3 330.255 4.487 20 0 EIADHM COc1cccc(SCc2cc(=O)oc3c(C)c([O-])ccc23)c1 ZINC000058627371 1037891895 /nfs/dbraw/zinc/89/18/95/1037891895.db2.gz PWQQIFQDASMTNR-UHFFFAOYSA-N -1 3 328.389 4.108 20 0 EIADHM CCSc1cccc(F)c1[N-]S(=O)(=O)c1cccc(F)c1C ZINC000574093205 1037934735 /nfs/dbraw/zinc/93/47/35/1037934735.db2.gz GGRQYXSCWMPLMP-UHFFFAOYSA-N -1 3 343.420 4.186 20 0 EIADHM O=C(CC(c1ccccc1)c1ccccc1)NCc1ccc([O-])c(F)c1 ZINC000606537056 1038154436 /nfs/dbraw/zinc/15/44/36/1038154436.db2.gz CBUYJACAGNECHF-UHFFFAOYSA-N -1 3 349.405 4.370 20 0 EIADHM Cc1csc2nc(-c3ccc(OC(F)(F)F)cc3)[n-]c(=O)c12 ZINC000504474475 1038380142 /nfs/dbraw/zinc/38/01/42/1038380142.db2.gz WCBUSRCHNKXYMN-UHFFFAOYSA-N -1 3 326.299 4.271 20 0 EIADHM O=S(=O)([N-][C@@H](CC1CC1)c1ccccc1)c1ccc(Cl)s1 ZINC000608036805 1038431757 /nfs/dbraw/zinc/43/17/57/1038431757.db2.gz XUCSXPVSSKTXBI-ZDUSSCGKSA-N -1 3 341.885 4.221 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@@H]3CC[C@@H]4CCC[C@@H]4C3)nc2)n1 ZINC000608090890 1038590418 /nfs/dbraw/zinc/59/04/18/1038590418.db2.gz QPYQXEJNNVXWDX-JJRVBVJISA-N -1 3 338.455 4.187 20 0 EIADHM COc1c(C)ccc([N-]S(=O)(=O)c2c(C)cc(C)cc2C)c1C ZINC000031722691 1038853854 /nfs/dbraw/zinc/85/38/54/1038853854.db2.gz AIKKZHRIAOJYSJ-UHFFFAOYSA-N -1 3 333.453 4.038 20 0 EIADHM Cc1ccccc1-c1nnsc1C(=O)[N-]c1nc(C(C)(C)C)co1 ZINC000899215664 1038879896 /nfs/dbraw/zinc/87/98/96/1038879896.db2.gz JQFIHOUDMPMRPP-UHFFFAOYSA-N -1 3 342.424 4.051 20 0 EIADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)[C@@H]3CCCC[C@H]3C)c2)n1 ZINC000424597205 1038923485 /nfs/dbraw/zinc/92/34/85/1038923485.db2.gz HJRVDYJIKASBFU-CXAGYDPISA-N -1 3 339.439 4.176 20 0 EIADHM CSCCc1ccc([N-]S(=O)(=O)c2cc(C)ccc2C)cc1 ZINC000609016113 1038994498 /nfs/dbraw/zinc/99/44/98/1038994498.db2.gz YMYLMHDTJHNGLB-UHFFFAOYSA-N -1 3 335.494 4.010 20 0 EIADHM CC(=O)c1cccc(NC(=O)c2cccc3c4c([nH]c32)CCCC4)c1[O-] ZINC000552069134 1039094958 /nfs/dbraw/zinc/09/49/58/1039094958.db2.gz CZUCYFJXMXVEBS-UHFFFAOYSA-N -1 3 348.402 4.207 20 0 EIADHM O=C(Nc1ccc([O-])c(C(F)(F)F)c1)[C@H]1CC[C@H](C(F)(F)F)C1 ZINC000552116036 1039146208 /nfs/dbraw/zinc/14/62/08/1039146208.db2.gz ZVQZDQPHPIRIOB-YUMQZZPRSA-N -1 3 341.251 4.328 20 0 EIADHM O=C(Cc1c[nH]c2ccc(Cl)cc12)Nc1c([O-])cccc1Cl ZINC000552434302 1039509607 /nfs/dbraw/zinc/50/96/07/1039509607.db2.gz IQCYAVPQCAHORN-UHFFFAOYSA-N -1 3 335.190 4.362 20 0 EIADHM C[C@H](CC(=O)Nc1c([O-])cccc1Cl)c1ccc(F)cc1F ZINC000552436726 1039516423 /nfs/dbraw/zinc/51/64/23/1039516423.db2.gz UGXUPAJHTPAODU-SECBINFHSA-N -1 3 325.742 4.456 20 0 EIADHM CC(C)COc1cccc(OCC(=O)Nc2c([O-])cccc2Cl)c1 ZINC000552434641 1039517786 /nfs/dbraw/zinc/51/77/86/1039517786.db2.gz TVAXIZXKLLCFOI-UHFFFAOYSA-N -1 3 349.814 4.098 20 0 EIADHM [O-]c1ccc(F)c(CN2CC[C@@H](CSc3ccccc3)C2)c1F ZINC000508837397 1039766968 /nfs/dbraw/zinc/76/69/68/1039766968.db2.gz MWTXMXGOLOPWLP-CYBMUJFWSA-N -1 3 335.419 4.285 20 0 EIADHM Oc1[n-]c(SCc2ccc(-c3cccs3)cc2)nc2nncc1-2 ZINC000434655671 1039781431 /nfs/dbraw/zinc/78/14/31/1039781431.db2.gz UZPKBDXZULSXNP-UHFFFAOYSA-N -1 3 340.433 4.079 20 0 EIADHM O=C(Nc1c([O-])cccc1Cl)c1cnc(-c2ccsc2)s1 ZINC000552781544 1039816839 /nfs/dbraw/zinc/81/68/39/1039816839.db2.gz KXWJQQAQGFXPHC-UHFFFAOYSA-N -1 3 336.825 4.483 20 0 EIADHM Cc1nc(-c2ccccc2)ncc1C(=O)Nc1c([O-])cccc1Cl ZINC000552782565 1039817084 /nfs/dbraw/zinc/81/70/84/1039817084.db2.gz TZEKGVRJMFQOGV-UHFFFAOYSA-N -1 3 339.782 4.063 20 0 EIADHM O=C(Nc1cccc([O-])c1F)c1cc2c(s1)-c1ccccc1OC2 ZINC000534945939 1039865779 /nfs/dbraw/zinc/86/57/79/1039865779.db2.gz ZVTWLRNRAXAGEB-UHFFFAOYSA-N -1 3 341.363 4.405 20 0 EIADHM CCS[C@@H]1CCCC[C@@H]1NC(=O)CCCc1ccc([O-])c(F)c1 ZINC000469251535 1039866873 /nfs/dbraw/zinc/86/68/73/1039866873.db2.gz RHDZVSVZNILJLA-DOTOQJQBSA-N -1 3 339.476 4.035 20 0 EIADHM O=C(Nc1ccc(Br)cc1[O-])c1ccc(Cl)c(F)c1 ZINC000535023763 1039889542 /nfs/dbraw/zinc/88/95/42/1039889542.db2.gz DRXDGXFHKGNNTJ-UHFFFAOYSA-N -1 3 344.567 4.200 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)NC[C@@H]1CCCCC(F)(F)C1 ZINC000552997481 1039898467 /nfs/dbraw/zinc/89/84/67/1039898467.db2.gz MULJXUNQUOAGRT-CQSZACIVSA-N -1 3 343.389 4.186 20 0 EIADHM CC(C)(C)c1ccc2cc(C(=O)Nc3n[n-]c(-c4ccco4)n3)[nH]c2c1 ZINC000514496578 1039934255 /nfs/dbraw/zinc/93/42/55/1039934255.db2.gz BRTKOPVJQFUUED-UHFFFAOYSA-N -1 3 349.394 4.096 20 0 EIADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)[C@@H](CC)CC(F)F)c2)n1 ZINC000457469865 1040038129 /nfs/dbraw/zinc/03/81/29/1040038129.db2.gz VRTYVUKDMZYRQW-NSHDSACASA-N -1 3 349.381 4.032 20 0 EIADHM O=C(Nc1cc(F)ccc1[O-])c1ccccc1CCC(F)(F)F ZINC000535420429 1040252969 /nfs/dbraw/zinc/25/29/69/1040252969.db2.gz NSOVTRKAPKYRLT-UHFFFAOYSA-N -1 3 327.277 4.279 20 0 EIADHM Cc1ccccc1C1(C(=O)Nc2cc(Br)ccc2[O-])CC1 ZINC000535413658 1040261010 /nfs/dbraw/zinc/26/10/10/1040261010.db2.gz HUUQFRYKYSZILP-UHFFFAOYSA-N -1 3 346.224 4.133 20 0 EIADHM COc1cccc([C@@H](C)NCc2cccc([O-])c2Br)c1 ZINC000315444960 1040335023 /nfs/dbraw/zinc/33/50/23/1040335023.db2.gz VRVAXRIKKKKEIE-LLVKDONJSA-N -1 3 336.229 4.014 20 0 EIADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)C(C)(C)CC(C)C)c2)n1 ZINC000084528462 1040583242 /nfs/dbraw/zinc/58/32/42/1040583242.db2.gz QRYOWFVIHCFXIK-UHFFFAOYSA-N -1 3 341.455 4.010 20 0 EIADHM C[C@H]1CCN(Cc2nc(=O)c3sccc3[n-]2)CC12CCCCC2 ZINC000462464573 1040621386 /nfs/dbraw/zinc/62/13/86/1040621386.db2.gz PRACGLQPTYOTPT-ZDUSSCGKSA-N -1 3 331.485 4.189 20 0 EIADHM Cc1ccccc1OCc1nc(=O)c2c(CC(C)C)csc2[n-]1 ZINC000479754918 1040628904 /nfs/dbraw/zinc/62/89/04/1040628904.db2.gz NBRQEMZMPMAVDD-UHFFFAOYSA-N -1 3 328.437 4.483 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)N1CCCC[C@@H]1c1ccc(F)cc1 ZINC000483810434 1041019906 /nfs/dbraw/zinc/01/99/06/1041019906.db2.gz ZENSIXLSGXITSL-QGZVFWFLSA-N -1 3 346.377 4.107 20 0 EIADHM COc1ccc(Cl)c(S(=O)(=O)[N-]c2c(C)cccc2Cl)c1 ZINC000461127155 1041256216 /nfs/dbraw/zinc/25/62/16/1041256216.db2.gz KDDITITWQHKYDH-UHFFFAOYSA-N -1 3 346.235 4.111 20 0 EIADHM O=C([O-])C[C@H](NCc1ccc(C(F)(F)F)s1)c1cccs1 ZINC000904006581 1041269703 /nfs/dbraw/zinc/26/97/03/1041269703.db2.gz XTAASOXTFFSKDJ-VIFPVBQESA-N -1 3 335.372 4.134 20 0 EIADHM Cc1ccc(C(=O)N2CCC(F)(c3ccc(Cl)cc3)CC2)c([O-])c1 ZINC000436494281 1041280006 /nfs/dbraw/zinc/28/00/06/1041280006.db2.gz LCPYIXNTJRPZPI-UHFFFAOYSA-N -1 3 347.817 4.455 20 0 EIADHM O=C([O-])C[C@H](CCc1ccccc1)NCc1c(F)cccc1Cl ZINC000904037817 1041285059 /nfs/dbraw/zinc/28/50/59/1041285059.db2.gz CINUHPUSTQBWHJ-AWEZNQCLSA-N -1 3 335.806 4.045 20 0 EIADHM O=S(=O)([N-]c1cc(F)ccc1Cl)c1csc2ccccc21 ZINC000552019035 1041299574 /nfs/dbraw/zinc/29/95/74/1041299574.db2.gz MIZDWEYWBNDKMT-UHFFFAOYSA-N -1 3 341.816 4.495 20 0 EIADHM CC(=O)c1cc(F)c([N-]C(=O)c2cnc(CC(C)C)s2)c(F)c1 ZINC000904063344 1041312844 /nfs/dbraw/zinc/31/28/44/1041312844.db2.gz HSWGQARGYFQILM-UHFFFAOYSA-N -1 3 338.379 4.075 20 0 EIADHM CCN(CC(F)(F)F)C(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436532839 1041315518 /nfs/dbraw/zinc/31/55/18/1041315518.db2.gz IARKRNNVQLKRPT-UHFFFAOYSA-N -1 3 337.341 4.007 20 0 EIADHM CC(=O)c1ccc(C(=O)NC2CCC(c3ccccc3)CC2)cc1[O-] ZINC000436530098 1041316339 /nfs/dbraw/zinc/31/63/39/1041316339.db2.gz MRDJXHMYBPEXHP-UHFFFAOYSA-N -1 3 337.419 4.051 20 0 EIADHM CN(C(=O)c1cc(Cc2ccccc2)ccc1[O-])C(C1CC1)C1CC1 ZINC000436544670 1041338305 /nfs/dbraw/zinc/33/83/05/1041338305.db2.gz PKNUTKWHNLTVMR-UHFFFAOYSA-N -1 3 335.447 4.244 20 0 EIADHM CC(C)c1ccc(C(=O)N2C[C@H](c3ccccc3)OC[C@H]2C)c([O-])c1 ZINC000436569300 1041349082 /nfs/dbraw/zinc/34/90/82/1041349082.db2.gz CIVOQBGDOYEUQX-FOIQADDNSA-N -1 3 339.435 4.118 20 0 EIADHM CC(C)c1ccc(C(=O)N(C)Cc2nc3c(s2)CCCC3)c([O-])c1 ZINC000436578987 1041357312 /nfs/dbraw/zinc/35/73/12/1041357312.db2.gz YIELMFKBNNALQB-UHFFFAOYSA-N -1 3 344.480 4.123 20 0 EIADHM O=C(c1cc(Cc2ccccc2)ccc1[O-])N1CCC(C(F)F)CC1 ZINC000436598349 1041358692 /nfs/dbraw/zinc/35/86/92/1041358692.db2.gz SWRPEZFFOOXLKI-UHFFFAOYSA-N -1 3 345.389 4.100 20 0 EIADHM O=C(c1cc(CCc2ccccc2)ccc1[O-])N1CCC2(CCC2)C1 ZINC000436587964 1041362748 /nfs/dbraw/zinc/36/27/48/1041362748.db2.gz YNLFLZFORUHKPR-UHFFFAOYSA-N -1 3 335.447 4.194 20 0 EIADHM Cc1cccc(C(=O)Nc2ccccc2NC(=O)c2ccccc2)c1[O-] ZINC000436609581 1041371127 /nfs/dbraw/zinc/37/11/27/1041371127.db2.gz SGNVKUZSSBEDJV-UHFFFAOYSA-N -1 3 346.386 4.205 20 0 EIADHM CC(C)c1ccc(C(=O)NCc2nc3ccccc3s2)c([O-])c1 ZINC000436623729 1041389806 /nfs/dbraw/zinc/38/98/06/1041389806.db2.gz IYIHUYBKUOVPAG-UHFFFAOYSA-N -1 3 326.421 4.055 20 0 EIADHM COc1ccc(C(=O)N(C)Cc2ccccc2-c2ccccc2)c([O-])c1 ZINC000436622934 1041390649 /nfs/dbraw/zinc/39/06/49/1041390649.db2.gz DGJBFROQNGVKFJ-UHFFFAOYSA-N -1 3 347.414 4.340 20 0 EIADHM Cc1nc(-c2ccccc2)sc1[C@H](C)NC(=O)c1ccccc1[O-] ZINC000436666479 1041405711 /nfs/dbraw/zinc/40/57/11/1041405711.db2.gz UAQJUHCSEKAJTC-LBPRGKRZSA-N -1 3 338.432 4.315 20 0 EIADHM CCc1ccc([C@H]2CCCCCN2C(=O)c2ccc(O)cc2[O-])o1 ZINC000436668994 1041408136 /nfs/dbraw/zinc/40/81/36/1041408136.db2.gz GTBZDKHTVVSBHY-MRXNPFEDSA-N -1 3 329.396 4.011 20 0 EIADHM Cc1cccc(CO[N-]C(=O)CCCCCO[C@H]2CCC[C@@H](C)C2)n1 ZINC000898933759 1041414291 /nfs/dbraw/zinc/41/42/91/1041414291.db2.gz GKADXCANTQBIIH-APWZRJJASA-N -1 3 348.487 4.094 20 0 EIADHM CC(C)c1nccn1Cc1cccc(NC(=O)c2ccccc2[O-])c1 ZINC000436713645 1041439551 /nfs/dbraw/zinc/43/95/51/1041439551.db2.gz RGBCBECPZGNNKU-UHFFFAOYSA-N -1 3 335.407 4.013 20 0 EIADHM CC(C)CN(C(=O)c1cc2c(cc1[O-])OCO2)c1ccc(Cl)cc1 ZINC000436585349 1041455369 /nfs/dbraw/zinc/45/53/69/1041455369.db2.gz PPTQUAHJUPTNQL-UHFFFAOYSA-N -1 3 347.798 4.077 20 0 EIADHM CCOc1cc(-c2nc3c(cccc3OC)n2C)cc(Cl)c1[O-] ZINC000436856797 1041506111 /nfs/dbraw/zinc/50/61/11/1041506111.db2.gz URBXYSMTISEQKQ-UHFFFAOYSA-N -1 3 332.787 4.007 20 0 EIADHM O=C(c1ccccc1[O-])N1CCC[C@H](c2cccc(C(F)(F)F)c2)C1 ZINC000436839240 1041506948 /nfs/dbraw/zinc/50/69/48/1041506948.db2.gz NRYZJEWHWLVFFG-AWEZNQCLSA-N -1 3 349.352 4.431 20 0 EIADHM CCc1ccc(-c2nc(CSCc3ccccc3)no2)c([O-])c1 ZINC000436864346 1041523101 /nfs/dbraw/zinc/52/31/01/1041523101.db2.gz YLIABDOELBKEEK-UHFFFAOYSA-N -1 3 326.421 4.438 20 0 EIADHM CCN(CC)[C@@H](c1nc(-c2ccc([O-])cc2F)no1)c1ccccc1 ZINC000436876289 1041533271 /nfs/dbraw/zinc/53/32/71/1041533271.db2.gz XXPZXDVBECAMOP-QGZVFWFLSA-N -1 3 341.386 4.013 20 0 EIADHM Cc1ccc(-c2nc(Cc3c[nH]c4cc(Cl)ccc34)no2)c([O-])c1 ZINC000436918885 1041557349 /nfs/dbraw/zinc/55/73/49/1041557349.db2.gz KXGUGBVFALPGIV-UHFFFAOYSA-N -1 3 339.782 4.476 20 0 EIADHM COc1cccc(C(=O)N(C)c2ccc(Oc3ccccc3)cc2)c1[O-] ZINC000436924815 1041560869 /nfs/dbraw/zinc/56/08/69/1041560869.db2.gz IGHRSVCVDMOPFP-UHFFFAOYSA-N -1 3 349.386 4.470 20 0 EIADHM C[C@H]1CCCN(C(=O)c2cc(Oc3ccccc3)ccc2[O-])CC1 ZINC000436946089 1041569659 /nfs/dbraw/zinc/56/96/59/1041569659.db2.gz COEKFLVCTIWKFX-HNNXBMFYSA-N -1 3 325.408 4.447 20 0 EIADHM Cc1cccc(Oc2ccccc2NC(=O)c2cccc3n[n-]nc32)c1 ZINC000540963249 1041754445 /nfs/dbraw/zinc/75/44/45/1041754445.db2.gz WWBHIMZZFQWIHE-UHFFFAOYSA-N -1 3 344.374 4.311 20 0 EIADHM O=C([O-])CCC1CCN(CCc2cc(Cl)ccc2Cl)CC1 ZINC000516872947 1041790254 /nfs/dbraw/zinc/79/02/54/1041790254.db2.gz VYHUFRZRXIBCNS-UHFFFAOYSA-N -1 3 330.255 4.113 20 0 EIADHM O=C([N-]c1cc(Cl)cc(F)c1F)c1ccoc1C(F)(F)F ZINC000464490826 1042036164 /nfs/dbraw/zinc/03/61/64/1042036164.db2.gz PMEKULYECIOOJR-UHFFFAOYSA-N -1 3 325.620 4.482 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2ccc(C(F)(F)F)c(C)c2)cc1 ZINC000438750200 1042327696 /nfs/dbraw/zinc/32/76/96/1042327696.db2.gz AJDRHCMUHGMNCS-UHFFFAOYSA-N -1 3 329.343 4.123 20 0 EIADHM CC(C)C(=C([O-])Nc1nc(-c2ccccc2)ns1)c1ccccc1 ZINC000439038368 1042472926 /nfs/dbraw/zinc/47/29/26/1042472926.db2.gz JLQRRLYSWBDVKM-MRXNPFEDSA-N -1 3 337.448 4.005 20 0 EIADHM Cc1cc(NC(=O)c2c[n-]c(=NC(=O)OC(C)(C)C)s2)cs1 ZINC000913720550 1042498827 /nfs/dbraw/zinc/49/88/27/1042498827.db2.gz IJIABAUAQGZFIB-UHFFFAOYSA-N -1 3 339.442 4.112 20 0 EIADHM O=S(=O)([N-]c1ccc(F)cc1Cl)c1csc2ccccc21 ZINC000506552333 1042591029 /nfs/dbraw/zinc/59/10/29/1042591029.db2.gz GIBSVHPEEDZIAY-UHFFFAOYSA-N -1 3 341.816 4.495 20 0 EIADHM CC[C@](C)(OC)c1noc(-c2cc(Cc3ccccc3)ccc2[O-])n1 ZINC000518625830 1042597598 /nfs/dbraw/zinc/59/75/98/1042597598.db2.gz RZPQPELASXRTKY-FQEVSTJZSA-N -1 3 338.407 4.305 20 0 EIADHM CC(C)CCN(CCC(C)C)C(=O)c1c[n-]c2ccccc2c1=O ZINC000175764615 1042780704 /nfs/dbraw/zinc/78/07/04/1042780704.db2.gz GZZRMRFHWKIIRH-UHFFFAOYSA-N -1 3 328.456 4.063 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1cc(O)cc(C(F)(F)F)c1 ZINC000646733026 1042782427 /nfs/dbraw/zinc/78/24/27/1042782427.db2.gz JGRXDIOFNMCLKN-UHFFFAOYSA-N -1 3 331.677 4.022 20 0 EIADHM CCSc1cccc(F)c1[N-]S(=O)(=O)Cc1ccc(F)cc1 ZINC000520675097 1042996012 /nfs/dbraw/zinc/99/60/12/1042996012.db2.gz OIRWQFMJHODHQI-UHFFFAOYSA-N -1 3 343.420 4.019 20 0 EIADHM CC(C)c1csc(CNC(=O)c2cc([O-])c3ccccc3c2)n1 ZINC000355016680 1043053428 /nfs/dbraw/zinc/05/34/28/1043053428.db2.gz VNBXIKXUZMSBBP-UHFFFAOYSA-N -1 3 326.421 4.055 20 0 EIADHM Cc1cc(C(C)(C)C)cc(C)c1S(=O)(=O)[N-]c1cccc(O)c1 ZINC000216133181 1043073392 /nfs/dbraw/zinc/07/33/92/1043073392.db2.gz HNGJWEQRQAUGOU-UHFFFAOYSA-N -1 3 333.453 4.107 20 0 EIADHM O=S(=O)([N-]c1cccc(F)c1F)c1ccc(-c2ccccc2)cc1 ZINC000520768872 1043100993 /nfs/dbraw/zinc/10/09/93/1043100993.db2.gz QHXSNLRWRQWISN-UHFFFAOYSA-N -1 3 345.370 4.433 20 0 EIADHM C[C@H](c1ccc(Cl)cc1Cl)N(C)C(=O)c1cccc(O)c1[O-] ZINC000186886038 1043130731 /nfs/dbraw/zinc/13/07/31/1043130731.db2.gz GROGAVJCPPDEOJ-SECBINFHSA-N -1 3 340.206 4.238 20 0 EIADHM Cc1ccc(NCc2cc([O-])cc(F)c2)c(OC[C@H]2CCCO2)c1 ZINC000185489009 1043189727 /nfs/dbraw/zinc/18/97/27/1043189727.db2.gz JZTWESVQSSIKSL-QGZVFWFLSA-N -1 3 331.387 4.010 20 0 EIADHM [O-]c1cc(F)cc(CNc2cccc(-c3noc(C4CC4)n3)c2)c1 ZINC000185600128 1043203645 /nfs/dbraw/zinc/20/36/45/1043203645.db2.gz LTJQXEIHMQFRQV-UHFFFAOYSA-N -1 3 325.343 4.071 20 0 EIADHM CC(C)CCOc1ccc(NC(=O)NCc2ccc([O-])c(F)c2)cc1 ZINC000465977997 1043238119 /nfs/dbraw/zinc/23/81/19/1043238119.db2.gz FVBNUICVJLCQLK-UHFFFAOYSA-N -1 3 346.402 4.278 20 0 EIADHM C[C@@H](NC(=O)c1cc([O-])c2ccccc2c1)c1c(F)cccc1F ZINC000526836231 1043243439 /nfs/dbraw/zinc/24/34/39/1043243439.db2.gz WTDVKLJDNVDDPC-LLVKDONJSA-N -1 3 327.330 4.315 20 0 EIADHM O=C(NCc1coc(-c2ccccc2)n1)c1cc([O-])c2ccccc2c1 ZINC000526926831 1043246290 /nfs/dbraw/zinc/24/62/90/1043246290.db2.gz BXBBWRQYUTUJJI-UHFFFAOYSA-N -1 3 344.370 4.130 20 0 EIADHM COc1ccnc2c(NC(=O)c3cc([O-])c4ccccc4c3)cccc12 ZINC000526921274 1043246605 /nfs/dbraw/zinc/24/66/05/1043246605.db2.gz JJQDZEYMTNFLBH-UHFFFAOYSA-N -1 3 344.370 4.355 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)c1ccc(Cl)cc1C(F)(F)F ZINC000186178305 1043251996 /nfs/dbraw/zinc/25/19/96/1043251996.db2.gz CINXBXHWGAMRPN-UHFFFAOYSA-N -1 3 347.695 4.134 20 0 EIADHM COc1c(F)cc(F)cc1NC(=O)c1cc([O-])c2ccccc2c1 ZINC000527167086 1043253051 /nfs/dbraw/zinc/25/30/51/1043253051.db2.gz CGHIEDCGONQERH-UHFFFAOYSA-N -1 3 329.302 4.085 20 0 EIADHM CCC(CC)[C@@H]1C[C@H](NC(=O)c2cc([O-])c3ccccc3c2)CCO1 ZINC000527170425 1043253122 /nfs/dbraw/zinc/25/31/22/1043253122.db2.gz IWXDPLAFDMQCQV-XLIONFOSSA-N -1 3 341.451 4.259 20 0 EIADHM O=C(NCc1ccc(C(F)F)cc1)c1cc([O-])c2ccccc2c1 ZINC000527173484 1043253339 /nfs/dbraw/zinc/25/33/39/1043253339.db2.gz XERRFNJFBAGUMV-UHFFFAOYSA-N -1 3 327.330 4.413 20 0 EIADHM Cc1c(NC(=O)c2cc([O-])c3ccccc3c2)cnn1-c1ccccc1 ZINC000527458603 1043262637 /nfs/dbraw/zinc/26/26/37/1043262637.db2.gz OJCSPELSYRCXMR-UHFFFAOYSA-N -1 3 343.386 4.292 20 0 EIADHM C[C@@H](c1cccc(Cl)c1)N(C)C(=O)NCc1ccc([O-])c(F)c1 ZINC000163777996 1043263843 /nfs/dbraw/zinc/26/38/43/1043263843.db2.gz CFFCHCGGZNDCCL-NSHDSACASA-N -1 3 336.794 4.087 20 0 EIADHM C[C@@H](CCCC(F)(F)F)NC(=O)CCCc1ccc([O-])c(F)c1 ZINC000427967970 1043280414 /nfs/dbraw/zinc/28/04/14/1043280414.db2.gz VVQXVPARTCSZTA-NSHDSACASA-N -1 3 335.341 4.091 20 0 EIADHM O=C([N-]c1nc(-c2ccccc2F)co1)c1scnc1C(F)F ZINC001128591059 1043380876 /nfs/dbraw/zinc/38/08/76/1043380876.db2.gz CAQLYRBXEOFTMR-UHFFFAOYSA-N -1 3 339.298 4.127 20 0 EIADHM [O-]c1c(F)cc(F)cc1Nc1nc2cc(Br)ccc2o1 ZINC001212477622 1043406723 /nfs/dbraw/zinc/40/67/23/1043406723.db2.gz JXOQUHXGGQMTBW-UHFFFAOYSA-N -1 3 341.111 4.318 20 0 EIADHM [O-]c1ccccc1-c1nc(CSc2c(F)cc(F)cc2F)no1 ZINC000520938885 1043451490 /nfs/dbraw/zinc/45/14/90/1043451490.db2.gz OXIZHFAXXGBGPN-UHFFFAOYSA-N -1 3 338.310 4.152 20 0 EIADHM CSc1ccncc1[N-]C(=O)c1csc(-c2ccccc2F)n1 ZINC000674256704 1043505192 /nfs/dbraw/zinc/50/51/92/1043505192.db2.gz OOFQYIIQCRKZJL-UHFFFAOYSA-N -1 3 345.424 4.318 20 0 EIADHM CSc1ccncc1[N-]C(=O)c1cc(-c2ccccc2)ns1 ZINC000674255589 1043505355 /nfs/dbraw/zinc/50/53/55/1043505355.db2.gz CVGSRTAFCQOTEE-UHFFFAOYSA-N -1 3 327.434 4.179 20 0 EIADHM C[C@H](CS(=O)(=O)[N-]c1cccc(Cl)c1F)c1ccccc1 ZINC000494470922 1043507484 /nfs/dbraw/zinc/50/74/84/1043507484.db2.gz GLJFLPXUOXHMMI-LLVKDONJSA-N -1 3 327.808 4.025 20 0 EIADHM CC(C)Cc1csc2[n-]c(COc3ccc(F)cc3)nc(=O)c12 ZINC000543020105 1043511420 /nfs/dbraw/zinc/51/14/20/1043511420.db2.gz IMIKBGSQHWHRAD-UHFFFAOYSA-N -1 3 332.400 4.314 20 0 EIADHM Cc1ccc(-c2nsc([N-]C(=O)c3ccc(F)cc3F)n2)s1 ZINC000066413129 1043687791 /nfs/dbraw/zinc/68/77/91/1043687791.db2.gz UUHITJMXWSSBMX-UHFFFAOYSA-N -1 3 337.376 4.106 20 0 EIADHM O=C(NCc1c(Cl)cccc1Cl)c1cc([O-])ccc1Cl ZINC000521319207 1043707385 /nfs/dbraw/zinc/70/73/85/1043707385.db2.gz ISIOFDHOLLULRY-UHFFFAOYSA-N -1 3 330.598 4.282 20 0 EIADHM C[C@@H](OC(=O)c1cccc(Cl)c1[O-])c1ccc(C(F)(F)F)nc1 ZINC001128731160 1043710795 /nfs/dbraw/zinc/71/07/95/1043710795.db2.gz LSPCXPTUNFJVBD-MRVPVSSYSA-N -1 3 345.704 4.377 20 0 EIADHM Cc1noc(C(F)F)c1C(=O)[N-]c1c(F)cccc1Br ZINC000674535692 1043740400 /nfs/dbraw/zinc/74/04/00/1043740400.db2.gz RGJGBYFSLKHGML-UHFFFAOYSA-N -1 3 349.106 4.075 20 0 EIADHM O=c1[n-]c(Sc2nc3ccccc3n2C(F)F)nc2ccccc12 ZINC000731921440 1043844842 /nfs/dbraw/zinc/84/48/42/1043844842.db2.gz BABBKWDHVGTEBD-UHFFFAOYSA-N -1 3 344.346 4.231 20 0 EIADHM CC(C)CCc1ccccc1NC(=O)c1nnc2ccccc2c1[O-] ZINC000732279702 1043891769 /nfs/dbraw/zinc/89/17/69/1043891769.db2.gz XAMQWLFFFPNSGL-UHFFFAOYSA-N -1 3 335.407 4.176 20 0 EIADHM O=C(Oc1cnc2ccc(Cl)cc2c1)c1cccc(Cl)c1[O-] ZINC001128951957 1044049651 /nfs/dbraw/zinc/04/96/51/1044049651.db2.gz VVQMGTARGSAVLV-UHFFFAOYSA-N -1 3 334.158 4.466 20 0 EIADHM Cc1cccc2cc(C(=O)Nc3ccc(Br)cc3[O-])oc21 ZINC000522004363 1044153248 /nfs/dbraw/zinc/15/32/48/1044153248.db2.gz RDZZSWIVSPHJQL-UHFFFAOYSA-N -1 3 346.180 4.462 20 0 EIADHM C[C@@H](c1cccc(Br)c1)N1CCC[C@@H](CCC(=O)[O-])C1 ZINC000226454859 1044213142 /nfs/dbraw/zinc/21/31/42/1044213142.db2.gz FQYCKDYKDZLPLI-STQMWFEESA-N -1 3 340.261 4.087 20 0 EIADHM CCOc1cc(Nc2cccc([O-])c2Br)ccc1OC ZINC001212544257 1044236280 /nfs/dbraw/zinc/23/62/80/1044236280.db2.gz FRJDRPFDOULSOF-UHFFFAOYSA-N -1 3 338.201 4.306 20 0 EIADHM Cc1csc(-c2cccc(S(=O)(=O)[N-]c3ccccc3F)c2)n1 ZINC000443401805 1044259147 /nfs/dbraw/zinc/25/91/47/1044259147.db2.gz VPXNYUNWFHEQOR-UHFFFAOYSA-N -1 3 348.424 4.058 20 0 EIADHM [O-]c1ccc(-c2nc(-c3ccc(-c4ccc(F)cc4)cc3)no2)nc1 ZINC001212558871 1044310862 /nfs/dbraw/zinc/31/08/62/1044310862.db2.gz JYGXVCNPFOZCFT-UHFFFAOYSA-N -1 3 333.322 4.310 20 0 EIADHM CC(C)(C)CN(CC(=O)[O-])Cc1cc(Cl)ccc1Br ZINC000665350298 1044471668 /nfs/dbraw/zinc/47/16/68/1044471668.db2.gz KUOJBPHXNZBBLG-UHFFFAOYSA-N -1 3 348.668 4.035 20 0 EIADHM Cc1cc(F)ccc1-c1ccc(/C=C2/C(=O)[N-]C(=O)c3ccccc32)o1 ZINC000734307146 1044530220 /nfs/dbraw/zinc/53/02/20/1044530220.db2.gz VVTWZBBTHFPDAS-WOJGMQOQSA-N -1 3 347.345 4.205 20 0 EIADHM [O-]c1cc(F)cc(CNc2cccc3cc(Br)cnc32)c1 ZINC000227851310 1044556270 /nfs/dbraw/zinc/55/62/70/1044556270.db2.gz VQGVKHCZBBYFMU-UHFFFAOYSA-N -1 3 347.187 4.454 20 0 EIADHM CCSc1cccc(F)c1[N-]S(=O)(=O)c1ccc(F)c(C)c1 ZINC000685916258 1044729774 /nfs/dbraw/zinc/72/97/74/1044729774.db2.gz AMFMJAIADFTHOS-UHFFFAOYSA-N -1 3 343.420 4.186 20 0 EIADHM Cc1cc(=O)[n-]c(CSc2ncc(-c3ccc(Cl)cc3)o2)n1 ZINC000761859101 1044804302 /nfs/dbraw/zinc/80/43/02/1044804302.db2.gz BIOJSGCQPCQXOB-UHFFFAOYSA-N -1 3 333.800 4.091 20 0 EIADHM C[C@H](c1ccccc1Cl)N(C)C(=O)c1cc(=O)c2ccccc2[n-]1 ZINC000053457804 1044812549 /nfs/dbraw/zinc/81/25/49/1044812549.db2.gz AVZQHKVPBTWICB-GFCCVEGCSA-N -1 3 340.810 4.015 20 0 EIADHM O=C(Nc1ccc(Cl)cc1[O-])C1(CCOCc2ccccc2)CC1 ZINC000474362924 1044888172 /nfs/dbraw/zinc/88/81/72/1044888172.db2.gz LPDYRZHBMJDUIW-UHFFFAOYSA-N -1 3 345.826 4.371 20 0 EIADHM O=C([O-])[C@H](CNCc1cc(Cl)sc1Cl)CC1CCCC1 ZINC000900083511 1044934611 /nfs/dbraw/zinc/93/46/11/1044934611.db2.gz IJRUAIQAZYYGMQ-NSHDSACASA-N -1 3 336.284 4.426 20 0 EIADHM O=C(C[C@H]1CCCN1Cc1cccc([O-])c1Cl)c1ccc(F)cc1 ZINC000509084700 1045088497 /nfs/dbraw/zinc/08/84/97/1045088497.db2.gz PWUKZLRLKYQTIA-MRXNPFEDSA-N -1 3 347.817 4.422 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)N1CCC(C2CCCCC2)CC1 ZINC000739058885 1045118773 /nfs/dbraw/zinc/11/87/73/1045118773.db2.gz KFWCFOUZGMYIPL-UHFFFAOYSA-N -1 3 334.435 4.033 20 0 EIADHM Cc1sc(Cl)nc1C(=O)[N-]c1nnc(C2CCCCC2)s1 ZINC000762840178 1045356446 /nfs/dbraw/zinc/35/64/46/1045356446.db2.gz CXOUSUZUHXXCMY-UHFFFAOYSA-N -1 3 342.877 4.256 20 0 EIADHM O=C(CCc1ccc(OC(F)F)cc1)Nc1ccc(Cl)cc1[O-] ZINC000533618858 1045642826 /nfs/dbraw/zinc/64/28/26/1045642826.db2.gz LJENMUXVPKBWJW-UHFFFAOYSA-N -1 3 341.741 4.218 20 0 EIADHM [O-]c1ccc(Nc2nc3cc(Br)ccc3o2)c(F)c1F ZINC001211997940 1045699878 /nfs/dbraw/zinc/69/98/78/1045699878.db2.gz TUDPVZPMQGQNMS-UHFFFAOYSA-N -1 3 341.111 4.318 20 0 EIADHM CCS[C@@H]1CCC[C@@H](NC(=O)c2cc3sccc3c([O-])c2)C1 ZINC000791378551 1045727246 /nfs/dbraw/zinc/72/72/46/1045727246.db2.gz KHULNZQPJZKUGS-CHWSQXEVSA-N -1 3 335.494 4.401 20 0 EIADHM CCCCC[C@@H](C)NC(=O)Nc1ccc(-c2cc(=O)[n-]c(C)n2)cc1 ZINC000915885288 1045821873 /nfs/dbraw/zinc/82/18/73/1045821873.db2.gz BNTDFPCEDHGZRM-CYBMUJFWSA-N -1 3 342.443 4.248 20 0 EIADHM COc1ccc(Br)c(Nc2ccc([O-])c(F)c2F)c1 ZINC001212007406 1045826945 /nfs/dbraw/zinc/82/69/45/1045826945.db2.gz BKJFNEGCIBMGQZ-UHFFFAOYSA-N -1 3 330.128 4.185 20 0 EIADHM COc1ccc(C(C)=O)c(Nc2ccc([O-])c(F)c2F)c1Cl ZINC001212011037 1045832488 /nfs/dbraw/zinc/83/24/88/1045832488.db2.gz NSOPURHJBAJVAU-UHFFFAOYSA-N -1 3 327.714 4.279 20 0 EIADHM CNc1cccc(Br)c1Nc1ccc([O-])c(F)c1F ZINC001212011171 1045833292 /nfs/dbraw/zinc/83/32/92/1045833292.db2.gz WKUDUHTYTBKVIJ-UHFFFAOYSA-N -1 3 329.144 4.218 20 0 EIADHM [O-]c1ccc(Nc2c(F)cccc2OC2CCOCC2)c(F)c1F ZINC001212016336 1045839209 /nfs/dbraw/zinc/83/92/09/1045839209.db2.gz KYOXHGUBZYRDMN-UHFFFAOYSA-N -1 3 339.313 4.111 20 0 EIADHM O=C(N[C@@H]1COc2c1cccc2Cl)c1cc([O-])c2ccccc2c1 ZINC000792223170 1045878197 /nfs/dbraw/zinc/87/81/97/1045878197.db2.gz OFVAMTYPUWUDAZ-MRXNPFEDSA-N -1 3 339.778 4.062 20 0 EIADHM Oc1cccc(-c2ccc([C@H]3C[C@@H]3Nc3ccc(=S)[n-]n3)cc2)c1 ZINC001170250537 1045971078 /nfs/dbraw/zinc/97/10/78/1045971078.db2.gz DNIAPVUBWZQYJO-SJORKVTESA-N -1 3 335.432 4.106 20 0 EIADHM O=C(Nc1ccc(Cl)c2cccnc12)c1cc([O-])ccc1Cl ZINC000320094043 1046007464 /nfs/dbraw/zinc/00/74/64/1046007464.db2.gz OIRMFZWQCCCKGY-UHFFFAOYSA-N -1 3 333.174 4.500 20 0 EIADHM Cc1ncsc1C(=O)[N-]c1cc(F)ccc1SCC(F)F ZINC000078189188 1046010042 /nfs/dbraw/zinc/01/00/42/1046010042.db2.gz GFDBUIDTGOEBNO-UHFFFAOYSA-N -1 3 332.372 4.200 20 0 EIADHM O=C(OCc1ncc(-c2cccc(Cl)c2)o1)c1ccc([O-])cc1 ZINC000032856510 1046052155 /nfs/dbraw/zinc/05/21/55/1046052155.db2.gz GXZPRGWTSGHORU-UHFFFAOYSA-N -1 3 329.739 4.058 20 0 EIADHM CCCCN(C(=O)c1cc2c(cc1[O-])OCO2)[C@@H](C)c1ccc(C)o1 ZINC000769739130 1046063999 /nfs/dbraw/zinc/06/39/99/1046063999.db2.gz SJGQTNNCRYPFJP-ZDUSSCGKSA-N -1 3 345.395 4.026 20 0 EIADHM O=C(CCCc1ccccc1)[N-]OCC1CCC(C(F)(F)F)CC1 ZINC000769829823 1046087158 /nfs/dbraw/zinc/08/71/58/1046087158.db2.gz JLTHZAODONXYOH-UHFFFAOYSA-N -1 3 343.389 4.426 20 0 EIADHM Cc1cc(O)ccc1NC(=O)c1cc(OCc2ccccc2)ccc1[O-] ZINC000770081567 1046143699 /nfs/dbraw/zinc/14/36/99/1046143699.db2.gz JUOFKJVGJXWFEX-UHFFFAOYSA-N -1 3 349.386 4.238 20 0 EIADHM CCc1ccc([O-])c(C(=O)N(C)[C@H](COC)c2ccc(Cl)cc2)c1 ZINC000428601987 1046326074 /nfs/dbraw/zinc/32/60/74/1046326074.db2.gz OWOKCDRBOLGZED-QGZVFWFLSA-N -1 3 347.842 4.068 20 0 EIADHM Cc1ccc(OC2CCN(Cc3ccc(C(=O)[O-])cc3)CC2)cc1C ZINC000455622409 1046362065 /nfs/dbraw/zinc/36/20/65/1046362065.db2.gz LPUYAKXFSMVKDU-UHFFFAOYSA-N -1 3 339.435 4.045 20 0 EIADHM Cn1ncc(NC(=O)c2cc(Oc3ccccc3)ccc2[O-])c1C1CC1 ZINC000771492808 1046418361 /nfs/dbraw/zinc/41/83/61/1046418361.db2.gz IQGNIZIALZFWNX-UHFFFAOYSA-N -1 3 349.390 4.048 20 0 EIADHM CC(C)c1ncc(-c2nc(=O)c3c4c(sc3[n-]2)CCCC4)s1 ZINC000127146190 1046618269 /nfs/dbraw/zinc/61/82/69/1046618269.db2.gz YSTBREQADRVEEP-UHFFFAOYSA-N -1 3 331.466 4.110 20 0 EIADHM C[C@@H]1Cc2ccccc2[C@@H]1NCc1cccc([O-])c1Br ZINC000459413375 1046635587 /nfs/dbraw/zinc/63/55/87/1046635587.db2.gz WZWHXXAVTSHWNO-PIGZYNQJSA-N -1 3 332.241 4.178 20 0 EIADHM Cc1cc([C@@H](C)NCc2cccc([O-])c2Br)ccc1F ZINC000459438347 1046683938 /nfs/dbraw/zinc/68/39/38/1046683938.db2.gz LIGLSXHRXALUFS-LLVKDONJSA-N -1 3 338.220 4.453 20 0 EIADHM CCOc1cc(CNc2ccc(F)c(OC)c2)cc(Cl)c1[O-] ZINC000459510900 1046749149 /nfs/dbraw/zinc/74/91/49/1046749149.db2.gz MRENVZDSYFPVMV-UHFFFAOYSA-N -1 3 325.767 4.204 20 0 EIADHM [O-]c1cccc(CN[C@H]2CCCc3c(O)cccc32)c1Br ZINC000459537113 1046751711 /nfs/dbraw/zinc/75/17/11/1046751711.db2.gz ZFJRPHUOEPGDSX-AWEZNQCLSA-N -1 3 348.240 4.028 20 0 EIADHM C[C@H](OC(=O)c1cc2occc2[n-]1)C(=O)Nc1cccc2ccccc21 ZINC000786030932 1046804282 /nfs/dbraw/zinc/80/42/82/1046804282.db2.gz JBMOBJYNHLYNFB-LBPRGKRZSA-N -1 3 348.358 4.098 20 0 EIADHM O=C(Nc1cccc([O-])c1F)c1cc(Cl)ccc1OC(F)F ZINC000128436438 1046866181 /nfs/dbraw/zinc/86/61/81/1046866181.db2.gz UIHUKWNCYLIDTD-UHFFFAOYSA-N -1 3 331.677 4.038 20 0 EIADHM CCCCOc1ccccc1[N-]S(=O)(=O)/C=C\c1ccccc1 ZINC000917761914 1047098736 /nfs/dbraw/zinc/09/87/36/1047098736.db2.gz PMJUUJMMGQTCKZ-SQFISAMPSA-N -1 3 331.437 4.278 20 0 EIADHM O=S(=O)(/C=C/c1ccccc1)[N-]c1ccccc1OC1CCCC1 ZINC000917751093 1047104636 /nfs/dbraw/zinc/10/46/36/1047104636.db2.gz SQPYCZANCJUFSI-CCEZHUSRSA-N -1 3 343.448 4.421 20 0 EIADHM O=S(=O)(/C=C\c1ccccc1)[N-]c1ccccc1OC1CCCC1 ZINC000917751094 1047104908 /nfs/dbraw/zinc/10/49/08/1047104908.db2.gz SQPYCZANCJUFSI-PFONDFGASA-N -1 3 343.448 4.421 20 0 EIADHM O=C(Nc1ccccc1N1CCCC1)c1cc2sccc2c([O-])c1 ZINC000788278976 1047157856 /nfs/dbraw/zinc/15/78/56/1047157856.db2.gz TVQJHZRYASMDFL-UHFFFAOYSA-N -1 3 338.432 4.459 20 0 EIADHM CC(C)(C)OC(=O)Cc1cccc(NCc2cc([O-])cc(F)c2)c1 ZINC000546728878 1047192062 /nfs/dbraw/zinc/19/20/62/1047192062.db2.gz IGFKNOUPYQJQKH-UHFFFAOYSA-N -1 3 331.387 4.028 20 0 EIADHM Cc1ccc(Cl)c(S(=O)(=O)[N-]c2ccc(F)cc2Cl)c1 ZINC000498023581 1047277539 /nfs/dbraw/zinc/27/75/39/1047277539.db2.gz AHKMMAAAKHTMBH-UHFFFAOYSA-N -1 3 334.199 4.242 20 0 EIADHM Cc1ccc(-c2nc(CN[C@@H](C)CCC[C@H](C)C(=O)[O-])cs2)cc1 ZINC000325635434 1047289090 /nfs/dbraw/zinc/28/90/90/1047289090.db2.gz VIZYNHFEFCHGSG-GJZGRUSLSA-N -1 3 346.496 4.488 20 0 EIADHM CCC(F)(F)C(C)(C)C[N-]S(=O)(=O)c1cscc1C(F)F ZINC000918144965 1047345556 /nfs/dbraw/zinc/34/55/56/1047345556.db2.gz UJPQJHKFSLSUQP-UHFFFAOYSA-N -1 3 347.399 4.036 20 0 EIADHM CC[C@@H](OC1CCCCC1)C(=O)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000476163009 1047392415 /nfs/dbraw/zinc/39/24/15/1047392415.db2.gz PPAGWBIOCCSKIX-OAHLLOKOSA-N -1 3 345.361 4.477 20 0 EIADHM C[C@H](O[N-]C(=O)CCC1CCCCC1)c1noc(-c2ccccc2)n1 ZINC000789592451 1047445471 /nfs/dbraw/zinc/44/54/71/1047445471.db2.gz VCNJOJLWLKJJKT-AWEZNQCLSA-N -1 3 343.427 4.206 20 0 EIADHM CC(C)CCc1nnc([N-]C(=O)c2cc3cc(F)ccc3o2)s1 ZINC001130914597 1047447237 /nfs/dbraw/zinc/44/72/37/1047447237.db2.gz KGXWIFROPFUOAX-UHFFFAOYSA-N -1 3 333.388 4.264 20 0 EIADHM CCc1ccc(C(=O)N2CCC3(CC2)c2ccccc2N=C3C)c([O-])c1 ZINC000898245869 1047595914 /nfs/dbraw/zinc/59/59/14/1047595914.db2.gz OOYXGRNLONLLSK-UHFFFAOYSA-N -1 3 348.446 4.235 20 0 EIADHM COc1ccnc(CSc2nnc([N-]c3ccccc3F)s2)c1 ZINC000106587169 1047686444 /nfs/dbraw/zinc/68/64/44/1047686444.db2.gz PATFZFSROKTVCA-UHFFFAOYSA-N -1 3 348.428 4.117 20 0 EIADHM C[C@H]1CN(C(=O)c2cc([O-])ccc2Cl)CC[C@@H]1c1ccccc1 ZINC000556352497 1047699451 /nfs/dbraw/zinc/69/94/51/1047699451.db2.gz AYRJFNZFXOXZCR-BBRMVZONSA-N -1 3 329.827 4.311 20 0 EIADHM CCCN(C(=O)c1ccc(CC)cc1[O-])[C@H]1C[C@H](OCC)C1(C)C ZINC001136849021 1047852135 /nfs/dbraw/zinc/85/21/35/1047852135.db2.gz WDZSEOSMVOJXSZ-ROUUACIJSA-N -1 3 333.472 4.010 20 0 EIADHM CCc1ccc(-c2nc(-c3ccc(-c4cc[nH]n4)cc3)no2)c([O-])c1 ZINC000809295391 1048305795 /nfs/dbraw/zinc/30/57/95/1048305795.db2.gz QXOUJDNJKGOMPN-UHFFFAOYSA-N -1 3 332.363 4.062 20 0 EIADHM CC(C)(C)[C@H]1CCCC[C@H]1CNC(=O)c1cc(=O)c2ccccc2[n-]1 ZINC000920043552 1048393550 /nfs/dbraw/zinc/39/35/50/1048393550.db2.gz RZACEXPFRIMYJZ-HOCLYGCPSA-N -1 3 340.467 4.110 20 0 EIADHM CC(C)(C)[C@H]1CCCC[C@H]1CNC(=O)c1c[n-]c2ccccc2c1=O ZINC000920040023 1048402321 /nfs/dbraw/zinc/40/23/21/1048402321.db2.gz NDBGUERBVDEYBO-YOEHRIQHSA-N -1 3 340.467 4.110 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)[C@@H]1C[C@H]1c1cccc2ccccc21 ZINC000132667260 1048404631 /nfs/dbraw/zinc/40/46/31/1048404631.db2.gz VAXYOYNZFCLSDO-ZWKOTPCHSA-N -1 3 335.378 4.104 20 0 EIADHM CCc1noc(C)c1[N-]C(=O)c1sc(-c2cccs2)nc1C ZINC000133088510 1048590329 /nfs/dbraw/zinc/59/03/29/1048590329.db2.gz WNHKEPIGSYJMOT-UHFFFAOYSA-N -1 3 333.438 4.291 20 0 EIADHM O=C([N-]C1(c2c(F)cccc2F)CCC1)C(F)(F)c1ccccc1 ZINC001132027986 1048615925 /nfs/dbraw/zinc/61/59/25/1048615925.db2.gz NHIMJACVLGYUQN-UHFFFAOYSA-N -1 3 337.316 4.252 20 0 EIADHM CN(CCc1ccc(C(F)(F)F)cc1)Cc1c(F)cc([O-])cc1F ZINC001144567660 1048732830 /nfs/dbraw/zinc/73/28/30/1048732830.db2.gz XFKMQQYDMFYKKY-UHFFFAOYSA-N -1 3 345.311 4.364 20 0 EIADHM C[C@@H]1OC2(CCN(Cc3cc(F)c([O-])cc3F)CC2)c2ccccc21 ZINC001144663831 1048780356 /nfs/dbraw/zinc/78/03/56/1048780356.db2.gz KRGDAOVWBLCFGU-ZDUSSCGKSA-N -1 3 345.389 4.253 20 0 EIADHM COc1cccc(C[C@H]2CCCN(Cc3cc(F)c([O-])cc3F)C2)c1 ZINC001144659941 1048791908 /nfs/dbraw/zinc/79/19/08/1048791908.db2.gz RFEVVIOEWSUSPK-OAHLLOKOSA-N -1 3 347.405 4.134 20 0 EIADHM CN(Cc1sccc1C(=O)[O-])Cc1ccc(C(F)(F)F)cc1 ZINC001144677365 1048797995 /nfs/dbraw/zinc/79/79/95/1048797995.db2.gz NIXZIYWZAIBXFG-UHFFFAOYSA-N -1 3 329.343 4.097 20 0 EIADHM Cc1ccc(N2CCCN(Cc3cccc([O-])c3Cl)CC2)cc1 ZINC000816477523 1048810941 /nfs/dbraw/zinc/81/09/41/1048810941.db2.gz BANUKPNHUAURFM-UHFFFAOYSA-N -1 3 330.859 4.066 20 0 EIADHM CC(=O)c1cccc(NC(=O)c2cc3ccccc3c(Cl)n2)c1[O-] ZINC000816621072 1048845499 /nfs/dbraw/zinc/84/54/99/1048845499.db2.gz XQWTWVNISHASQS-UHFFFAOYSA-N -1 3 340.766 4.049 20 0 EIADHM O=C([O-])c1cc(CN2CCC(c3ccc(F)c(F)c3)CC2)cs1 ZINC000846243782 1048847214 /nfs/dbraw/zinc/84/72/14/1048847214.db2.gz GTSSTZNPTMKTKW-UHFFFAOYSA-N -1 3 337.391 4.104 20 0 EIADHM CC1(C)CN(C(=O)c2cc3sccc3c([O-])c2)[C@H]1c1cccnc1 ZINC000816802701 1048863377 /nfs/dbraw/zinc/86/33/77/1048863377.db2.gz VQDNNKOPYSKWQP-KRWDZBQOSA-N -1 3 338.432 4.225 20 0 EIADHM CCn1nc(C(C)C)cc1C(=O)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000134129822 1048884802 /nfs/dbraw/zinc/88/48/02/1048884802.db2.gz GKLCFTSVVKTYCV-UHFFFAOYSA-N -1 3 341.333 4.003 20 0 EIADHM CCCc1ncc(C(=O)Nc2ccc([O-])c(C(F)(F)F)c2)s1 ZINC000134140737 1048886927 /nfs/dbraw/zinc/88/69/27/1048886927.db2.gz VOAZYUXPSFIQFB-UHFFFAOYSA-N -1 3 330.331 4.072 20 0 EIADHM Cc1oc(-c2cccs2)nc1C(=O)[N-]c1cc(F)cc(F)c1F ZINC000817085179 1048897492 /nfs/dbraw/zinc/89/74/92/1048897492.db2.gz VNDPGFOICFTKGC-UHFFFAOYSA-N -1 3 338.310 4.381 20 0 EIADHM CSc1ccc([O-])c(C(=O)NCc2ccc(C(F)(F)F)cc2)c1 ZINC001135847692 1048917580 /nfs/dbraw/zinc/91/75/80/1048917580.db2.gz JYJKXNWJACCNFO-UHFFFAOYSA-N -1 3 341.354 4.063 20 0 EIADHM O=C([N-]c1nnc(/C=C/c2ccco2)s1)c1c(F)cccc1Cl ZINC000134440270 1048956425 /nfs/dbraw/zinc/95/64/25/1048956425.db2.gz AWGOHGIDNUMFMR-VOTSOKGWSA-N -1 3 349.774 4.346 20 0 EIADHM Cc1ccc(C(=O)COC(=O)c2cc3cc(Cl)sc3[n-]2)s1 ZINC000811394885 1049050424 /nfs/dbraw/zinc/05/04/24/1049050424.db2.gz LVKFOFFGAIHJSJ-UHFFFAOYSA-N -1 3 339.825 4.292 20 0 EIADHM C[C@@H](OC(=O)c1cc2cc(Cl)sc2[n-]1)C(=O)c1ccccc1 ZINC000811393781 1049051971 /nfs/dbraw/zinc/05/19/71/1049051971.db2.gz DUKCWVNTIMQXKC-SECBINFHSA-N -1 3 333.796 4.311 20 0 EIADHM O=C(N[C@@H](c1ccccc1)C1CC1)c1cc([O-])cc(Br)c1 ZINC001136149512 1049175806 /nfs/dbraw/zinc/17/58/06/1049175806.db2.gz NIISXCYJGXKFSQ-INIZCTEOSA-N -1 3 346.224 4.036 20 0 EIADHM O=C(Nc1ccc([C@@H]2CCOC2)cc1)c1cc2sccc2c([O-])c1 ZINC000818747128 1049203647 /nfs/dbraw/zinc/20/36/47/1049203647.db2.gz ZOGLAEVGPCHBSQ-CYBMUJFWSA-N -1 3 339.416 4.363 20 0 EIADHM O=C(NC[C@@H]1CCCc2ccccc21)c1cc2sccc2c([O-])c1 ZINC001136167174 1049217001 /nfs/dbraw/zinc/21/70/01/1049217001.db2.gz KCVIPORNAJWTMM-AWEZNQCLSA-N -1 3 337.444 4.457 20 0 EIADHM CN(Cc1ccccc1OCc1ccccc1)C(=O)c1ccccc1[O-] ZINC001171320900 1049269281 /nfs/dbraw/zinc/26/92/81/1049269281.db2.gz PRLOJOKXGPJHIM-UHFFFAOYSA-N -1 3 347.414 4.243 20 0 EIADHM Cc1ccc(C(=O)Nc2cccc3c(Br)c[nH]c32)c([O-])c1 ZINC001148506062 1049328006 /nfs/dbraw/zinc/32/80/06/1049328006.db2.gz RGYIHUVSSLXPGH-UHFFFAOYSA-N -1 3 345.196 4.197 20 0 EIADHM Cc1ccc2c(c1F)N(Cc1cc(=O)[n-]c(-c3ccccc3)n1)CCC2 ZINC001170938093 1049367761 /nfs/dbraw/zinc/36/77/61/1049367761.db2.gz BGYQIGHUWAUZHO-UHFFFAOYSA-N -1 3 349.409 4.250 20 0 EIADHM O=C(CCCc1cc(Cl)sc1Cl)[N-]OC/C=C\Cl ZINC000812400476 1049449744 /nfs/dbraw/zinc/44/97/44/1049449744.db2.gz MNPIWCAIXXPDEY-DJWKRKHSSA-N -1 3 328.648 4.178 20 0 EIADHM CSc1ccc([O-])c(C(=O)N2CCC[C@H]2c2ccccc2C)c1 ZINC001136327018 1049487528 /nfs/dbraw/zinc/48/75/28/1049487528.db2.gz USYOAEWLVGASNO-KRWDZBQOSA-N -1 3 327.449 4.400 20 0 EIADHM CSc1ccc([O-])c(C(=O)N2CCC[C@@H](c3ccccc3)C2)c1 ZINC000615236139 1049567736 /nfs/dbraw/zinc/56/77/36/1049567736.db2.gz RGEVQSATFJVQPJ-OAHLLOKOSA-N -1 3 327.449 4.134 20 0 EIADHM COc1ccc([O-])c(C(=O)Nc2ccc3c(ccn3CC(C)C)c2)c1 ZINC001136419248 1049608448 /nfs/dbraw/zinc/60/84/48/1049608448.db2.gz AIPFLUJPGKWAFS-UHFFFAOYSA-N -1 3 338.407 4.264 20 0 EIADHM COc1ccc(C(=O)N(Cc2ccccc2)C2CCCCC2)c([O-])c1 ZINC001136644645 1049807484 /nfs/dbraw/zinc/80/74/84/1049807484.db2.gz DLGWLMUXQLBFRG-UHFFFAOYSA-N -1 3 339.435 4.376 20 0 EIADHM COc1ccccc1-c1csc(NC(=O)c2c(C)cccc2[O-])n1 ZINC001136667634 1049821015 /nfs/dbraw/zinc/82/10/15/1049821015.db2.gz LXATXKMDDKILJJ-UHFFFAOYSA-N -1 3 340.404 4.085 20 0 EIADHM C[C@H]1CC[C@H](NC(=O)c2cc(Oc3ccccc3)ccc2[O-])CC1 ZINC001136726586 1049850506 /nfs/dbraw/zinc/85/05/06/1049850506.db2.gz DXVBFVXAKNZYPO-SHTZXODSSA-N -1 3 325.408 4.493 20 0 EIADHM CC(C)c1ccc(C(=O)NCCOc2ccccc2C(C)C)c([O-])c1 ZINC001136820868 1049901898 /nfs/dbraw/zinc/90/18/98/1049901898.db2.gz JUYGMLZUOFSVGH-UHFFFAOYSA-N -1 3 341.451 4.448 20 0 EIADHM O=C([N-]c1nnc(C2CCCCC2)s1)c1cc2cccnc2s1 ZINC000824168528 1049904449 /nfs/dbraw/zinc/90/44/49/1049904449.db2.gz SWYIFGLKIAFRPB-UHFFFAOYSA-N -1 3 344.465 4.448 20 0 EIADHM CCC(CC)(CC)NC(=O)c1c[n-]c(=NC(=O)OC(C)(C)C)s1 ZINC001136835945 1049905398 /nfs/dbraw/zinc/90/53/98/1049905398.db2.gz LQEQNRVRPJLTLU-UHFFFAOYSA-N -1 3 341.477 4.189 20 0 EIADHM O=C(Nc1ccccc1CC(F)(F)F)c1cc([O-])ccc1Cl ZINC000551477912 1049953450 /nfs/dbraw/zinc/95/34/50/1049953450.db2.gz VUVPMRRBNFXZPP-UHFFFAOYSA-N -1 3 329.705 4.403 20 0 EIADHM CC[C@@H]([N-]S(=O)(=O)c1c(F)cc(C)cc1F)c1ccc(C)cc1 ZINC001186340401 1050303918 /nfs/dbraw/zinc/30/39/18/1050303918.db2.gz IBZYBZPWDIVYIJ-MRXNPFEDSA-N -1 3 339.407 4.011 20 0 EIADHM Cc1ccc(-c2ccccc2-c2noc(-c3cncc([O-])c3)n2)cc1 ZINC001212708229 1050330459 /nfs/dbraw/zinc/33/04/59/1050330459.db2.gz BAUQVTNXEZODRL-UHFFFAOYSA-N -1 3 329.359 4.480 20 0 EIADHM C[C@H](OC(=O)c1cc(Cl)c(Cl)[n-]1)c1nc2ccccc2o1 ZINC000181787923 1050337569 /nfs/dbraw/zinc/33/75/69/1050337569.db2.gz LXQMWBTWNODZBE-ZETCQYMHSA-N -1 3 325.151 4.381 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-][C@H]2CCC[C@H]2CCC(C)C)c(F)c1F ZINC001186523873 1050352156 /nfs/dbraw/zinc/35/21/56/1050352156.db2.gz DUQUSSZFXYSGRG-KBPBESRZSA-N -1 3 345.455 4.156 20 0 EIADHM CSc1ccccc1NC(=O)Nc1nc2c(cccc2[O-])s1 ZINC001186708217 1050391844 /nfs/dbraw/zinc/39/18/44/1050391844.db2.gz GQDOFGJAVCPMAU-UHFFFAOYSA-N -1 3 331.422 4.368 20 0 EIADHM COc1cc(NC(=O)c2cc([O-])ccc2Cl)cc2ccccc21 ZINC001178752965 1050543216 /nfs/dbraw/zinc/54/32/16/1050543216.db2.gz GERKKQPPVSMRPS-UHFFFAOYSA-N -1 3 327.767 4.460 20 0 EIADHM O=C(Nc1cccc(Br)c1)Nc1c([O-])cccc1Cl ZINC001187463808 1050546253 /nfs/dbraw/zinc/54/62/53/1050546253.db2.gz DCUOWUPMUJTJFJ-UHFFFAOYSA-N -1 3 341.592 4.452 20 0 EIADHM O=C([N-]c1nc(F)c(F)c(Cl)c1F)c1ccoc1C(F)(F)F ZINC001187710821 1050604669 /nfs/dbraw/zinc/60/46/69/1050604669.db2.gz UXSKNMZRADYKNF-UHFFFAOYSA-N -1 3 344.598 4.016 20 0 EIADHM Cc1ccc([O-])c(NC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)n1 ZINC001188206552 1050726381 /nfs/dbraw/zinc/72/63/81/1050726381.db2.gz MPTMOXVDOGRRCU-UHFFFAOYSA-N -1 3 345.708 4.412 20 0 EIADHM CC(C)(C)c1nc([N-]c2ccc(C(=O)NC3CCCCC3)cc2)no1 ZINC001174081088 1050754940 /nfs/dbraw/zinc/75/49/40/1050754940.db2.gz VAXVCZPZHQLKFF-UHFFFAOYSA-N -1 3 342.443 4.173 20 0 EIADHM O=C(c1cccc(Nc2cccc(Cl)c2[O-])c1)N1CCCCC1 ZINC001174173383 1050814414 /nfs/dbraw/zinc/81/44/14/1050814414.db2.gz BKDCKHPMHKGTLV-UHFFFAOYSA-N -1 3 330.815 4.415 20 0 EIADHM CC1CCN(C(=O)c2cccc(Nc3c(F)cc([O-])cc3F)c2)CC1 ZINC001174204473 1050838871 /nfs/dbraw/zinc/83/88/71/1050838871.db2.gz OHSGQPCIVWWAFB-UHFFFAOYSA-N -1 3 346.377 4.286 20 0 EIADHM COc1ccc(F)c(Nc2ncc(Br)cc2[O-])c1Cl ZINC001250301108 1050862790 /nfs/dbraw/zinc/86/27/90/1050862790.db2.gz FUSZSXRQYHULOW-UHFFFAOYSA-N -1 3 347.571 4.094 20 0 EIADHM O=C(Cn1c2ccccc2c2ccccc21)Nc1ccc(F)c([O-])c1 ZINC001180079356 1050876426 /nfs/dbraw/zinc/87/64/26/1050876426.db2.gz RVJOHNVXHDSRAK-UHFFFAOYSA-N -1 3 334.350 4.278 20 0 EIADHM Cc1ccc(Nc2ccc(F)c(C(=O)N3CCCC3)c2)c(Cl)c1[O-] ZINC001188993907 1050881609 /nfs/dbraw/zinc/88/16/09/1050881609.db2.gz VZICSZMOMYGKLY-UHFFFAOYSA-N -1 3 348.805 4.473 20 0 EIADHM Cn1cc(-c2ccc(Nc3cccc([O-])c3Br)cc2)cn1 ZINC001174379101 1050941478 /nfs/dbraw/zinc/94/14/78/1050941478.db2.gz HFRFQIUIXDQLIC-UHFFFAOYSA-N -1 3 344.212 4.299 20 0 EIADHM O=S(=O)(Cc1ccc(F)cc1F)[N-]c1cccc2sccc21 ZINC001189823995 1051071114 /nfs/dbraw/zinc/07/11/14/1051071114.db2.gz BWZZREWBDVZBHN-UHFFFAOYSA-N -1 3 339.388 4.121 20 0 EIADHM Cc1ccc(NC(=O)c2ccc3[n-]c(=S)oc3c2)c(CN(C)C)c1 ZINC000074677788 1051150809 /nfs/dbraw/zinc/15/08/09/1051150809.db2.gz AWZKZNWBZKFBLQ-UHFFFAOYSA-N -1 3 341.436 4.113 20 0 EIADHM O=S(=O)([N-]c1cnc(Cl)cc1Cl)c1ccc(C2CC2)cc1 ZINC001190469044 1051193666 /nfs/dbraw/zinc/19/36/66/1051193666.db2.gz FXXYLWYRUIHLGO-UHFFFAOYSA-N -1 3 343.235 4.067 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N1CCc2cc(F)cc(F)c2C1 ZINC001181628578 1051267614 /nfs/dbraw/zinc/26/76/14/1051267614.db2.gz DJNUDJCGUHHVPY-UHFFFAOYSA-N -1 3 339.341 4.022 20 0 EIADHM CCc1ccc(N2CCN(Cc3ccc([O-])c(F)c3)CC2)cc1Cl ZINC001181717829 1051283102 /nfs/dbraw/zinc/28/31/02/1051283102.db2.gz LSUQFKHIGPQUFP-UHFFFAOYSA-N -1 3 348.849 4.069 20 0 EIADHM Cc1cc(O)c(Nc2c(F)cc([O-])cc2F)cc1Br ZINC001175099401 1051345023 /nfs/dbraw/zinc/34/50/23/1051345023.db2.gz FGCVLXNUFQPDNU-UHFFFAOYSA-N -1 3 330.128 4.191 20 0 EIADHM COc1ccc(Nc2c(F)cc([O-])cc2F)cc1Br ZINC001175099694 1051345882 /nfs/dbraw/zinc/34/58/82/1051345882.db2.gz FPTULBZEUOMTKI-UHFFFAOYSA-N -1 3 330.128 4.185 20 0 EIADHM CC(=O)c1cccc(Br)c1Nc1c(F)cc([O-])cc1F ZINC001175101963 1051349108 /nfs/dbraw/zinc/34/91/08/1051349108.db2.gz BIGUASRRTLJGON-UHFFFAOYSA-N -1 3 342.139 4.379 20 0 EIADHM [O-]c1cc(F)c(Nc2c(F)ccc(Br)c2F)c(F)c1 ZINC001175102326 1051349605 /nfs/dbraw/zinc/34/96/05/1051349605.db2.gz IRDLYRCXGHCMTR-UHFFFAOYSA-N -1 3 336.082 4.455 20 0 EIADHM COC(=O)c1cc(Nc2c(F)cc([O-])cc2F)cc(C(F)(F)F)c1 ZINC001175098088 1051380262 /nfs/dbraw/zinc/38/02/62/1051380262.db2.gz XSHMZZUGBINQGQ-UHFFFAOYSA-N -1 3 347.239 4.219 20 0 EIADHM O=C(NCCCc1ccccc1)Nc1ccc(C(F)(F)F)cc1[O-] ZINC001191208704 1051384400 /nfs/dbraw/zinc/38/44/00/1051384400.db2.gz OZKGBZYTMVQMKS-UHFFFAOYSA-N -1 3 338.329 4.165 20 0 EIADHM [O-]c1ccc(CNCCOc2ccc(Cl)c(Cl)c2)c(F)c1F ZINC001182072809 1051391551 /nfs/dbraw/zinc/39/15/51/1051391551.db2.gz VSWYOVULYNLHBL-UHFFFAOYSA-N -1 3 348.176 4.146 20 0 EIADHM COc1cc(CNC(=O)Nc2c(C)cc(C)cc2C)cc(Cl)c1[O-] ZINC001182126195 1051395492 /nfs/dbraw/zinc/39/54/92/1051395492.db2.gz PUIVRMGRZVGASA-UHFFFAOYSA-N -1 3 348.830 4.301 20 0 EIADHM [O-]c1ccc(F)c(Nc2ncc(Br)cc2Cl)c1F ZINC001175261497 1051501941 /nfs/dbraw/zinc/50/19/41/1051501941.db2.gz KUNHMVAMYBGNMU-UHFFFAOYSA-N -1 3 335.535 4.225 20 0 EIADHM Cc1ncc(NC(=O)Nc2c(C(C)C)cccc2C(C)C)c(=O)[n-]1 ZINC001191617797 1051491531 /nfs/dbraw/zinc/49/15/31/1051491531.db2.gz NEVRDCAZROZMNI-UHFFFAOYSA-N -1 3 328.416 4.381 20 0 EIADHM [O-]c1ccc(F)c(Nc2noc3cc(Br)ccc32)c1F ZINC001175261490 1051499027 /nfs/dbraw/zinc/49/90/27/1051499027.db2.gz KJRUWWNKUZRURE-UHFFFAOYSA-N -1 3 341.111 4.318 20 0 EIADHM [O-]c1ccc(F)c(Nc2cnc(Cl)c(Br)c2)c1F ZINC001175263956 1051499906 /nfs/dbraw/zinc/49/99/06/1051499906.db2.gz ZLMFCWUDGHANPK-UHFFFAOYSA-N -1 3 335.535 4.225 20 0 EIADHM [O-]c1ccc(F)c(Nc2c(F)cc(Br)cc2F)c1F ZINC001175264089 1051500504 /nfs/dbraw/zinc/50/05/04/1051500504.db2.gz ADMDNGGYGMEAHX-UHFFFAOYSA-N -1 3 336.082 4.455 20 0 EIADHM [O-]c1ccc(F)c(Nc2ccc3nnc(-c4ccccc4)n3c2)c1F ZINC001175263645 1051501551 /nfs/dbraw/zinc/50/15/51/1051501551.db2.gz OIHGGUBXFZZWIX-UHFFFAOYSA-N -1 3 338.317 4.124 20 0 EIADHM COc1cc(Nc2c(F)ccc([O-])c2F)ccc1Br ZINC001175268720 1051502896 /nfs/dbraw/zinc/50/28/96/1051502896.db2.gz RBXPMHOQOZAYMX-UHFFFAOYSA-N -1 3 330.128 4.185 20 0 EIADHM CCOC(=O)c1ccc2ccc(Nc3c(F)ccc([O-])c3F)cc2n1 ZINC001175270182 1051505601 /nfs/dbraw/zinc/50/56/01/1051505601.db2.gz VPSGRXACUAIEDZ-UHFFFAOYSA-N -1 3 344.317 4.139 20 0 EIADHM [O-]c1ccc(F)c(Nc2cccc([C@H]3CN4C=CSC4=N3)c2)c1F ZINC001175270191 1051505921 /nfs/dbraw/zinc/50/59/21/1051505921.db2.gz WBNPPPPXSJWQPK-CYBMUJFWSA-N -1 3 345.374 4.345 20 0 EIADHM COc1c(C)cc(Nc2c(F)ccc([O-])c2F)cc1Br ZINC001175270320 1051506285 /nfs/dbraw/zinc/50/62/85/1051506285.db2.gz XQBKEQBZXYRHNR-UHFFFAOYSA-N -1 3 344.155 4.494 20 0 EIADHM CCOC(=O)c1cc(Cl)cc(Nc2c(F)ccc([O-])c2F)c1 ZINC001175269820 1051507518 /nfs/dbraw/zinc/50/75/18/1051507518.db2.gz NAKAIYRKUKFMNN-UHFFFAOYSA-N -1 3 327.714 4.244 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)C1(c2cccs2)CCCCC1 ZINC000156267505 1051514119 /nfs/dbraw/zinc/51/41/19/1051514119.db2.gz JNECHOALQVLZRE-UHFFFAOYSA-N -1 3 333.428 4.111 20 0 EIADHM c1ccc(OCc2cccc(Nc3ccc(-c4nn[n-]n4)cc3)c2)cc1 ZINC001175430066 1051587871 /nfs/dbraw/zinc/58/78/71/1051587871.db2.gz CSKBDWQWHBSXNX-UHFFFAOYSA-N -1 3 343.390 4.189 20 0 EIADHM CCCC[C@@H](CC)CCCN(C)C(=O)c1cc(=O)[n-]c(C2CC2)n1 ZINC000621111517 1051663629 /nfs/dbraw/zinc/66/36/29/1051663629.db2.gz LNVDOKISVSSOCR-CQSZACIVSA-N -1 3 333.476 4.128 20 0 EIADHM CN(C(=O)c1ccc(C(C)(C)C)cc1[O-])[C@H](C1CCC1)C(F)(F)F ZINC001192322839 1051688438 /nfs/dbraw/zinc/68/84/38/1051688438.db2.gz PTOWLTLAGWBQLX-OAHLLOKOSA-N -1 3 343.389 4.493 20 0 EIADHM Cc1cc(NC(=O)Nc2ccc(Br)cc2[O-])ccc1F ZINC001192382743 1051711484 /nfs/dbraw/zinc/71/14/84/1051711484.db2.gz VZZULHQRKFYABU-UHFFFAOYSA-N -1 3 339.164 4.246 20 0 EIADHM O=S(=O)([N-][C@@H]1CCCC12CCCCC2)c1cc(F)ccc1Cl ZINC001192483579 1051756219 /nfs/dbraw/zinc/75/62/19/1051756219.db2.gz BAKDWMPVJRTTFB-OAHLLOKOSA-N -1 3 345.867 4.260 20 0 EIADHM CCSc1ccc([C@H](C)NC(=O)NCc2ccc([O-])c(F)c2)cc1 ZINC000159012472 1051803962 /nfs/dbraw/zinc/80/39/62/1051803962.db2.gz SROBLKCYOYXUSV-LBPRGKRZSA-N -1 3 348.443 4.204 20 0 EIADHM CC(C)(C)C1CC(C(=O)Nc2n[n-]c(-c3cc4ccccc4o3)n2)C1 ZINC001183367459 1051835847 /nfs/dbraw/zinc/83/58/47/1051835847.db2.gz GLYOFFYPBGPSNT-UHFFFAOYSA-N -1 3 338.411 4.229 20 0 EIADHM [O-]c1cccc2sc(Nc3cnn(Cc4cccs4)c3)nc21 ZINC001176156817 1051945301 /nfs/dbraw/zinc/94/53/01/1051945301.db2.gz CMHUDFXXBCPZGD-UHFFFAOYSA-N -1 3 328.422 4.052 20 0 EIADHM C/C=C/C[C@@H]1CCCN(C(=O)c2ccc(OCCCC)cc2[O-])C1 ZINC001184099591 1051949346 /nfs/dbraw/zinc/94/93/46/1051949346.db2.gz YIUJJIBYHWMGIJ-LLCTXKFZSA-N -1 3 331.456 4.390 20 0 EIADHM O=C(N[C@@H]1CCCc2ccccc21)c1ccc([O-])cc1C(F)(F)F ZINC001193734043 1051978023 /nfs/dbraw/zinc/97/80/23/1051978023.db2.gz POFDHYJCTBHHCO-MRXNPFEDSA-N -1 3 335.325 4.218 20 0 EIADHM CC(C)(C)Cc1cc(NC(=O)c2ccc([O-])cc2C(F)(F)F)on1 ZINC001193734490 1051978167 /nfs/dbraw/zinc/97/81/67/1051978167.db2.gz TYGQNYFUKYLRSC-UHFFFAOYSA-N -1 3 342.317 4.240 20 0 EIADHM Nc1cccc2cccc(NC(=O)c3ccc([O-])cc3C(F)(F)F)c12 ZINC001193745985 1051991513 /nfs/dbraw/zinc/99/15/13/1051991513.db2.gz OMIDGQANRAQREC-UHFFFAOYSA-N -1 3 346.308 4.399 20 0 EIADHM CC(C)(CNC(=O)c1ccc([O-])cc1C(F)(F)F)c1ccccc1 ZINC001193757754 1051992793 /nfs/dbraw/zinc/99/27/93/1051992793.db2.gz BODWBYRNVZQYHJ-UHFFFAOYSA-N -1 3 337.341 4.119 20 0 EIADHM CCN(CC)C(=O)c1cc(F)cc(Nc2cccc(Cl)c2[O-])c1 ZINC001176298460 1052005164 /nfs/dbraw/zinc/00/51/64/1052005164.db2.gz XTNAVOSRJGSULX-UHFFFAOYSA-N -1 3 336.794 4.410 20 0 EIADHM O=C([N-]c1ccc(Cl)c2nsnc21)c1ccc(C(F)(F)F)o1 ZINC001194416511 1052145363 /nfs/dbraw/zinc/14/53/63/1052145363.db2.gz CMBGBYNMNUCYQK-UHFFFAOYSA-N -1 3 347.705 4.209 20 0 EIADHM Cc1cccc(C)c1S(=O)(=O)[N-]c1ccc(OC(F)(F)F)cc1 ZINC001194634599 1052181680 /nfs/dbraw/zinc/18/16/80/1052181680.db2.gz WQPPHTSZENNDDC-UHFFFAOYSA-N -1 3 345.342 4.003 20 0 EIADHM Cc1cccc(C)c1S(=O)(=O)[N-]c1cc(F)c(Cl)cc1F ZINC001194643285 1052185948 /nfs/dbraw/zinc/18/59/48/1052185948.db2.gz SIURMLOLUHABHD-UHFFFAOYSA-N -1 3 331.771 4.036 20 0 EIADHM CC(C)c1nnc([N-]C(=O)c2csc(C3CCCCC3)n2)s1 ZINC000622322813 1052197070 /nfs/dbraw/zinc/19/70/70/1052197070.db2.gz GLBNAICBVKJYAB-UHFFFAOYSA-N -1 3 336.486 4.418 20 0 EIADHM CCCCC[C@H](C)[N-]S(=O)(=O)c1ccc(F)cc1C(F)(F)F ZINC001185231778 1052199877 /nfs/dbraw/zinc/19/98/77/1052199877.db2.gz DHOMQQYZJSYHRP-JTQLQIEISA-N -1 3 341.370 4.092 20 0 EIADHM O=C(c1cc([O-])ccc1Cl)N1CCC(Cc2cccc(F)c2)CC1 ZINC000622313617 1052203489 /nfs/dbraw/zinc/20/34/89/1052203489.db2.gz VPXGTQYYRIGBAK-UHFFFAOYSA-N -1 3 347.817 4.280 20 0 EIADHM CCc1ccc(C(=O)N(C)CCCOc2cccc(Cl)c2)c([O-])c1 ZINC000622320346 1052205196 /nfs/dbraw/zinc/20/51/96/1052205196.db2.gz GOZHBYZMPQGJGA-UHFFFAOYSA-N -1 3 347.842 4.149 20 0 EIADHM COc1ccc(Cl)c(NC(=O)c2cc([O-])cc(C(F)(F)F)c2)c1 ZINC000622330130 1052211149 /nfs/dbraw/zinc/21/11/49/1052211149.db2.gz LQYXBZRPDBWWQB-UHFFFAOYSA-N -1 3 345.704 4.325 20 0 EIADHM CCc1ccc(C(=O)Nc2ccccc2NCC(F)(F)F)c([O-])c1 ZINC000622333470 1052213650 /nfs/dbraw/zinc/21/36/50/1052213650.db2.gz YOJDSQIESMMYJW-UHFFFAOYSA-N -1 3 338.329 4.181 20 0 EIADHM CC(C)Oc1c(Cl)cccc1NC(=O)Cc1ccc([O-])c(F)c1 ZINC000622379849 1052237389 /nfs/dbraw/zinc/23/73/89/1052237389.db2.gz MPUQIMZWYPOTBH-UHFFFAOYSA-N -1 3 337.778 4.153 20 0 EIADHM O=C(Nc1cc(F)ccc1[O-])Nc1cc(C(F)(F)F)ccc1F ZINC001185617389 1052272038 /nfs/dbraw/zinc/27/20/38/1052272038.db2.gz OBANAEXJDNNRPX-UHFFFAOYSA-N -1 3 332.228 4.333 20 0 EIADHM CCc1ccc([O-])c(C(=O)Nc2cnn(CC(C)C)c2C(C)C)c1 ZINC000622474795 1052284747 /nfs/dbraw/zinc/28/47/47/1052284747.db2.gz FLDRZWPXOKKLIC-UHFFFAOYSA-N -1 3 329.444 4.183 20 0 EIADHM CC(C)C1(C)CCN(C(=O)c2cc([O-])cc(C(F)(F)F)c2)CC1 ZINC000622525061 1052315955 /nfs/dbraw/zinc/31/59/55/1052315955.db2.gz QNCGIZWNDYQAOJ-UHFFFAOYSA-N -1 3 329.362 4.309 20 0 EIADHM CC(C)c1ccc(C(=O)N2CC3(CCCC3)OC(C)(C)C2)c([O-])c1 ZINC000622545940 1052319626 /nfs/dbraw/zinc/31/96/26/1052319626.db2.gz AGPJYVOSKPNPQD-UHFFFAOYSA-N -1 3 331.456 4.079 20 0 EIADHM Cc1ccc(C(=O)Nc2cccc(Cl)c2OCC(F)F)c([O-])c1 ZINC000622601813 1052344101 /nfs/dbraw/zinc/34/41/01/1052344101.db2.gz PCPLAAIBVRNIJY-UHFFFAOYSA-N -1 3 341.741 4.250 20 0 EIADHM O=C(c1cc([O-])cc(C(F)(F)F)c1)N1CC(C2CCCCC2)C1 ZINC000622622439 1052352334 /nfs/dbraw/zinc/35/23/34/1052352334.db2.gz NQGRYTFZSMXVAL-UHFFFAOYSA-N -1 3 327.346 4.063 20 0 EIADHM C[C@@H]1CCC[C@@H]([C@@H](CNCc2csc(C3CC3)n2)CC(=O)[O-])C1 ZINC000864534226 1053310984 /nfs/dbraw/zinc/31/09/84/1053310984.db2.gz SJGWGJNBKWZQMY-BPLDGKMQSA-N -1 3 336.501 4.027 20 0 EIADHM CC[C@@H](C)CO[N-]C(=O)CCC(=O)c1cc(Cl)sc1Cl ZINC000794851643 1053553497 /nfs/dbraw/zinc/55/34/97/1053553497.db2.gz GNAWXZIBGVLBIM-MRVPVSSYSA-N -1 3 338.256 4.112 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2c(C)cc(F)cc2Cl)c(F)c1 ZINC001196384482 1053653028 /nfs/dbraw/zinc/65/30/28/1053653028.db2.gz OUDXZLCXWGBSQW-UHFFFAOYSA-N -1 3 331.771 4.036 20 0 EIADHM C[C@H](OCCCNC(=O)c1cc([O-])c2ccccc2c1)c1ccccc1 ZINC000471639716 1053677645 /nfs/dbraw/zinc/67/76/45/1053677645.db2.gz QBKLMYYVYZOJQK-INIZCTEOSA-N -1 3 349.430 4.443 20 0 EIADHM O=C(NCc1ccc(OC(F)F)cc1)c1cc([O-])c2ccccc2c1 ZINC000471638571 1053677923 /nfs/dbraw/zinc/67/79/23/1053677923.db2.gz SZALZEUSTKBBLR-UHFFFAOYSA-N -1 3 343.329 4.077 20 0 EIADHM CC(=O)c1ccc(NC(=S)Nc2nc3c(cccc3[O-])s2)cc1 ZINC001196519167 1053690570 /nfs/dbraw/zinc/69/05/70/1053690570.db2.gz GCNVTOFTSCPMOX-UHFFFAOYSA-N -1 3 343.433 4.013 20 0 EIADHM O=c1[n-]c(CN2CCC[C@@H]2c2ccccc2)nc2c3ccccc3oc21 ZINC000021417312 1053735005 /nfs/dbraw/zinc/73/50/05/1053735005.db2.gz BPELHQHTADCRSC-MRXNPFEDSA-N -1 3 345.402 4.419 20 0 EIADHM CCN(Cc1ccccc1)Cc1nc2c3ccccc3oc2c(=O)[n-]1 ZINC000023700542 1053785498 /nfs/dbraw/zinc/78/54/98/1053785498.db2.gz QTHXCTXESJICOT-UHFFFAOYSA-N -1 3 333.391 4.104 20 0 EIADHM Cc1ccccc1CN(C)Cc1nc2c3ccccc3oc2c(=O)[n-]1 ZINC000024789581 1053816987 /nfs/dbraw/zinc/81/69/87/1053816987.db2.gz VSKFBZCDMGLJLU-UHFFFAOYSA-N -1 3 333.391 4.022 20 0 EIADHM C[C@H](CN(C)Cc1ccc(C(=O)[O-])cc1Br)C(C)(C)C ZINC000399375054 1053895768 /nfs/dbraw/zinc/89/57/68/1053895768.db2.gz GLNFCLFJVVXGNS-LLVKDONJSA-N -1 3 342.277 4.261 20 0 EIADHM COc1c(Cl)cccc1NC(=O)c1cc([O-])c2ccccc2c1 ZINC000471855079 1053907940 /nfs/dbraw/zinc/90/79/40/1053907940.db2.gz FBJLZSLBEYZSRF-UHFFFAOYSA-N -1 3 327.767 4.460 20 0 EIADHM [O-]c1cccc(Cl)c1NC(=S)NCc1ccc(Cl)cc1 ZINC001197577965 1053930404 /nfs/dbraw/zinc/93/04/04/1053930404.db2.gz KWFDSZSAQIULPN-UHFFFAOYSA-N -1 3 327.236 4.186 20 0 EIADHM Cc1cc(C)c(S(=O)(=O)[N-]c2ncc(Cl)cc2Cl)c(C)c1 ZINC001251456894 1053940565 /nfs/dbraw/zinc/94/05/65/1053940565.db2.gz NYYXWJLMHBJHQO-UHFFFAOYSA-N -1 3 345.251 4.114 20 0 EIADHM O[C@@H](CSc1nnc([N-]c2ccccc2F)s1)c1ccccc1 ZINC000010428186 1053957393 /nfs/dbraw/zinc/95/73/93/1053957393.db2.gz HKPONUKSBQUMBI-AWEZNQCLSA-N -1 3 347.440 4.247 20 0 EIADHM C[C@@]1(C[N-]C(=O)C(F)(F)c2cccc(Cl)c2Cl)CC1(F)F ZINC000855796444 1053977300 /nfs/dbraw/zinc/97/73/00/1053977300.db2.gz STIGPCREGPPMID-NSHDSACASA-N -1 3 344.135 4.247 20 0 EIADHM [O-]c1ccc(NC(=S)Nc2cccc(C(F)(F)F)c2)cc1F ZINC001198058012 1054054286 /nfs/dbraw/zinc/05/42/86/1054054286.db2.gz SOFGGDZWKYRPRN-UHFFFAOYSA-N -1 3 330.306 4.359 20 0 EIADHM O=C(NCc1ccccc1COCc1ccccc1)c1ccccc1[O-] ZINC000032738996 1054111969 /nfs/dbraw/zinc/11/19/69/1054111969.db2.gz QCOARHKMFPOVQB-UHFFFAOYSA-N -1 3 347.414 4.039 20 0 EIADHM CC(C)c1ccc(C(=O)N2CCC[C@@H](OC3CCC3)CC2)c([O-])c1 ZINC000871328197 1054194290 /nfs/dbraw/zinc/19/42/90/1054194290.db2.gz FVJNOKUNLNJELY-QGZVFWFLSA-N -1 3 331.456 4.079 20 0 EIADHM COC(=O)c1ccc([O-])cc1NC(=S)Nc1ccc(C(C)C)cc1 ZINC001198625103 1054209999 /nfs/dbraw/zinc/20/99/99/1054209999.db2.gz CZEKMVLDEGMMTL-UHFFFAOYSA-N -1 3 344.436 4.111 20 0 EIADHM CC(C)c1nc(C(=O)[N-]c2nnc(-c3ccccc3)s2)cs1 ZINC000338615911 1054211712 /nfs/dbraw/zinc/21/17/12/1054211712.db2.gz BTAMDEGBGKVLEA-UHFFFAOYSA-N -1 3 330.438 4.037 20 0 EIADHM O=C([O-])CC[C@H]1CCCN(Cc2ccc(Oc3ccccc3)o2)C1 ZINC000871621753 1054232158 /nfs/dbraw/zinc/23/21/58/1054232158.db2.gz NPMBSYIBUQINKO-OAHLLOKOSA-N -1 3 329.396 4.149 20 0 EIADHM Cc1cccc(NC(=S)Nc2ccc(Br)cc2[O-])c1 ZINC001198682922 1054235127 /nfs/dbraw/zinc/23/51/27/1054235127.db2.gz QDVMMTPQBCSOGR-UHFFFAOYSA-N -1 3 337.242 4.272 20 0 EIADHM Cc1ccc(C)c(CC(=O)[N-]OCc2ccc(C(F)(F)F)cc2)c1 ZINC000857472880 1054265116 /nfs/dbraw/zinc/26/51/16/1054265116.db2.gz HCFGCQGYORLEFY-UHFFFAOYSA-N -1 3 337.341 4.113 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N(Cc1cccc(O)c1)CC1CC1 ZINC000472315266 1054280533 /nfs/dbraw/zinc/28/05/33/1054280533.db2.gz UFZAYFLSCQVQFQ-UHFFFAOYSA-N -1 3 347.414 4.303 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N1CCC[C@H](Nc2ccccc2)C1 ZINC000472342988 1054287738 /nfs/dbraw/zinc/28/77/38/1054287738.db2.gz UDHHBGLLWPFLPE-IBGZPJMESA-N -1 3 346.430 4.262 20 0 EIADHM O=S(=O)([N-]c1cccc(Cl)c1F)c1ccc2occc2c1 ZINC001198861902 1054287901 /nfs/dbraw/zinc/28/79/01/1054287901.db2.gz NEUUKXYPRTWDNB-UHFFFAOYSA-N -1 3 325.748 4.026 20 0 EIADHM CSc1cc(C)nc(SC)c1[N-]C(=O)c1ccc2c(c1)COC2 ZINC001198842441 1054291174 /nfs/dbraw/zinc/29/11/74/1054291174.db2.gz WJMNACWAVONVOI-UHFFFAOYSA-N -1 3 346.477 4.116 20 0 EIADHM Cc1ccncc1C[N-]C(=O)C(F)(F)c1cccc(Cl)c1Cl ZINC000857526421 1054298851 /nfs/dbraw/zinc/29/88/51/1054298851.db2.gz SMCIRLVUTAJDBE-UHFFFAOYSA-N -1 3 345.176 4.105 20 0 EIADHM COc1ccc(S(=O)(=O)[N-]c2cc(C)c(Cl)cc2C)c(C)c1 ZINC001198939847 1054309245 /nfs/dbraw/zinc/30/92/45/1054309245.db2.gz MFDHOLKMBZCGSE-UHFFFAOYSA-N -1 3 339.844 4.075 20 0 EIADHM Cc1cc(N(C)C)cc(C)c1NC(=O)c1cc([O-])c2ccccc2c1 ZINC000472412124 1054314327 /nfs/dbraw/zinc/31/43/27/1054314327.db2.gz PURBEAWZOCXOHC-UHFFFAOYSA-N -1 3 334.419 4.481 20 0 EIADHM C[C@@H](NCc1cccc(NC(=O)C2CCC2)c1)c1cccc([O-])c1F ZINC000872021519 1054336090 /nfs/dbraw/zinc/33/60/90/1054336090.db2.gz RNUJQAPQSYQHEH-CYBMUJFWSA-N -1 3 342.414 4.121 20 0 EIADHM C[C@H](NCc1c(F)cccc1N1CCCC1)c1cccc([O-])c1F ZINC000872070190 1054377455 /nfs/dbraw/zinc/37/74/55/1054377455.db2.gz SGEFYWDHOLJVKQ-ZDUSSCGKSA-N -1 3 332.394 4.121 20 0 EIADHM C[C@H](NCc1ccc(OC(F)F)c(F)c1)c1cccc([O-])c1F ZINC000872072002 1054378224 /nfs/dbraw/zinc/37/82/24/1054378224.db2.gz BMRXBKIFXHJTFH-VIFPVBQESA-N -1 3 329.293 4.123 20 0 EIADHM CC[C@H](N[C@@H](C)c1cccc([O-])c1F)c1cccc(OC)c1OC ZINC000872092458 1054387766 /nfs/dbraw/zinc/38/77/66/1054387766.db2.gz NPFMRCCQLGYZRF-WFASDCNBSA-N -1 3 333.403 4.350 20 0 EIADHM [O-]c1cccc(Br)c1NC(=S)NCC1CCCCC1 ZINC001199923226 1054496067 /nfs/dbraw/zinc/49/60/67/1054496067.db2.gz SHDVJBBOUPIXGL-UHFFFAOYSA-N -1 3 343.290 4.021 20 0 EIADHM COc1ccc(CNCc2ccc([O-])c(Cl)c2)c(Cl)c1OC ZINC000873179238 1054500859 /nfs/dbraw/zinc/50/08/59/1054500859.db2.gz MZJCTDOGCWMSSX-UHFFFAOYSA-N -1 3 342.222 4.006 20 0 EIADHM CCc1ccc([O-])c(C(=O)N2C[C@H](C)C[C@H]2c2ccccc2F)c1 ZINC001137070518 1054521704 /nfs/dbraw/zinc/52/17/04/1054521704.db2.gz DCQNNRMNLHXRMW-ACJLOTCBSA-N -1 3 327.399 4.317 20 0 EIADHM CCCCCN(Cn1c(Cc2cccs2)n[n-]c1=S)C(C)C ZINC000116256414 1054544508 /nfs/dbraw/zinc/54/45/08/1054544508.db2.gz RAHPAMWLAAANHJ-UHFFFAOYSA-N -1 3 338.546 4.451 20 0 EIADHM CC[C@H](C)Cc1c(C)sc2[nH]c(-c3ccc([O-])cc3)nc(=O)c12 ZINC000060486391 1054696164 /nfs/dbraw/zinc/69/61/64/1054696164.db2.gz SADINAGBQGFJMS-JTQLQIEISA-N -1 3 328.437 4.254 20 0 EIADHM C[C@@H]([N-]C(=O)C(F)(F)c1ccccc1)c1ccc(C(F)(F)F)nc1 ZINC000874639962 1054708186 /nfs/dbraw/zinc/70/81/86/1054708186.db2.gz SATABKQTSTWJGX-SNVBAGLBSA-N -1 3 344.283 4.070 20 0 EIADHM Cc1csc(C(=O)[N-]c2nc(C(C)C)ns2)c1Br ZINC000874694641 1054719057 /nfs/dbraw/zinc/71/90/57/1054719057.db2.gz WXANWKKOEKQMED-UHFFFAOYSA-N -1 3 346.275 4.046 20 0 EIADHM O=C([O-])[C@@]12CCC[C@@H]1CN(Cc1cc(C(F)(F)F)ccc1Cl)C2 ZINC000859812596 1054732670 /nfs/dbraw/zinc/73/26/70/1054732670.db2.gz SRZQDMDQQVLUCR-IUODEOHRSA-N -1 3 347.764 4.046 20 0 EIADHM COc1cc(OC(F)(F)F)ccc1Nc1cc([O-])c(F)cc1F ZINC001201360993 1054760513 /nfs/dbraw/zinc/76/05/13/1054760513.db2.gz UPOCCEHLUAPJEO-UHFFFAOYSA-N -1 3 335.228 4.321 20 0 EIADHM [O-]c1c(F)cc(Nc2cncc(OCc3ccccc3)c2)cc1F ZINC001201625819 1054868020 /nfs/dbraw/zinc/86/80/20/1054868020.db2.gz LLWZNIPVJCLSPQ-UHFFFAOYSA-N -1 3 328.318 4.388 20 0 EIADHM Cc1c(C)c(C)c(S(=O)(=O)[N-]c2ccc([C@H](C)O)cc2)c(C)c1C ZINC001201799894 1054907814 /nfs/dbraw/zinc/90/78/14/1054907814.db2.gz UXFUHFPWOJMCPO-INIZCTEOSA-N -1 3 347.480 4.083 20 0 EIADHM Cc1cc([O-])c(NC(=O)Nc2ccccc2F)cc1Br ZINC001202002616 1054991980 /nfs/dbraw/zinc/99/19/80/1054991980.db2.gz ZPTOCAMXZYDQNM-UHFFFAOYSA-N -1 3 339.164 4.246 20 0 EIADHM O=C(Nc1cc(=O)[n-]c(C2CC2)n1)Nc1c(Cl)cccc1Cl ZINC001202093936 1055029251 /nfs/dbraw/zinc/02/92/51/1055029251.db2.gz IWJYZUCWSGWKGE-UHFFFAOYSA-N -1 3 339.182 4.010 20 0 EIADHM Cc1nn(C)c2cc(NC(=O)c3cc4sccc4c([O-])c3)ccc12 ZINC000794462924 1055125793 /nfs/dbraw/zinc/12/57/93/1055125793.db2.gz PHKWSSVJOGAECC-UHFFFAOYSA-N -1 3 337.404 4.054 20 0 EIADHM O=C(Nc1ccc(Cl)cc1)Nc1ccc([O-])c(Br)c1 ZINC001202375668 1055155445 /nfs/dbraw/zinc/15/54/45/1055155445.db2.gz GDDYGYXYHCGJAZ-UHFFFAOYSA-N -1 3 341.592 4.452 20 0 EIADHM CC(=O)c1cccc([O-])c1NC(=O)Nc1ccc(C(F)(F)F)cc1 ZINC001202412658 1055162387 /nfs/dbraw/zinc/16/23/87/1055162387.db2.gz WVWWFVGYAJSJFE-UHFFFAOYSA-N -1 3 338.285 4.258 20 0 EIADHM Cc1ccc([C@H]2CCCCN2Cc2nnc(-c3ccccc3[O-])o2)cc1 ZINC000878129253 1055191494 /nfs/dbraw/zinc/19/14/94/1055191494.db2.gz IGXFKDOZKNZDGU-GOSISDBHSA-N -1 3 349.434 4.478 20 0 EIADHM C[C@@H](c1ccccc1)N(Cc1nnc(-c2ccccc2[O-])o1)C1CC1 ZINC000878218901 1055211266 /nfs/dbraw/zinc/21/12/66/1055211266.db2.gz CGGNTYLSEBILQJ-AWEZNQCLSA-N -1 3 335.407 4.168 20 0 EIADHM C[C@@H](c1cccc(Br)c1)N1CCC(CCC(=O)[O-])CC1 ZINC000086755724 1055270403 /nfs/dbraw/zinc/27/04/03/1055270403.db2.gz BJYBQKRUKXQQBI-LBPRGKRZSA-N -1 3 340.261 4.087 20 0 EIADHM Cc1cccc(C(=O)Nc2ccc(Cl)c(Br)c2)c1[O-] ZINC000094670792 1055525549 /nfs/dbraw/zinc/52/55/49/1055525549.db2.gz MYYXJQXHHKXVPH-UHFFFAOYSA-N -1 3 340.604 4.369 20 0 EIADHM Cc1ccccc1[C@@H]1C[C@@H](C)N(C(=O)c2cc(=O)c3ccccc3[n-]2)C1 ZINC000265717330 1055801537 /nfs/dbraw/zinc/80/15/37/1055801537.db2.gz XWBYYMDUEUUTHW-HZPDHXFCSA-N -1 3 346.430 4.267 20 0 EIADHM Cc1ccc([N-]S(=O)(=O)c2cc(Cl)cc(Cl)c2)c(F)c1 ZINC000007428164 1056794855 /nfs/dbraw/zinc/79/48/55/1056794855.db2.gz STPPDWDBVSNOPL-UHFFFAOYSA-N -1 3 334.199 4.242 20 0 EIADHM C/C(=C\C(=O)Oc1cccc(-c2nc(C)cc(=O)[n-]2)c1)C(C)(C)C ZINC000744219234 1059336780 /nfs/dbraw/zinc/33/67/80/1059336780.db2.gz OXGYCCYLMUDYAK-FMIVXFBMSA-N -1 3 326.396 4.055 20 0 EIADHM COC(=O)Nc1ccc(C(=O)O[C@@H](C)c2ccccc2Cl)cc1[O-] ZINC000745650669 1059865224 /nfs/dbraw/zinc/86/52/24/1059865224.db2.gz JYUCUULYBZDFRQ-JTQLQIEISA-N -1 3 349.770 4.142 20 0 EIADHM O=C(OCc1ccno1)c1cc(-c2ccccc2)cc(Cl)c1[O-] ZINC000746080329 1060003905 /nfs/dbraw/zinc/00/39/05/1060003905.db2.gz VNLMUKOSQPQWEA-UHFFFAOYSA-N -1 3 329.739 4.058 20 0 EIADHM COc1ccccc1Cn1nc(C)cc1Nc1ccc(Cl)c([O-])c1 ZINC001212588146 1060766249 /nfs/dbraw/zinc/76/62/49/1060766249.db2.gz GXSUTQYPUQAPPJ-UHFFFAOYSA-N -1 3 343.814 4.351 20 0 EIADHM [O-]c1cc(Nc2ccc3ncc(Br)n3c2)ccc1Cl ZINC001212589449 1060773790 /nfs/dbraw/zinc/77/37/90/1060773790.db2.gz LVOGRXDMZYPFJS-UHFFFAOYSA-N -1 3 338.592 4.199 20 0 EIADHM COc1ccccc1-n1ncc(C)c1Nc1ccc(Cl)c([O-])c1 ZINC001212591611 1060857490 /nfs/dbraw/zinc/85/74/90/1060857490.db2.gz VVFNERJVBOZWSI-UHFFFAOYSA-N -1 3 329.787 4.292 20 0 EIADHM COC(=O)c1c(F)ccc(Nc2ccc(Cl)c([O-])c2)c1Cl ZINC001212593777 1060914885 /nfs/dbraw/zinc/91/48/85/1060914885.db2.gz JSMUGHFIMRYFJP-UHFFFAOYSA-N -1 3 330.142 4.368 20 0 EIADHM [O-]c1cc(Nc2c(F)cccc2OC[C@@H]2CCCO2)ccc1Cl ZINC001212594871 1060972615 /nfs/dbraw/zinc/97/26/15/1060972615.db2.gz ALHAVQXSBZFVBI-LBPRGKRZSA-N -1 3 337.778 4.486 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2ccc(Cl)cc2F)c(Cl)c1 ZINC000025365786 202129678 /nfs/dbraw/zinc/12/96/78/202129678.db2.gz NJUFPVIVISJDCP-UHFFFAOYSA-N -1 3 334.199 4.242 20 0 EIADHM C[C@@H](c1cc2ccccc2o1)N(C)C(=O)c1c[n-]c2ccccc2c1=O ZINC000053797372 201129672 /nfs/dbraw/zinc/12/96/72/201129672.db2.gz OBNHCNBDVLIGJE-ZDUSSCGKSA-N -1 3 346.386 4.108 20 0 EIADHM COc1cc(C(=O)Nc2ccccc2[O-])cc(Cl)c1OCC(C)C ZINC000060618672 202783846 /nfs/dbraw/zinc/78/38/46/202783846.db2.gz YTXUUHOKBDZOPQ-UHFFFAOYSA-N -1 3 349.814 4.341 20 0 EIADHM FC(F)(c1cc(Cl)nc(=S)[n-]1)N1CCC2(CCCC2)CC1 ZINC001164422379 718894031 /nfs/dbraw/zinc/89/40/31/718894031.db2.gz UXIAOHCYSXUJKR-UHFFFAOYSA-N -1 3 333.835 4.124 20 0 EIADHM Cc1cc(OC(C)C)ccc1[N-]S(=O)(=O)c1ccc(Cl)cc1 ZINC000614863607 1032101279 /nfs/dbraw/zinc/10/12/79/1032101279.db2.gz JBVBARHIVQHHKH-UHFFFAOYSA-N -1 3 339.844 4.236 20 0 EIADHM CN(C)[C@H]1CCOc2c(Nc3cc(Cl)cc(C(=O)[O-])c3)cccc21 ZINC001211969666 1032139721 /nfs/dbraw/zinc/13/97/21/1032139721.db2.gz UPNJDZNWWIHQFI-INIZCTEOSA-N -1 3 346.814 4.167 20 0 EIADHM [O-]c1c(F)cc(Br)cc1Nc1c(F)ccc(F)c1F ZINC001175032232 1051324989 /nfs/dbraw/zinc/32/49/89/1051324989.db2.gz XCBLRQOLCPZILL-UHFFFAOYSA-N -1 3 336.082 4.455 20 0 EIADHM COC(=O)c1cnc(S[C@@H](C)c2ccc3cc(OC)ccc3c2)[n-]1 ZINC000193543668 1032158675 /nfs/dbraw/zinc/15/86/75/1032158675.db2.gz YNUDBJYTDVGMNZ-NSHDSACASA-N -1 3 342.420 4.211 20 0 EIADHM CCC[C@@H](NC(=O)Cc1ccc([O-])c(F)c1)c1ccc(F)cc1F ZINC000450102097 1032299459 /nfs/dbraw/zinc/29/94/59/1032299459.db2.gz QIMRBDRAPAPWAV-MRXNPFEDSA-N -1 3 337.341 4.010 20 0 EIADHM O=C(Nc1ccc(Cc2ccncc2)cc1)c1cc([O-])ccc1Cl ZINC000514694456 1032363593 /nfs/dbraw/zinc/36/35/93/1032363593.db2.gz JWVLHLJFWJCSNX-UHFFFAOYSA-N -1 3 338.794 4.284 20 0 EIADHM CC(C)c1ccc2c(c1)[C@H](NC(=O)c1cc(=O)c3ccccc3[n-]1)CC2 ZINC000428523965 1032411709 /nfs/dbraw/zinc/41/17/09/1032411709.db2.gz HXEBEAFPOVLHLK-LJQANCHMSA-N -1 3 346.430 4.069 20 0 EIADHM O=C(Cc1cccc(OC(F)(F)F)c1)Nc1cc(Cl)ccc1[O-] ZINC000533054161 1032460778 /nfs/dbraw/zinc/46/07/78/1032460778.db2.gz IRQFKMCDRGTNER-UHFFFAOYSA-N -1 3 345.704 4.125 20 0 EIADHM CC(C)c1nn(C)c2sc(C(=O)Nc3ccc(Cl)cc3[O-])cc12 ZINC000533159171 1032514966 /nfs/dbraw/zinc/51/49/66/1032514966.db2.gz MCPYLGJDNNLUKH-UHFFFAOYSA-N -1 3 349.843 4.370 20 0 EIADHM O=C(CC1(C(F)(F)F)CC1)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000500529735 1032587180 /nfs/dbraw/zinc/58/71/80/1032587180.db2.gz WHUJQRLBDPKLKZ-UHFFFAOYSA-N -1 3 327.224 4.082 20 0 EIADHM CCC[C@@H](C(=O)Nc1ccc([O-])c(C(F)(F)F)c1)c1ccccn1 ZINC000500558496 1032649427 /nfs/dbraw/zinc/64/94/27/1032649427.db2.gz DXUYRMUZMCVUHV-GFCCVEGCSA-N -1 3 338.329 4.328 20 0 EIADHM C[C@@H]1C[C@@H](c2ccccc2)CCN1C(=O)c1cc([O-])ccc1Cl ZINC000512422223 1032727464 /nfs/dbraw/zinc/72/74/64/1032727464.db2.gz YHKYLNRHONOJLO-HIFRSBDPSA-N -1 3 329.827 4.454 20 0 EIADHM CCSc1cccc(CN[C@@H](CC(=O)[O-])c2ccc(OC)cc2)c1 ZINC000683172041 1019088838 /nfs/dbraw/zinc/08/88/38/1019088838.db2.gz UPQKQIVDLOVOIV-SFHVURJKSA-N -1 3 345.464 4.113 20 0 EIADHM Cc1ccc(-c2ncc(CNCc3cccc(C(=O)[O-])c3)s2)cc1 ZINC000683176840 1019115842 /nfs/dbraw/zinc/11/58/42/1019115842.db2.gz SZSKWZGQLRMFLZ-UHFFFAOYSA-N -1 3 338.432 4.107 20 0 EIADHM Cc1cccc([O-])c1C(=O)N1CCC(Cc2cc(F)ccc2F)CC1 ZINC001626348638 1019318113 /nfs/dbraw/zinc/31/81/13/1019318113.db2.gz QGKGRLKJSQOHDT-UHFFFAOYSA-N -1 3 345.389 4.074 20 0 EIADHM CCOc1ccccc1[C@@H](CC)NC(=O)c1cc([O-])ccc1Cl ZINC000339689760 1019810808 /nfs/dbraw/zinc/81/08/08/1019810808.db2.gz XURFFLULZVRVOQ-MRXNPFEDSA-N -1 3 333.815 4.325 20 0 EIADHM CC1=C[C@@H](C)CN(Cc2nc(=O)c3c(-c4ccco4)csc3[n-]2)C1 ZINC000430284027 1019979044 /nfs/dbraw/zinc/97/90/44/1019979044.db2.gz MFCPARLCPGIBBA-LLVKDONJSA-N -1 3 341.436 4.055 20 0 EIADHM CCCOCc1nc(=O)c2c(-c3ccccc3Cl)csc2[n-]1 ZINC000060090491 1020021416 /nfs/dbraw/zinc/02/14/16/1020021416.db2.gz MEAUTYWZYQPCME-UHFFFAOYSA-N -1 3 334.828 4.232 20 0 EIADHM Cc1nc(C(=O)[N-]c2nnc(-c3cc(C)cc(C)c3)s2)sc1C ZINC000683551112 1020878369 /nfs/dbraw/zinc/87/83/69/1020878369.db2.gz SFJXICRXKNUVDW-UHFFFAOYSA-N -1 3 344.465 4.148 20 0 EIADHM CCO[C@H](C)C(=O)Nc1ccc([O-])c(-c2nc3ccccc3s2)c1 ZINC000093095713 1021225613 /nfs/dbraw/zinc/22/56/13/1021225613.db2.gz ZRKFLNDHVJLKEZ-LLVKDONJSA-N -1 3 342.420 4.032 20 0 EIADHM CC(C)(CC(F)(F)F)C(=O)Nc1cc(Br)ccc1[O-] ZINC000613025859 1021632179 /nfs/dbraw/zinc/63/21/79/1021632179.db2.gz DFTFCZLWDPAIHT-UHFFFAOYSA-N -1 3 340.139 4.072 20 0 EIADHM COc1cc(NC(=O)c2cc([O-])ccc2Cl)ccc1C(F)(F)F ZINC000685840450 1021682693 /nfs/dbraw/zinc/68/26/93/1021682693.db2.gz OLRADONSHOYDAD-UHFFFAOYSA-N -1 3 345.704 4.325 20 0 EIADHM O=C(c1cc([O-])ccc1Cl)N1CCC[C@H](c2ccccc2)CC1 ZINC000431785613 1021843385 /nfs/dbraw/zinc/84/33/85/1021843385.db2.gz AMWIECMRQNOUBX-HNNXBMFYSA-N -1 3 329.827 4.456 20 0 EIADHM Cc1c([O-])ccc2c(CN(C)Cc3ccc(Cl)s3)cc(=O)oc12 ZINC000052710182 1022019039 /nfs/dbraw/zinc/01/90/39/1022019039.db2.gz FGELYYPWMBCJQC-UHFFFAOYSA-N -1 3 349.839 4.154 20 0 EIADHM CC(=CC(=O)Nc1nnc(C(F)(F)F)[n-]1)c1ccccc1Cl ZINC000066629117 1022105769 /nfs/dbraw/zinc/10/57/69/1022105769.db2.gz BMDNSGKECMJWKD-SREVYHEPSA-N -1 3 330.697 4.168 20 0 EIADHM CC(=CC(=O)Nc1nc(C(F)(F)F)n[n-]1)c1ccccc1Cl ZINC000066629117 1022105782 /nfs/dbraw/zinc/10/57/82/1022105782.db2.gz BMDNSGKECMJWKD-SREVYHEPSA-N -1 3 330.697 4.168 20 0 EIADHM Cc1ccncc1C1=CCN(C(=O)c2cc([O-])c3ccccc3c2)CC1 ZINC000375638611 1022877040 /nfs/dbraw/zinc/87/70/40/1022877040.db2.gz HZKKZHQOYGBDQN-UHFFFAOYSA-N -1 3 344.414 4.178 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@@H]3C[C@H]3CC(C)(C)C)nc2)n1 ZINC000651395501 1022903449 /nfs/dbraw/zinc/90/34/49/1022903449.db2.gz OHOOEMOXIIZICA-DZGCQCFKSA-N -1 3 326.444 4.043 20 0 EIADHM CCCCN(CC(F)(F)F)C(=O)c1cc([O-])cc(C(F)(F)F)c1 ZINC000623017194 1023015439 /nfs/dbraw/zinc/01/54/39/1023015439.db2.gz AGWYQHDTAQNQLL-UHFFFAOYSA-N -1 3 343.267 4.216 20 0 EIADHM CCc1ccc([C@@H]2CCCCCN2Cc2nc(CC)cc(=O)[n-]2)o1 ZINC001167454961 1023032665 /nfs/dbraw/zinc/03/26/65/1023032665.db2.gz ZXKLUJOWDJSYDA-INIZCTEOSA-N -1 3 329.444 4.017 20 0 EIADHM CS[C@H]1CCCCN([C@H](C(=O)[O-])c2ccc(Cl)cc2Cl)C1 ZINC000584637767 1023137959 /nfs/dbraw/zinc/13/79/59/1023137959.db2.gz BUZFEGLIFGBYFW-FZMZJTMJSA-N -1 3 348.295 4.337 20 0 EIADHM Cc1ccc(-c2noc(C=C([O-])c3ccccc3Cl)n2)cc1C ZINC001211646959 1023211872 /nfs/dbraw/zinc/21/18/72/1023211872.db2.gz FNOJWDXLCKMRHV-UHFFFAOYSA-N -1 3 326.783 4.432 20 0 EIADHM [O-]C(=Cc1nc(-c2cc(F)ccc2F)no1)c1ccccc1Cl ZINC001211647101 1023216452 /nfs/dbraw/zinc/21/64/52/1023216452.db2.gz HNGCFMCCYBBWID-UHFFFAOYSA-N -1 3 334.709 4.094 20 0 EIADHM CCOc1ccc(-c2noc(C=C([O-])c3ccccc3Cl)n2)cc1 ZINC001211647148 1023220303 /nfs/dbraw/zinc/22/03/03/1023220303.db2.gz IOIIDWNCWSPNHR-UHFFFAOYSA-N -1 3 342.782 4.214 20 0 EIADHM [O-]C(=Cc1nc(-c2cccc3cnccc32)no1)c1ccccc1Cl ZINC001211647341 1023223107 /nfs/dbraw/zinc/22/31/07/1023223107.db2.gz KXKOUEAIFNWEMX-UHFFFAOYSA-N -1 3 349.777 4.364 20 0 EIADHM COC(C)(C)C(=O)Nc1ccc([O-])c(-c2nc3ccccc3s2)c1 ZINC000179933596 1023223478 /nfs/dbraw/zinc/22/34/78/1023223478.db2.gz BGCBXNAGAIUAKF-UHFFFAOYSA-N -1 3 342.420 4.032 20 0 EIADHM CC(C)[C@H](CNC(=O)c1cc(=O)c2ccccc2[n-]1)Cc1ccccc1 ZINC000276259474 1023278966 /nfs/dbraw/zinc/27/89/66/1023278966.db2.gz RQZRUYPKPOKPBR-KRWDZBQOSA-N -1 3 348.446 4.185 20 0 EIADHM O=C([O-])c1ccc(-c2nc(CN3CCC[C@@H](C4CCC4)C3)co2)cc1 ZINC000659802860 1023287335 /nfs/dbraw/zinc/28/73/35/1023287335.db2.gz YGWOMSASASELIV-QGZVFWFLSA-N -1 3 340.423 4.052 20 0 EIADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)C(C)(C)C(C)(C)C)c2)n1 ZINC000431836735 1023291918 /nfs/dbraw/zinc/29/19/18/1023291918.db2.gz ZWCHTVYIAQURKE-UHFFFAOYSA-N -1 3 341.455 4.422 20 0 EIADHM COc1cccc([C@H](CC(=O)[O-])NCc2ccc(C3CCC3)cc2)c1 ZINC000417580439 1023363191 /nfs/dbraw/zinc/36/31/91/1023363191.db2.gz FCYZZVZNGHBISD-FQEVSTJZSA-N -1 3 339.435 4.268 20 0 EIADHM O=C([O-])CC[C@@H](NCc1cnc(C2CCCC2)s1)c1ccccc1 ZINC000417592616 1023368035 /nfs/dbraw/zinc/36/80/35/1023368035.db2.gz FHDHMXWNCIZKGN-QGZVFWFLSA-N -1 3 344.480 4.496 20 0 EIADHM O=C([O-])[C@@H]1C[C@H](NCc2cscc2C(F)(F)F)c2ccccc21 ZINC000417626044 1023385847 /nfs/dbraw/zinc/38/58/47/1023385847.db2.gz MNUDYOFJKVKBLS-OCCSQVGLSA-N -1 3 341.354 4.170 20 0 EIADHM CC(C)=CCSC[C@H](NCc1cccc(Cl)c1Cl)C(=O)[O-] ZINC000417625766 1023386726 /nfs/dbraw/zinc/38/67/26/1023386726.db2.gz MSXYWZMIINJPSR-ZDUSSCGKSA-N -1 3 348.295 4.236 20 0 EIADHM C[C@@H](C1CC1)N(Cc1ccccc1)C(=O)NCc1ccc([O-])c(F)c1 ZINC000163679092 1023390362 /nfs/dbraw/zinc/39/03/62/1023390362.db2.gz VILVWHCTXSFJLO-AWEZNQCLSA-N -1 3 342.414 4.042 20 0 EIADHM Cc1cccc(C(=O)Nc2nnc(-c3cccc(Cl)c3)s2)c1[O-] ZINC001143491759 1023459135 /nfs/dbraw/zinc/45/91/35/1023459135.db2.gz QZUREXJDMLIUHV-UHFFFAOYSA-N -1 3 345.811 4.125 20 0 EIADHM CCc1nc(C(C)C)ccc1CN1CC[C@H](C(=O)[O-])[C@@H]2CCCC[C@H]21 ZINC000656769389 1023511282 /nfs/dbraw/zinc/51/12/82/1023511282.db2.gz ZBBNIKDAPSTWEQ-ABSDTBQOSA-N -1 3 344.499 4.233 20 0 EIADHM O=C(N[C@@H]1C[C@H]1c1ccc2ccccc2c1)c1cc([O-])ccc1Cl ZINC000511680252 1023827449 /nfs/dbraw/zinc/82/74/49/1023827449.db2.gz IHFODUGFKAHPTG-QFBILLFUSA-N -1 3 337.806 4.485 20 0 EIADHM Cc1cc(C)c(S(=O)(=O)[N-]c2ccc(COC(C)C)cc2)c(C)c1 ZINC000511696284 1023829611 /nfs/dbraw/zinc/82/96/11/1023829611.db2.gz ARXMOQCTJUGISJ-UHFFFAOYSA-N -1 3 347.480 4.338 20 0 EIADHM CSc1cc(C)c(C(=O)[N-]c2nc(Cc3ccccc3)ns2)o1 ZINC001125952318 1023862686 /nfs/dbraw/zinc/86/26/86/1023862686.db2.gz MFOBJOMMFRAGKT-UHFFFAOYSA-N -1 3 345.449 4.005 20 0 EIADHM CC(C)(NCc1cc([O-])cc(F)c1)c1nc(C(F)(F)F)cs1 ZINC000349561766 1023902273 /nfs/dbraw/zinc/90/22/73/1023902273.db2.gz BUYFNVJJMRSOPO-UHFFFAOYSA-N -1 3 334.338 4.032 20 0 EIADHM CCC(C)(C)c1ccc(CNC(C)(C)c2nc(C)cc(=O)[n-]2)cc1 ZINC000660748936 1024047330 /nfs/dbraw/zinc/04/73/30/1024047330.db2.gz CZUWEIBIFIAPRK-UHFFFAOYSA-N -1 3 327.472 4.203 20 0 EIADHM CC[C@@H]1CCc2c(sc3[n-]c(COc4ccccc4)nc(=O)c23)C1 ZINC000510628556 1024115982 /nfs/dbraw/zinc/11/59/82/1024115982.db2.gz IXNFZDMOLMQOPZ-GFCCVEGCSA-N -1 3 340.448 4.491 20 0 EIADHM CC[C@H]1CCc2c(sc3[n-]c(COc4ccccc4)nc(=O)c23)C1 ZINC000510628560 1024117958 /nfs/dbraw/zinc/11/79/58/1024117958.db2.gz IXNFZDMOLMQOPZ-LBPRGKRZSA-N -1 3 340.448 4.491 20 0 EIADHM Cc1ccc(-c2nc(-c3cc(F)cc(Br)c3)no2)c([O-])c1 ZINC000091332310 1024254924 /nfs/dbraw/zinc/25/49/24/1024254924.db2.gz WNANWHVKXJAOFE-UHFFFAOYSA-N -1 3 349.159 4.319 20 0 EIADHM C[C@H]1CO[C@@H](c2ccccc2Cl)CN1Cc1cc([O-])cc(F)c1 ZINC000473142201 1024456912 /nfs/dbraw/zinc/45/69/12/1024456912.db2.gz PSQLKEQAGVBEHU-KPZWWZAWSA-N -1 3 335.806 4.147 20 0 EIADHM CN(C)[C@@H](C/N=C/c1cc(Cl)cc(Cl)c1[O-])c1ccccc1 ZINC000022727999 1024525583 /nfs/dbraw/zinc/52/55/83/1024525583.db2.gz JQZJQKIBMQZQKA-UWSDUSPXSA-N -1 3 337.250 4.421 20 0 EIADHM Cc1cc([C@H](C)N2C[C@]3(C[C@@H]4CC[C@H]3C4)OC(C)(C)C2)oc1C(=O)[O-] ZINC000652447107 1024836836 /nfs/dbraw/zinc/83/68/36/1024836836.db2.gz PUOJRSWMEXYAIL-YYQBIWNASA-N -1 3 347.455 4.017 20 0 EIADHM C[C@H](CCSc1ccccc1)N1Cc2ccccc2[C@H](C(=O)[O-])C1 ZINC000652469724 1024845005 /nfs/dbraw/zinc/84/50/05/1024845005.db2.gz CXGSFCRWRDOPBW-DNVCBOLYSA-N -1 3 341.476 4.241 20 0 EIADHM O=C([O-])c1cccc2c1CN(CCSc1ccc(Cl)cc1)CC2 ZINC000652487494 1024852331 /nfs/dbraw/zinc/85/23/31/1024852331.db2.gz HJXTWGVDPWLZBC-UHFFFAOYSA-N -1 3 347.867 4.189 20 0 EIADHM O=C([O-])CC[C@@H]1CCCCN1Cc1nc(-c2ccccc2)cs1 ZINC000652496314 1024853829 /nfs/dbraw/zinc/85/38/29/1024853829.db2.gz RLUUGKLCAPUUBK-HNNXBMFYSA-N -1 3 330.453 4.029 20 0 EIADHM O=C([O-])CC[C@@H]1CCCN(CCc2cccc(Cl)c2Cl)C1 ZINC000652495234 1024854730 /nfs/dbraw/zinc/85/47/30/1024854730.db2.gz PASAKANVECDJDS-LBPRGKRZSA-N -1 3 330.255 4.113 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1c[nH]cc1-c1ccccc1F ZINC000427041649 1024930434 /nfs/dbraw/zinc/93/04/34/1024930434.db2.gz UMUKXDPKTQHRDA-UHFFFAOYSA-N -1 3 330.746 4.432 20 0 EIADHM C[C@@H](Cc1cccc(F)c1)N(C)C(=O)CCCc1ccc([O-])c(F)c1 ZINC000458234819 1024966465 /nfs/dbraw/zinc/96/64/65/1024966465.db2.gz CYDMSAWXYRMLKL-AWEZNQCLSA-N -1 3 347.405 4.083 20 0 EIADHM CC[C@@H](C)c1ccc(S(=O)(=O)[N-]c2cc(F)ccc2F)cc1 ZINC000007405109 1025397742 /nfs/dbraw/zinc/39/77/42/1025397742.db2.gz NXRQMDBMIASCJG-LLVKDONJSA-N -1 3 325.380 4.279 20 0 EIADHM O=c1[n-]c(CSc2ccc(F)cc2F)nc2c3ccccc3oc21 ZINC000006997719 1025808051 /nfs/dbraw/zinc/80/80/51/1025808051.db2.gz HNUXMKMPSYMNQN-UHFFFAOYSA-N -1 3 344.342 4.240 20 0 EIADHM Cc1ccc(C)c(S(=O)(=O)[N-]c2cc(C(F)(F)F)ccc2F)c1 ZINC000014254823 1025866183 /nfs/dbraw/zinc/86/61/83/1025866183.db2.gz XJTAPCGRUGLBPN-UHFFFAOYSA-N -1 3 347.333 4.262 20 0 EIADHM CC[C@H]([N-]C(=O)C(F)(F)c1cccc(Cl)c1)c1nc(C)cs1 ZINC000729447553 1025882841 /nfs/dbraw/zinc/88/28/41/1025882841.db2.gz CTKUEWLJBGQCJC-LBPRGKRZSA-N -1 3 344.814 4.464 20 0 EIADHM O=C([N-]c1nnc(C2CCCCC2)s1)c1cc(F)c(F)c(F)c1 ZINC000728462839 1025919081 /nfs/dbraw/zinc/91/90/81/1025919081.db2.gz SKQPWOKZHMZBNJ-UHFFFAOYSA-N -1 3 341.358 4.255 20 0 EIADHM CCCOc1ccc(C(C)(C)NC(=O)c2cc([O-])ccc2Cl)cc1 ZINC000511062235 1026056530 /nfs/dbraw/zinc/05/65/30/1026056530.db2.gz CVVGVZHNIMTFMJ-UHFFFAOYSA-N -1 3 347.842 4.500 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)c1ccc(-c2ccc(F)cc2)s1 ZINC000303764069 1026191052 /nfs/dbraw/zinc/19/10/52/1026191052.db2.gz FTOQYTDIXQZHEK-UHFFFAOYSA-N -1 3 345.370 4.329 20 0 EIADHM C[C@H](NCc1ccc([O-])c(F)c1)c1ccc(C(F)(F)F)nc1Cl ZINC000894612619 1026257293 /nfs/dbraw/zinc/25/72/93/1026257293.db2.gz KLOFBDQNTBFQLF-QMMMGPOBSA-N -1 3 348.727 4.449 20 0 EIADHM C[C@@H](CNCc1nc(C(=O)[O-])cs1)Cc1ccc(C(C)(C)C)cc1 ZINC000277525753 1026371979 /nfs/dbraw/zinc/37/19/79/1026371979.db2.gz YZAHWCGAACRPST-CYBMUJFWSA-N -1 3 346.496 4.107 20 0 EIADHM O=C(Nc1ccc(OC(F)(F)F)cc1)c1cc([O-])ccc1Cl ZINC000320167726 1026398441 /nfs/dbraw/zinc/39/84/41/1026398441.db2.gz YCTBOSONIDUASM-UHFFFAOYSA-N -1 3 331.677 4.197 20 0 EIADHM CSc1ccc(C(=O)[N-]c2nnc(-c3ccc(C)cc3C)s2)o1 ZINC000112240124 1026411777 /nfs/dbraw/zinc/41/17/77/1026411777.db2.gz VKTNCOVGCKJPDS-UHFFFAOYSA-N -1 3 345.449 4.389 20 0 EIADHM O=C([O-])C[C@@H](NCc1ccc(Cl)c(Cl)c1)c1ccsc1 ZINC000426684952 1026473518 /nfs/dbraw/zinc/47/35/18/1026473518.db2.gz DKEUZGQEEKPPCX-CYBMUJFWSA-N -1 3 330.236 4.361 20 0 EIADHM O=C([O-])C[C@@H](NCc1cccc(-c2cccnc2)c1)c1ccsc1 ZINC000426693062 1026495037 /nfs/dbraw/zinc/49/50/37/1026495037.db2.gz XOCOLDHABXHWEB-GOSISDBHSA-N -1 3 338.432 4.116 20 0 EIADHM O=C([O-])[C@@H](NCc1cc(F)cc(Cl)c1)c1cccc(Cl)c1 ZINC000426738840 1026519051 /nfs/dbraw/zinc/51/90/51/1026519051.db2.gz ZGCHPXZIOGSUAW-AWEZNQCLSA-N -1 3 328.170 4.048 20 0 EIADHM CSc1ccc(CN[C@@H](C(=O)[O-])c2ccc(Cl)c(F)c2)cc1 ZINC000426755607 1026543395 /nfs/dbraw/zinc/54/33/95/1026543395.db2.gz DNQOZLBCLCEMHQ-OAHLLOKOSA-N -1 3 339.819 4.117 20 0 EIADHM Cc1nc(C)c(CN[C@@H](CC(=O)[O-])c2ccc(C(C)C)cc2)s1 ZINC000426769503 1026548149 /nfs/dbraw/zinc/54/81/49/1026548149.db2.gz JMOUWYGXQYNVBC-INIZCTEOSA-N -1 3 332.469 4.189 20 0 EIADHM O=C([O-])C[C@@H](NCc1cnc(-c2ccsc2)s1)c1ccccc1 ZINC000426770249 1026550374 /nfs/dbraw/zinc/55/03/74/1026550374.db2.gz QIHIZTXNQUXINN-OAHLLOKOSA-N -1 3 344.461 4.177 20 0 EIADHM COc1cccc([C@@H](CC(=O)[O-])NCc2ccc(C(C)(C)C)s2)c1 ZINC000426805555 1026561462 /nfs/dbraw/zinc/56/14/62/1026561462.db2.gz CLSRCMPLNYJACQ-MRXNPFEDSA-N -1 3 347.480 4.360 20 0 EIADHM O=C([O-])C[C@H](NCc1cc2ccc(F)cc2[nH]1)c1cccc(Cl)c1 ZINC000426803212 1026571291 /nfs/dbraw/zinc/57/12/91/1026571291.db2.gz LDDDASMZQFVFLK-INIZCTEOSA-N -1 3 346.789 4.266 20 0 EIADHM CC(C)Oc1cccc(CN[C@H](CC(=O)[O-])c2cccc(Cl)c2)c1 ZINC000426826545 1026582994 /nfs/dbraw/zinc/58/29/94/1026582994.db2.gz FFQCYNPUGUKUAI-GOSISDBHSA-N -1 3 347.842 4.433 20 0 EIADHM COc1ccc(CN[C@H](CC(=O)[O-])c2ccc(C(C)C)cc2)cc1F ZINC000426824775 1026583979 /nfs/dbraw/zinc/58/39/79/1026583979.db2.gz NYTHZYKUXCFZJP-GOSISDBHSA-N -1 3 345.414 4.263 20 0 EIADHM Cc1cc([C@H](NCc2cc3c(cccc3F)[nH]2)C(=O)[O-])ccc1Cl ZINC000426828664 1026586136 /nfs/dbraw/zinc/58/61/36/1026586136.db2.gz LXZCOZBXPVXFJI-KRWDZBQOSA-N -1 3 346.789 4.184 20 0 EIADHM COc1ccc([C@@H]2CCCN2Cc2cccc([O-])c2Cl)c(OC)c1 ZINC000507027535 1026594551 /nfs/dbraw/zinc/59/45/51/1026594551.db2.gz VTIHRUHJXADKIN-INIZCTEOSA-N -1 3 347.842 4.400 20 0 EIADHM Cc1ccccc1[C@@H](CC(C)C)NC(=O)c1c[n-]c2ccccc2c1=O ZINC000112324119 1026671727 /nfs/dbraw/zinc/67/17/27/1026671727.db2.gz IJBZJYSBQJHCLC-HXUWFJFHSA-N -1 3 348.446 4.354 20 0 EIADHM Cc1ccc([O-])c(CN(C)[C@@H](C)c2ccccc2Br)n1 ZINC000507222402 1026707695 /nfs/dbraw/zinc/70/76/95/1026707695.db2.gz UFGMTMUXUXGWIQ-LBPRGKRZSA-N -1 3 335.245 4.051 20 0 EIADHM CCCOc1ccc([N-]S(=O)(=O)c2ccc(F)cc2C)c(C)c1 ZINC000511141199 1026729970 /nfs/dbraw/zinc/72/99/70/1026729970.db2.gz JDVBOGJWHUZGDV-UHFFFAOYSA-N -1 3 337.416 4.032 20 0 EIADHM CS[C@@H]1CCCCN([C@@H](C(=O)[O-])c2cc(Cl)cc(Cl)c2)C1 ZINC000519602345 1026764215 /nfs/dbraw/zinc/76/42/15/1026764215.db2.gz HYPLBUJDOUYJPC-ZIAGYGMSSA-N -1 3 348.295 4.337 20 0 EIADHM CS[C@H]1CCCCN([C@@H](C(=O)[O-])c2cc(Cl)cc(Cl)c2)C1 ZINC000519602342 1026764551 /nfs/dbraw/zinc/76/45/51/1026764551.db2.gz HYPLBUJDOUYJPC-UONOGXRCSA-N -1 3 348.295 4.337 20 0 EIADHM COc1cccc(C(=O)Nc2cccc(CCC(F)(F)F)c2)c1[O-] ZINC000440706844 1027019119 /nfs/dbraw/zinc/01/91/19/1027019119.db2.gz VOKWQZCEMUFKAB-UHFFFAOYSA-N -1 3 339.313 4.148 20 0 EIADHM Cc1ccc(-c2noc([N-]Cc3coc(-c4cccs4)n3)n2)cc1 ZINC000302060847 1027203178 /nfs/dbraw/zinc/20/31/78/1027203178.db2.gz REHOPGTXZAPSNY-UHFFFAOYSA-N -1 3 338.392 4.374 20 0 EIADHM CCc1nnc([N-]C(=O)c2cnc(-c3ccc(C)cc3C)s2)s1 ZINC000061111359 1027347340 /nfs/dbraw/zinc/34/73/40/1027347340.db2.gz MIRFOGJJBXAKEW-UHFFFAOYSA-N -1 3 344.465 4.093 20 0 EIADHM CCC(CC)c1nnc([N-]C(=O)c2cnc(C(C)(C)C)s2)s1 ZINC000108987172 1027785251 /nfs/dbraw/zinc/78/52/51/1027785251.db2.gz YVFRNUPDQVJGPV-UHFFFAOYSA-N -1 3 338.502 4.448 20 0 EIADHM CC(C)Oc1cccnc1-c1noc(-c2ccc(C(C)C)cc2[O-])n1 ZINC000664994021 1027843886 /nfs/dbraw/zinc/84/38/86/1027843886.db2.gz WSAFMENOXTXSRL-UHFFFAOYSA-N -1 3 339.395 4.415 20 0 EIADHM CC(C)Sc1cccc(Cl)c1CN1CC[C@H](C)[C@H](C(=O)[O-])C1 ZINC000583024766 1027861515 /nfs/dbraw/zinc/86/15/15/1027861515.db2.gz JKXBSKOANSNBOD-QWHCGFSZSA-N -1 3 341.904 4.383 20 0 EIADHM [O-]c1c(F)cc(Nc2cn3cc(C(F)(F)F)ccc3n2)cc1F ZINC001213377437 1028033931 /nfs/dbraw/zinc/03/39/31/1028033931.db2.gz OXHNYWRLEJSKFB-UHFFFAOYSA-N -1 3 329.228 4.081 20 0 EIADHM O=S(=O)([N-]c1ccsc1Cl)c1ccc(C(F)(F)F)cc1 ZINC000189730238 1028210959 /nfs/dbraw/zinc/21/09/59/1028210959.db2.gz CMVRMZIHTPOQMU-UHFFFAOYSA-N -1 3 341.763 4.221 20 0 EIADHM CC(C)(C)c1cc(Nc2ccc(Cl)cc2S(=O)(=O)[O-])ccn1 ZINC001213166502 1028218547 /nfs/dbraw/zinc/21/85/47/1028218547.db2.gz FVGFHIAVSNPJCW-UHFFFAOYSA-N -1 3 340.832 4.023 20 0 EIADHM Cc1c(Cl)c(CN2CCCC[C@@H]2CCC(=O)[O-])nc2ccccc12 ZINC000324306686 1028241955 /nfs/dbraw/zinc/24/19/55/1028241955.db2.gz XRWYCHRZSAWCRJ-CQSZACIVSA-N -1 3 346.858 4.416 20 0 EIADHM C[C@H](C(=O)OC(C)(C)C)c1noc(-c2cc3ccccc3cc2[O-])n1 ZINC000280941558 1028286639 /nfs/dbraw/zinc/28/66/39/1028286639.db2.gz SNHFOYLJHLDYQS-NSHDSACASA-N -1 3 340.379 4.041 20 0 EIADHM [O-]c1ccc(CNc2ccc(C(F)(F)F)cn2)cc1Br ZINC000155640339 1028476087 /nfs/dbraw/zinc/47/60/87/1028476087.db2.gz GXSUDVFVVCQGOR-UHFFFAOYSA-N -1 3 347.134 4.181 20 0 EIADHM CC[C@H](c1ccccc1OC)N(C)C(=O)c1cc([O-])ccc1Cl ZINC000583337879 1028538858 /nfs/dbraw/zinc/53/88/58/1028538858.db2.gz OGNVPOSIHYULLA-MRXNPFEDSA-N -1 3 333.815 4.278 20 0 EIADHM COc1ccc([O-])c(C(=O)Nc2cccc(NC3CCCC3)c2)c1 ZINC000522759971 1028760666 /nfs/dbraw/zinc/76/06/66/1028760666.db2.gz FNJCREBGJLOIDT-UHFFFAOYSA-N -1 3 326.396 4.008 20 0 EIADHM COc1cc(Br)c(Nc2cc(F)c([O-])c(F)c2)cc1C ZINC001213386614 1028777364 /nfs/dbraw/zinc/77/73/64/1028777364.db2.gz LUSJJEAPAOUFOO-UHFFFAOYSA-N -1 3 344.155 4.494 20 0 EIADHM Cc1ccc2c(Cc3noc(-c4ccc(C)cc4[O-])n3)cn(C)c2c1 ZINC000445627613 1028796428 /nfs/dbraw/zinc/79/64/28/1028796428.db2.gz QQPLBMITVMJAEH-UHFFFAOYSA-N -1 3 333.391 4.142 20 0 EIADHM Cc1cccc([N-]S(=O)(=O)c2ccc(OC(C)C)c(C)c2)c1C ZINC000614732154 1029287652 /nfs/dbraw/zinc/28/76/52/1029287652.db2.gz IGDUCXIUCLEPTE-UHFFFAOYSA-N -1 3 333.453 4.200 20 0 EIADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)[C@@H](C)CC(C)(C)C)c2)n1 ZINC000475376863 1029598481 /nfs/dbraw/zinc/59/84/81/1029598481.db2.gz YXFHUUBBZHVQJG-ZDUSSCGKSA-N -1 3 341.455 4.422 20 0 EIADHM CC1CCC(OC2CCN([C@@H](C(=O)[O-])c3ccccc3F)CC2)CC1 ZINC000584118768 1029627723 /nfs/dbraw/zinc/62/77/23/1029627723.db2.gz LBJHZUYZGGDUHN-JFIBYHEFSA-N -1 3 349.446 4.011 20 0 EIADHM O=c1[n-]c(N[C@@H]2C[C@H]2c2ccc(F)c(F)c2)c(Cl)cc1Cl ZINC001168065120 1029640854 /nfs/dbraw/zinc/64/08/54/1029640854.db2.gz VBEHFBOMLROIPA-JVXZTZIISA-N -1 3 331.149 4.340 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2c(C)c(C)ccc2Cl)c(F)c1 ZINC000446963890 1029653437 /nfs/dbraw/zinc/65/34/37/1029653437.db2.gz DIDVXCYCXJVBAQ-UHFFFAOYSA-N -1 3 327.808 4.205 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(NCc3cccc(Cl)c3)nc2)n1 ZINC000301186809 1029684158 /nfs/dbraw/zinc/68/41/58/1029684158.db2.gz STEDQVOZUSQCGD-UHFFFAOYSA-N -1 3 340.814 4.072 20 0 EIADHM C[C@H](C1CC1)N(Cc1csc(-c2ccc(C(=O)[O-])cc2)n1)C1CC1 ZINC000584237328 1029687296 /nfs/dbraw/zinc/68/72/96/1029687296.db2.gz USZSFUVDTMKMHQ-GFCCVEGCSA-N -1 3 342.464 4.271 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(NC[C@@H](C)c3ccc(C)cc3)nc2)n1 ZINC000301382426 1029721557 /nfs/dbraw/zinc/72/15/57/1029721557.db2.gz SUXPTHIAOLOFIV-OAHLLOKOSA-N -1 3 348.450 4.331 20 0 EIADHM CCC[C@@H](Nc1ccc(-c2nc(CC)cc(=O)[n-]2)cn1)c1ccccc1 ZINC000080952312 1029767210 /nfs/dbraw/zinc/76/72/10/1029767210.db2.gz KCQBXVGJYZSCNP-GOSISDBHSA-N -1 3 348.450 4.348 20 0 EIADHM CC[C@H](c1nnc([N-]C(=O)c2csnc2C)s1)c1ccccc1 ZINC000181962826 1029930144 /nfs/dbraw/zinc/93/01/44/1029930144.db2.gz ZTGOGYQRNBGGJZ-LBPRGKRZSA-N -1 3 344.465 4.097 20 0 EIADHM CCCCOc1ccc(C(=O)Nc2cccc(C(C)=O)c2[O-])cc1 ZINC000147228007 1030083665 /nfs/dbraw/zinc/08/36/65/1030083665.db2.gz OZNSTFQYMZRYSQ-UHFFFAOYSA-N -1 3 327.380 4.026 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@@H](C)c3cccc(C)c3)nc2)n1 ZINC000450944774 1030125080 /nfs/dbraw/zinc/12/50/80/1030125080.db2.gz JVVYPXHYUXUHLI-AWEZNQCLSA-N -1 3 334.423 4.288 20 0 EIADHM CCS[C@H]1CCCC[C@H]1NC(=O)c1cc([O-])c2ccccc2c1 ZINC000525935496 1030128133 /nfs/dbraw/zinc/12/81/33/1030128133.db2.gz JQCSLHBGIDUXAI-AEFFLSMTSA-N -1 3 329.465 4.340 20 0 EIADHM O=C(Nc1ccc(NCCc2ccccc2)cc1)c1c([O-])cccc1O ZINC000447549418 1030150736 /nfs/dbraw/zinc/15/07/36/1030150736.db2.gz LMKVOKKCBHXPCE-UHFFFAOYSA-N -1 3 348.402 4.005 20 0 EIADHM C[C@@H]1CC(C(=O)[O-])C[C@@H](C)N1CCc1cc(Cl)ccc1Cl ZINC000530172820 1030192437 /nfs/dbraw/zinc/19/24/37/1030192437.db2.gz AVWZUTHZDIJDCQ-GHMZBOCLSA-N -1 3 330.255 4.110 20 0 EIADHM C[C@H]1CC(C(=O)[O-])C[C@H](C)N1Cc1ncc(-c2cccc(Cl)c2)o1 ZINC000530174791 1030196064 /nfs/dbraw/zinc/19/60/64/1030196064.db2.gz BCVQMKDSYDZZNB-RYUDHWBXSA-N -1 3 348.830 4.069 20 0 EIADHM C[C@@H]1CC(C(=O)[O-])C[C@@H](C)N1Cc1csc(-c2ccc(F)cc2)n1 ZINC000530178481 1030201479 /nfs/dbraw/zinc/20/14/79/1030201479.db2.gz JEPPJCRNZXYMGH-VXGBXAGGSA-N -1 3 348.443 4.023 20 0 EIADHM CCc1onc(-c2ccccc2)c1C(=O)Nc1cccc([O-])c1F ZINC000527002967 1030373507 /nfs/dbraw/zinc/37/35/07/1030373507.db2.gz DPRZBNAAPNTYGZ-UHFFFAOYSA-N -1 3 326.327 4.001 20 0 EIADHM CC(C)c1ccc(CNC(=O)CCCc2ccc([O-])c(F)c2)cc1 ZINC000468400455 1030381192 /nfs/dbraw/zinc/38/11/92/1030381192.db2.gz CFTLXVKMBGKSQF-UHFFFAOYSA-N -1 3 329.415 4.294 20 0 EIADHM Cc1ccccc1S(=O)(=O)[N-]c1ccc(OC2CCCC2)cc1 ZINC000321582905 1030455578 /nfs/dbraw/zinc/45/55/78/1030455578.db2.gz VWXUEHKRWDGGTN-UHFFFAOYSA-N -1 3 331.437 4.117 20 0 EIADHM CC(C)Sc1ccc(Cl)cc1NC(=O)c1cccc2n[n-]nc21 ZINC000527107123 1030484101 /nfs/dbraw/zinc/48/41/01/1030484101.db2.gz QCHZWCZIOKLWFQ-UHFFFAOYSA-N -1 3 346.843 4.364 20 0 EIADHM O=C(Nc1cccc(Oc2ccccc2)c1)c1cccc2n[n-]nc21 ZINC000527357478 1030666928 /nfs/dbraw/zinc/66/69/28/1030666928.db2.gz PGKVETLQLPBZFX-UHFFFAOYSA-N -1 3 330.347 4.003 20 0 EIADHM CCC(CC)c1cc(C(=O)N=c2cc(-c3ccccc3F)o[n-]2)on1 ZINC000448493043 1030821798 /nfs/dbraw/zinc/82/17/98/1030821798.db2.gz RTNPBVWNVYVGEU-UHFFFAOYSA-N -1 3 343.358 4.047 20 0 EIADHM CC1(C(=O)Nc2ccc(Br)cc2[O-])CCC(F)(F)CC1 ZINC000527931066 1030975767 /nfs/dbraw/zinc/97/57/67/1030975767.db2.gz LJAWVWWNGXIOKP-UHFFFAOYSA-N -1 3 348.187 4.309 20 0 EIADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)[C@H]3CCC[C@H]3CC)c2)n1 ZINC000448723470 1030987382 /nfs/dbraw/zinc/98/73/82/1030987382.db2.gz HVRWBXDTIPYUBY-DYVFJYSZSA-N -1 3 339.439 4.176 20 0 EIADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)[C@@H]3C[C@H]3CC(C)C)c2)n1 ZINC000448726241 1030989873 /nfs/dbraw/zinc/98/98/73/1030989873.db2.gz RZPXQVUPRUCKRX-RHSMWYFYSA-N -1 3 339.439 4.032 20 0 EIADHM C[C@H](CC(=O)Nc1cc(Br)ccc1[O-])c1ccccc1 ZINC000531393967 1031169132 /nfs/dbraw/zinc/16/91/32/1031169132.db2.gz PDSCQXKEPUFDPP-LLVKDONJSA-N -1 3 334.213 4.287 20 0 EIADHM Cc1ccc(C)c([N-]S(=O)(=O)c2ccc(OC3CCCC3)cc2)c1 ZINC000096659199 1031196345 /nfs/dbraw/zinc/19/63/45/1031196345.db2.gz BXYFQJQNKRKQKT-UHFFFAOYSA-N -1 3 345.464 4.426 20 0 EIADHM C[C@H]1C[C@@H](C(F)(F)F)CCN1C(=O)CCCc1ccc([O-])c(F)c1 ZINC000452650630 1031218781 /nfs/dbraw/zinc/21/87/81/1031218781.db2.gz VKZHQDJZHJAGGE-AAEUAGOBSA-N -1 3 347.352 4.043 20 0 EIADHM CCC(CC)c1nnc([N-]C(=O)c2coc(Br)c2)s1 ZINC000030654986 1031252682 /nfs/dbraw/zinc/25/26/82/1031252682.db2.gz QGYWHIFFSBEGDC-UHFFFAOYSA-N -1 3 344.234 4.050 20 0 EIADHM Cn1ccnc1[C@@H]([N-]c1nc2cc(F)ccc2o1)c1cccc(F)c1 ZINC000114446645 1031368976 /nfs/dbraw/zinc/36/89/76/1031368976.db2.gz MGIDHYPSQSPYEQ-INIZCTEOSA-N -1 3 340.333 4.041 20 0 EIADHM O=C(N[C@H](c1ccccc1)[C@H]1CCOC1)c1cc([O-])c2ccccc2c1 ZINC000375921198 1031516748 /nfs/dbraw/zinc/51/67/48/1031516748.db2.gz QLAGJSVUQNLYQB-LAUBAEHRSA-N -1 3 347.414 4.053 20 0 EIADHM CCSCc1ccnc(NC(=O)c2cc([O-])c3ccccc3c2)c1 ZINC000472438146 1031627526 /nfs/dbraw/zinc/62/75/26/1031627526.db2.gz ONBXWOAKYUSPJY-UHFFFAOYSA-N -1 3 338.432 4.446 20 0 EIADHM O=C([N-]c1nnc(-c2ccsc2)s1)c1ccc(Cl)s1 ZINC000048706414 1031853436 /nfs/dbraw/zinc/85/34/36/1031853436.db2.gz PYRARBCYRZIWNU-UHFFFAOYSA-N -1 3 327.843 4.234 20 0 EIADHM Cc1nc(C(C)C)sc1[C@H](C)N(C)Cc1cc(=O)[n-]c(C2CC2)n1 ZINC000459366276 1031954021 /nfs/dbraw/zinc/95/40/21/1031954021.db2.gz BRLDVIGOQJCKDQ-LBPRGKRZSA-N -1 3 346.500 4.141 20 0 EIADHM O=C(Nc1cc(F)ccc1[O-])c1cc(-c2ccccn2)ccc1Cl ZINC000134131968 1031994583 /nfs/dbraw/zinc/99/45/83/1031994583.db2.gz SWHLDWYRDHVWGG-UHFFFAOYSA-N -1 3 342.757 4.499 20 0 EIADHM [O-]c1cccc(CNCc2ccccc2OC(F)(F)F)c1Cl ZINC000645143962 1033837709 /nfs/dbraw/zinc/83/77/09/1033837709.db2.gz OWXPKOJYMZICTA-UHFFFAOYSA-N -1 3 331.721 4.234 20 0 EIADHM CC[C@@](C)(O)CN(Cc1ccccc1)Cc1cccc([O-])c1Cl ZINC000513040965 1034349709 /nfs/dbraw/zinc/34/97/09/1034349709.db2.gz MDSJAXJVIQJVEZ-LJQANCHMSA-N -1 3 333.859 4.209 20 0 EIADHM CC(C)(C)c1ncsc1C(=O)[N-]c1nnc(-c2ccccc2)s1 ZINC000473492386 1034375284 /nfs/dbraw/zinc/37/52/84/1034375284.db2.gz OITTYUCQKYXHAT-UHFFFAOYSA-N -1 3 344.465 4.211 20 0 EIADHM [O-]c1ccc(F)c(CN2CC[C@@H](C(F)(F)F)C3(CCC3)C2)c1F ZINC000513547189 1035028198 /nfs/dbraw/zinc/02/81/98/1035028198.db2.gz AFNOPEKMENHOLD-CYBMUJFWSA-N -1 3 335.316 4.225 20 0 EIADHM CCOc1ccc(CNCc2c(F)ccc([O-])c2F)cc1Cl ZINC000513625737 1035077143 /nfs/dbraw/zinc/07/71/43/1035077143.db2.gz WGGCHQXUKLESOX-UHFFFAOYSA-N -1 3 327.758 4.012 20 0 EIADHM Cc1ccc(-c2csc3[n-]c(-c4ccncn4)nc(=O)c23)c(C)c1 ZINC000345346749 1035203386 /nfs/dbraw/zinc/20/33/86/1035203386.db2.gz MZOOKGVNEMNTLV-UHFFFAOYSA-N -1 3 334.404 4.138 20 0 EIADHM [O-]c1ccc(Cc2nc(-c3ccsc3C(F)(F)F)no2)cc1F ZINC000904921786 1035662264 /nfs/dbraw/zinc/66/22/64/1035662264.db2.gz QQHKMZQOYBHUHD-UHFFFAOYSA-N -1 3 344.289 4.252 20 0 EIADHM CC(C)(C)[C@@H]1OCCC[C@@H]1CNC(=O)c1cc([O-])c2ccccc2c1 ZINC000575222426 1035728970 /nfs/dbraw/zinc/72/89/70/1035728970.db2.gz AEHRSXXTLITWMA-DNVCBOLYSA-N -1 3 341.451 4.117 20 0 EIADHM CC1(C)[C@@H](c2ccccc2)CCN1Cc1nc(=O)c2sccc2[n-]1 ZINC000421031362 1035963741 /nfs/dbraw/zinc/96/37/41/1035963741.db2.gz ZULYANVLKGLNRF-CQSZACIVSA-N -1 3 339.464 4.165 20 0 EIADHM CCN(C(=O)c1cccc(C)c1[O-])c1cccc(Br)c1 ZINC000436752637 1036013839 /nfs/dbraw/zinc/01/38/39/1036013839.db2.gz AAAOVPKKEJFLSY-UHFFFAOYSA-N -1 3 334.213 4.130 20 0 EIADHM CCc1ccc([O-])c(C(=O)N2CCC(c3c(F)cccc3F)CC2)c1 ZINC000485599771 1036058481 /nfs/dbraw/zinc/05/84/81/1036058481.db2.gz NGFKEHCPVHCLAQ-UHFFFAOYSA-N -1 3 345.389 4.253 20 0 EIADHM CCSc1ccc(Cl)cc1NC(=O)c1cc(=O)[n-]c(C2CC2)n1 ZINC000571535408 1036081521 /nfs/dbraw/zinc/08/15/21/1036081521.db2.gz NMCLNSGNMPQLGB-UHFFFAOYSA-N -1 3 349.843 4.077 20 0 EIADHM O=c1cc(C=Cc2ccc(C(F)(F)F)cc2)nc(-c2ccncc2)[n-]1 ZINC000486008651 1036427394 /nfs/dbraw/zinc/42/73/94/1036427394.db2.gz SGYXQTYUTKDLPZ-ZZXKWVIFSA-N -1 3 343.308 4.021 20 0 EIADHM Cc1ccccc1C1(C(=O)Nc2ccc(Br)cc2[O-])CC1 ZINC000588842534 1036548239 /nfs/dbraw/zinc/54/82/39/1036548239.db2.gz AQOBQYXNQOCFNW-UHFFFAOYSA-N -1 3 346.224 4.133 20 0 EIADHM CCC[C@H]1CCCC[C@@H]1C[N-]S(=O)(=O)c1cc(F)ccc1Cl ZINC001212163373 1037053271 /nfs/dbraw/zinc/05/32/71/1037053271.db2.gz VKMRCDQXLHJIPX-QWHCGFSZSA-N -1 3 347.883 4.364 20 0 EIADHM CC(C)N(Cc1ccccc1F)C(=O)CCCc1ccc([O-])c(F)c1 ZINC000468973132 1037210654 /nfs/dbraw/zinc/21/06/54/1037210654.db2.gz NGOBDRBVMQIUSH-UHFFFAOYSA-N -1 3 347.405 4.430 20 0 EIADHM C[C@H](NC(=O)c1cc(=O)c2ccccc2[n-]1)c1ccc2c(c1)CCCC2 ZINC000273682820 1037550790 /nfs/dbraw/zinc/55/07/90/1037550790.db2.gz JFPGYNUMOPFNEJ-AWEZNQCLSA-N -1 3 346.430 4.310 20 0 EIADHM CCN(CC)[C@@H](C(=O)Nc1cccc(Cl)c1[O-])c1ccccc1 ZINC000605892621 1037870036 /nfs/dbraw/zinc/87/00/36/1037870036.db2.gz BIBMADITKOSZJN-MRXNPFEDSA-N -1 3 332.831 4.067 20 0 EIADHM O=C(Cc1coc2ccc3ccccc3c12)NCc1ccc([O-])c(F)c1 ZINC000606537201 1038151946 /nfs/dbraw/zinc/15/19/46/1038151946.db2.gz ZDYJQKOCFBBLQO-UHFFFAOYSA-N -1 3 349.361 4.290 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1ccc(Cl)c2ncccc12 ZINC000513808162 1038223054 /nfs/dbraw/zinc/22/30/54/1038223054.db2.gz OHNPMKUAXYBQMA-UHFFFAOYSA-N -1 3 333.174 4.500 20 0 EIADHM CC(C)(C)CN(Cc1ccccc1)C(=O)NCc1ccc([O-])c(F)c1 ZINC000606714596 1038226590 /nfs/dbraw/zinc/22/65/90/1038226590.db2.gz LGRUBCKLEHVOJQ-UHFFFAOYSA-N -1 3 344.430 4.289 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(NC3C[C@H](C)C[C@@H](C)C3)nc2)n1 ZINC000606895483 1038287893 /nfs/dbraw/zinc/28/78/93/1038287893.db2.gz IQKGOBXPEKPMOW-CHWSQXEVSA-N -1 3 326.444 4.043 20 0 EIADHM COc1cc(/C=C2\COc3cc(C)cc(C)c3C2=O)cc(Cl)c1[O-] ZINC000063411724 1038310494 /nfs/dbraw/zinc/31/04/94/1038310494.db2.gz SKHSTLLDKUFGBO-AWNIVKPZSA-N -1 3 344.794 4.330 20 0 EIADHM CC[C@H](C)c1cc(C(=O)[N-]c2cc(F)c(OC(F)F)cc2F)on1 ZINC000490280509 1038469451 /nfs/dbraw/zinc/46/94/51/1038469451.db2.gz ZDJGWNQWSJMGNT-ZETCQYMHSA-N -1 3 346.280 4.320 20 0 EIADHM O=C([N-]c1nc(-c2cccs2)ns1)c1coc2cc(F)ccc12 ZINC000480742376 1038781004 /nfs/dbraw/zinc/78/10/04/1038781004.db2.gz QWMKCNBDBOZLLF-UHFFFAOYSA-N -1 3 345.380 4.404 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1ccc(F)c(Br)c1 ZINC000608354778 1038801228 /nfs/dbraw/zinc/80/12/28/1038801228.db2.gz UIQPCSIXSIWWHS-UHFFFAOYSA-N -1 3 344.567 4.200 20 0 EIADHM Cc1ccc(Oc2ccc(NC(=O)c3ccc(C)c(C)c3[O-])cc2)nn1 ZINC000608437157 1038822534 /nfs/dbraw/zinc/82/25/34/1038822534.db2.gz ZMUPSUMXKCBARM-UHFFFAOYSA-N -1 3 349.390 4.152 20 0 EIADHM Cc1cc(C(=O)Nc2cccc([O-])c2F)c(C)cc1Br ZINC000119170331 1038867921 /nfs/dbraw/zinc/86/79/21/1038867921.db2.gz VBJCOXLUMGSKGR-UHFFFAOYSA-N -1 3 338.176 4.163 20 0 EIADHM Cc1cccc([N-]S(=O)(=O)c2cc(F)ccc2Cl)c1Cl ZINC000608755223 1038892620 /nfs/dbraw/zinc/89/26/20/1038892620.db2.gz FMCUNCSVJAKIPW-UHFFFAOYSA-N -1 3 334.199 4.242 20 0 EIADHM CSCCc1ccc([N-]S(=O)(=O)c2ccc(C)cc2C)cc1 ZINC000609015589 1038993657 /nfs/dbraw/zinc/99/36/57/1038993657.db2.gz BDLBACHSTVQQIC-UHFFFAOYSA-N -1 3 335.494 4.010 20 0 EIADHM CC(=O)c1cc(F)c([N-]C(=O)c2cc(Cl)ccc2F)c(F)c1 ZINC000534066531 1039084772 /nfs/dbraw/zinc/08/47/72/1039084772.db2.gz GUCBPNNLXWPONP-UHFFFAOYSA-N -1 3 327.689 4.212 20 0 EIADHM CC(C)c1ccc(C(=O)N2CC[C@@H](C(F)(F)F)C[C@H]2C)c([O-])c1 ZINC000456109535 1039097556 /nfs/dbraw/zinc/09/75/56/1039097556.db2.gz DKLBUSZQYBEMHG-DGCLKSJQSA-N -1 3 329.362 4.319 20 0 EIADHM Cc1cc(=O)[n-]c([C@@H](C)SCc2cccc(OC(F)F)c2)n1 ZINC000121798237 1039488551 /nfs/dbraw/zinc/48/85/51/1039488551.db2.gz QRABHUVVHFLRKK-SNVBAGLBSA-N -1 3 326.368 4.086 20 0 EIADHM O=c1nc(-c2ccc3c(n2)CCCC3)[n-]c2sc3ccccc3c21 ZINC000552625340 1039698710 /nfs/dbraw/zinc/69/87/10/1039698710.db2.gz KNKXDPAMEOWSKH-UHFFFAOYSA-N -1 3 333.416 4.491 20 0 EIADHM Cc1cnc(=S)[n-]c1O[C@H](C)c1ccc(F)c(Br)c1 ZINC001225741241 1039712399 /nfs/dbraw/zinc/71/23/99/1039712399.db2.gz SXSHLNFFQFGWDP-MRVPVSSYSA-N -1 3 343.221 4.115 20 0 EIADHM O=c1[n-]c(CSc2nc3ccccc3o2)nc2c3ccccc3oc21 ZINC000061124273 1039796545 /nfs/dbraw/zinc/79/65/45/1039796545.db2.gz ZPLFTSUJFZSYSS-UHFFFAOYSA-N -1 3 349.371 4.103 20 0 EIADHM O=C(Nc1c([O-])cccc1Cl)c1cccc(Oc2ccncc2)c1 ZINC000552779976 1039817003 /nfs/dbraw/zinc/81/70/03/1039817003.db2.gz QFEMCJVYTGQDQX-UHFFFAOYSA-N -1 3 340.766 4.485 20 0 EIADHM Cn1cc(CCC(=O)Nc2c([O-])cccc2Cl)c2ccccc21 ZINC000552783308 1039818219 /nfs/dbraw/zinc/81/82/19/1039818219.db2.gz OGZIIJDDEWLVQY-UHFFFAOYSA-N -1 3 328.799 4.109 20 0 EIADHM [O-]c1ccc(F)c(CNCc2ccccc2OC2CCCC2)c1F ZINC000510001397 1039844042 /nfs/dbraw/zinc/84/40/42/1039844042.db2.gz FWVPLLPBGJHLBD-UHFFFAOYSA-N -1 3 333.378 4.282 20 0 EIADHM CO[C@@H](c1noc(-c2cc(Cc3ccccc3)ccc2[O-])n1)C(C)C ZINC000556011626 1039862093 /nfs/dbraw/zinc/86/20/93/1039862093.db2.gz PGPBRAOQBYHECC-GOSISDBHSA-N -1 3 338.407 4.377 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)NC[C@H]1CCCCC(F)(F)C1 ZINC000552997480 1039899217 /nfs/dbraw/zinc/89/92/17/1039899217.db2.gz MULJXUNQUOAGRT-AWEZNQCLSA-N -1 3 343.389 4.186 20 0 EIADHM CCC(CC)c1nnc([N-]C(=O)c2c(F)cc(C)cc2F)s1 ZINC000666969626 1040057376 /nfs/dbraw/zinc/05/73/76/1040057376.db2.gz XUHHWTSQEZAECM-UHFFFAOYSA-N -1 3 325.384 4.281 20 0 EIADHM C[C@@H]1C[C@@H](c2ccccc2)N(C(=O)CCCc2ccc([O-])c(F)c2)C1 ZINC000553337794 1040146449 /nfs/dbraw/zinc/14/64/49/1040146449.db2.gz VKEKOYXRKQPAGM-BEFAXECRSA-N -1 3 341.426 4.464 20 0 EIADHM CC(C)CCCCCC(=O)OCc1noc(-c2ccccc2[O-])n1 ZINC000783982594 1040157665 /nfs/dbraw/zinc/15/76/65/1040157665.db2.gz VDXIFJZMBGYABM-UHFFFAOYSA-N -1 3 332.400 4.092 20 0 EIADHM O=C(c1cc([O-])cc(Br)c1)N(C1CC1)C1CCCCC1 ZINC001626439863 1040182754 /nfs/dbraw/zinc/18/27/54/1040182754.db2.gz RLGLHJRGOLSFCC-UHFFFAOYSA-N -1 3 338.245 4.092 20 0 EIADHM O=C([N-]c1nnc(Cc2ccccc2)s1)c1cc(Cl)cs1 ZINC000757793273 1040222370 /nfs/dbraw/zinc/22/23/70/1040222370.db2.gz OBQGNNNJKJKZOQ-UHFFFAOYSA-N -1 3 335.841 4.096 20 0 EIADHM CC(C)c1ccc([C@@H](N=c2ncnc3[nH][n-]cc2-3)c2cccs2)cc1 ZINC000514922493 1040357287 /nfs/dbraw/zinc/35/72/87/1040357287.db2.gz SNMXLXLSFLVOAJ-QGZVFWFLSA-N -1 3 349.463 4.113 20 0 EIADHM CC[C@@H](C)Oc1cc(C)ccc1CNC(=O)c1cc([O-])ccc1Cl ZINC000551562478 1040413932 /nfs/dbraw/zinc/41/39/32/1040413932.db2.gz GGWAQDQRNAXITM-CYBMUJFWSA-N -1 3 347.842 4.461 20 0 EIADHM CCc1cccc(NC(=O)NCc2ccc([O-])c(Br)c2)c1 ZINC000482763847 1040476016 /nfs/dbraw/zinc/47/60/16/1040476016.db2.gz AWOBGPJGNSNRNA-UHFFFAOYSA-N -1 3 349.228 4.039 20 0 EIADHM Cc1noc(C)c1[N-]C(=O)c1cc(Cl)cc(Br)c1F ZINC000435753353 1040609549 /nfs/dbraw/zinc/60/95/49/1040609549.db2.gz QSVLDKYHISHILV-UHFFFAOYSA-N -1 3 347.571 4.099 20 0 EIADHM COc1ccc([O-])c(-c2nc(-c3ccc(Cl)cc3Cl)no2)c1 ZINC000445455192 1040796133 /nfs/dbraw/zinc/79/61/33/1040796133.db2.gz JKYBXUHIQIHBBD-UHFFFAOYSA-N -1 3 337.162 4.425 20 0 EIADHM CCc1cccc(C(=O)N(CC)[C@@H](C)Cc2ccc(OC)cc2)c1[O-] ZINC000539844517 1040836087 /nfs/dbraw/zinc/83/60/87/1040836087.db2.gz AHAPNKMEGJSHLT-HNNXBMFYSA-N -1 3 341.451 4.057 20 0 EIADHM Cc1ccc(C(=O)N2CCCC[C@H]2Cc2ccc(F)cc2)c([O-])c1 ZINC000539890224 1040860246 /nfs/dbraw/zinc/86/02/46/1040860246.db2.gz XJSNPBLHUYXFES-KRWDZBQOSA-N -1 3 327.399 4.077 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2cccc(C(C)(F)F)c2)c(C)c1 ZINC000436149304 1040909071 /nfs/dbraw/zinc/90/90/71/1040909071.db2.gz ANHWVPYPMQIMHX-UHFFFAOYSA-N -1 3 325.380 4.216 20 0 EIADHM CCOc1ccc([N-]S(=O)(=O)c2ccc(C)cc2C)cc1Cl ZINC000515631934 1040913676 /nfs/dbraw/zinc/91/36/76/1040913676.db2.gz GGDHTBZPCUPZFT-UHFFFAOYSA-N -1 3 339.844 4.156 20 0 EIADHM C[C@@]1(c2ccccc2)CCN(C(=O)CCCc2ccc([O-])c(F)c2)C1 ZINC000469309956 1041249692 /nfs/dbraw/zinc/24/96/92/1041249692.db2.gz LBVKKUIAJRHIPZ-OAQYLSRUSA-N -1 3 341.426 4.044 20 0 EIADHM Cc1cccc(C(C)C)c1[N-]S(=O)(=O)c1ccc2c(c1)C[C@@H](C)O2 ZINC000540205171 1041266693 /nfs/dbraw/zinc/26/66/93/1041266693.db2.gz ZAPMKWSPYIAXAE-CQSZACIVSA-N -1 3 345.464 4.243 20 0 EIADHM C[C@H](C(=O)[O-])[C@H](NCc1ccc(C(F)(F)F)s1)c1ccccc1 ZINC000904005165 1041266916 /nfs/dbraw/zinc/26/69/16/1041266916.db2.gz PVPJAXQITYOARD-HZMBPMFUSA-N -1 3 343.370 4.319 20 0 EIADHM CC(C)(C)c1csc(CN[C@H](CCc2ccccc2)CC(=O)[O-])n1 ZINC000904040135 1041291293 /nfs/dbraw/zinc/29/12/93/1041291293.db2.gz KYAFKHTWTGKGPP-OAHLLOKOSA-N -1 3 346.496 4.006 20 0 EIADHM COc1cc(CN[C@@H](CC(=O)[O-])c2cccc(C)c2)ccc1SC ZINC000904046202 1041300061 /nfs/dbraw/zinc/30/00/61/1041300061.db2.gz XGLWEMHVUGVTCF-INIZCTEOSA-N -1 3 345.464 4.031 20 0 EIADHM COc1ccc(C(=O)N2CCCC[C@@H]2CCc2ccccc2)c([O-])c1 ZINC000436523028 1041304869 /nfs/dbraw/zinc/30/48/69/1041304869.db2.gz YPVATRKNSZSAHE-QGZVFWFLSA-N -1 3 339.435 4.028 20 0 EIADHM O=C(Nc1c([O-])cccc1Cl)c1ccc(-n2cccc2)c(F)c1 ZINC000567416532 1041328205 /nfs/dbraw/zinc/32/82/05/1041328205.db2.gz XOPQCMYVVYBMMS-UHFFFAOYSA-N -1 3 330.746 4.228 20 0 EIADHM O=C(Nc1cc(Cl)c([O-])c(Cl)c1)[C@H]1CCCN1C1CCCC1 ZINC000463103295 1041345728 /nfs/dbraw/zinc/34/57/28/1041345728.db2.gz DWKJPSGZTZSFCN-CQSZACIVSA-N -1 3 343.254 4.045 20 0 EIADHM CC(C)c1ccc(C(=O)N(CC2CCC2)CC(F)(F)F)c([O-])c1 ZINC000436579888 1041358152 /nfs/dbraw/zinc/35/81/52/1041358152.db2.gz VLRRHQUMDCIZQJ-UHFFFAOYSA-N -1 3 329.362 4.320 20 0 EIADHM Cc1cccc([C@H]2CCCCCN2C(=O)c2ccc(O)cc2[O-])c1 ZINC000436623055 1041389828 /nfs/dbraw/zinc/38/98/28/1041389828.db2.gz FTGOGDAWNCSEPL-GOSISDBHSA-N -1 3 325.408 4.164 20 0 EIADHM O=C(c1c([O-])cccc1O)N1CCc2cc(-c3cccc(F)c3)ccc21 ZINC000436648181 1041404249 /nfs/dbraw/zinc/40/42/49/1041404249.db2.gz MKAQNRFRUHHFML-UHFFFAOYSA-N -1 3 349.361 4.107 20 0 EIADHM CC(C)c1ccc(C(=O)N[C@@H]2CCO[C@@H](c3ccccc3)C2)c([O-])c1 ZINC000436660012 1041413469 /nfs/dbraw/zinc/41/34/69/1041413469.db2.gz RCLQVDAMTYALEO-YLJYHZDGSA-N -1 3 339.435 4.166 20 0 EIADHM Cc1c(Br)cccc1-c1noc(-c2ccccc2[O-])n1 ZINC000436689879 1041423710 /nfs/dbraw/zinc/42/37/10/1041423710.db2.gz SJPQLWACLHSHNO-UHFFFAOYSA-N -1 3 331.169 4.180 20 0 EIADHM Cc1cccc(C(=O)Nc2ccc(-c3cnc(C4CC4)o3)cc2)c1[O-] ZINC000436762694 1041459935 /nfs/dbraw/zinc/45/99/35/1041459935.db2.gz TVYRODOIUCMBOC-UHFFFAOYSA-N -1 3 334.375 4.485 20 0 EIADHM CCc1ccc([O-])c(C(=O)N(C)[C@H](CC)c2cccc(OC)c2)c1 ZINC000436747425 1041462204 /nfs/dbraw/zinc/46/22/04/1041462204.db2.gz ALRQFWSSCZCMDY-GOSISDBHSA-N -1 3 327.424 4.187 20 0 EIADHM CCc1ccc(C(=O)N2CCC[C@H]2c2nc3cc(C)ccc3[nH]2)c([O-])c1 ZINC000436817618 1041487262 /nfs/dbraw/zinc/48/72/62/1041487262.db2.gz BOVKZELGDHAWPS-SFHVURJKSA-N -1 3 349.434 4.117 20 0 EIADHM CCc1ccc(C(=O)N2CCC[C@H]2c2nc3ccc(C)cc3[nH]2)c([O-])c1 ZINC000436817618 1041487265 /nfs/dbraw/zinc/48/72/65/1041487265.db2.gz BOVKZELGDHAWPS-SFHVURJKSA-N -1 3 349.434 4.117 20 0 EIADHM COC[C@H](C)Oc1ccc(Cl)cc1NC(=O)c1cc(C)ccc1[O-] ZINC000436822964 1041501280 /nfs/dbraw/zinc/50/12/80/1041501280.db2.gz YTPINXKGGQIDBG-LBPRGKRZSA-N -1 3 349.814 4.020 20 0 EIADHM CCc1ccc(C(=O)N(CC)[C@H](C)c2cccc(OC)c2)c([O-])c1 ZINC000436820843 1041502185 /nfs/dbraw/zinc/50/21/85/1041502185.db2.gz SUNAJOIUDCGZDH-CQSZACIVSA-N -1 3 327.424 4.187 20 0 EIADHM O=C(c1ccccc1[O-])N(Cc1ccc(F)cc1Cl)CC1CC1 ZINC000436827083 1041502941 /nfs/dbraw/zinc/50/29/41/1041502941.db2.gz MPLYSGPGPGYRCP-UHFFFAOYSA-N -1 3 333.790 4.237 20 0 EIADHM O=C(c1ccccc1[O-])N1CC[C@@H](Sc2cccc(Cl)c2)C1 ZINC000436846782 1041515581 /nfs/dbraw/zinc/51/55/81/1041515581.db2.gz YHZBYGDAVWJYEU-CQSZACIVSA-N -1 3 333.840 4.052 20 0 EIADHM Cc1cc(C(=O)Nc2cc(Cl)ccc2[O-])nn1-c1ccc(C)cc1 ZINC000436854177 1041517783 /nfs/dbraw/zinc/51/77/83/1041517783.db2.gz FXNPDFAAIQZHKO-UHFFFAOYSA-N -1 3 341.798 4.100 20 0 EIADHM COc1cccc(-c2nc(Cc3ccc(C(C)(C)C)cc3)no2)c1[O-] ZINC000436888468 1041543630 /nfs/dbraw/zinc/54/36/30/1041543630.db2.gz NDJQBZHASJOAIF-UHFFFAOYSA-N -1 3 338.407 4.339 20 0 EIADHM CCc1ccc([O-])c(C(=O)N(C)c2cccc(OC(F)(F)F)c2)c1 ZINC000538789603 1041543782 /nfs/dbraw/zinc/54/37/82/1041543782.db2.gz AZPGJENTJCGGRP-UHFFFAOYSA-N -1 3 339.313 4.130 20 0 EIADHM COc1ccc(OCc2noc(-c3ccc(C(C)C)cc3[O-])n2)cc1 ZINC000436892881 1041544906 /nfs/dbraw/zinc/54/49/06/1041544906.db2.gz LWXRBBPRYBUHJB-UHFFFAOYSA-N -1 3 340.379 4.153 20 0 EIADHM Cc1ccc(-c2nc(-c3cccc(NC(=O)C(C)C)c3)no2)c([O-])c1 ZINC000436896998 1041551360 /nfs/dbraw/zinc/55/13/60/1041551360.db2.gz PIGGVEJJUKFWQD-UHFFFAOYSA-N -1 3 337.379 4.012 20 0 EIADHM COc1cc(-c2noc(-c3ccc(C(C)C)cc3[O-])n2)ccc1F ZINC000436900017 1041553315 /nfs/dbraw/zinc/55/33/15/1041553315.db2.gz ASAYGMXOFONBAI-UHFFFAOYSA-N -1 3 328.343 4.380 20 0 EIADHM O=C(c1cc(Cc2ccccc2)ccc1[O-])N(CC1CC1)C1CCC1 ZINC000436933062 1041564081 /nfs/dbraw/zinc/56/40/81/1041564081.db2.gz SCDPPKAHDWCIPP-UHFFFAOYSA-N -1 3 335.447 4.388 20 0 EIADHM CC(C)c1ccc(-c2nc(-c3ccc4cnn(C)c4c3)no2)c([O-])c1 ZINC000436935099 1041566012 /nfs/dbraw/zinc/56/60/12/1041566012.db2.gz ZZQUTFUKJJVMBD-UHFFFAOYSA-N -1 3 334.379 4.119 20 0 EIADHM O=C(Nc1cc(F)ccc1[O-])c1coc(-c2ccccc2Cl)n1 ZINC000540630258 1041571484 /nfs/dbraw/zinc/57/14/84/1041571484.db2.gz JYZCSCFNGBOZIT-UHFFFAOYSA-N -1 3 332.718 4.092 20 0 EIADHM CCc1ccc(C(=O)N2CC[C@@H](c3cccc(Cl)c3)C2)c([O-])c1 ZINC000436985815 1041588129 /nfs/dbraw/zinc/58/81/29/1041588129.db2.gz PRCYTBRHRSTLKX-OAHLLOKOSA-N -1 3 329.827 4.238 20 0 EIADHM CCCCS[C@H](C)C(=O)Nc1ccc(Br)cc1[O-] ZINC000516487513 1041599499 /nfs/dbraw/zinc/59/94/99/1041599499.db2.gz JINNAUWHWWIGEH-SECBINFHSA-N -1 3 332.263 4.015 20 0 EIADHM CCCCS[C@@H](C)C(=O)Nc1ccc(Br)cc1[O-] ZINC000516487514 1041599585 /nfs/dbraw/zinc/59/95/85/1041599585.db2.gz JINNAUWHWWIGEH-VIFPVBQESA-N -1 3 332.263 4.015 20 0 EIADHM CC1=C(c2ccco2)CN(C(=O)c2cc([O-])c3ccccc3c2)CC1 ZINC000521467768 1041813409 /nfs/dbraw/zinc/81/34/09/1041813409.db2.gz ZJKLDVHMAAHFGV-UHFFFAOYSA-N -1 3 333.387 4.458 20 0 EIADHM CC1(C)CCc2c(OC(=O)c3cccc(Cl)c3[O-])cccc2O1 ZINC001270295750 1042009445 /nfs/dbraw/zinc/00/94/45/1042009445.db2.gz KUVCBFOROGOACC-UHFFFAOYSA-N -1 3 332.783 4.368 20 0 EIADHM CCCCc1nnc([N-]C(=O)c2ncsc2-c2ccccc2)s1 ZINC000438054067 1042021756 /nfs/dbraw/zinc/02/17/56/1042021756.db2.gz WKLAOXGSKFXTQM-UHFFFAOYSA-N -1 3 344.465 4.257 20 0 EIADHM CC(C)(C)c1ncc(C(=O)Nc2ccc([O-])c(C(F)(F)F)c2)s1 ZINC000473586718 1042058928 /nfs/dbraw/zinc/05/89/28/1042058928.db2.gz YPYUNCLJYLHDFY-UHFFFAOYSA-N -1 3 344.358 4.417 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1ncsc1-c1ccccc1 ZINC000438171230 1042071416 /nfs/dbraw/zinc/07/14/16/1042071416.db2.gz UREZDTHQYZJGEV-UHFFFAOYSA-N -1 3 330.796 4.421 20 0 EIADHM COc1ccccc1S(=O)(=O)[N-]c1cccc(C(F)F)c1Cl ZINC000541803510 1042123443 /nfs/dbraw/zinc/12/34/43/1042123443.db2.gz ALDKHOHPZILNEW-UHFFFAOYSA-N -1 3 347.770 4.087 20 0 EIADHM CCSc1cccc(Br)c1[N-]C(=O)c1ccco1 ZINC000464705558 1042135982 /nfs/dbraw/zinc/13/59/82/1042135982.db2.gz AYQCLVDQFOPHDZ-UHFFFAOYSA-N -1 3 326.215 4.406 20 0 EIADHM CCCCOc1ccc(NC(=O)c2cccc(OC)c2[O-])c(C)c1 ZINC000302943152 1042198756 /nfs/dbraw/zinc/19/87/56/1042198756.db2.gz IIKSALKRLUQOKS-UHFFFAOYSA-N -1 3 329.396 4.140 20 0 EIADHM Cc1ccc(C(=O)Nc2ccc(Oc3cccnc3)c(C)c2)c([O-])c1 ZINC000303031804 1042259586 /nfs/dbraw/zinc/25/95/86/1042259586.db2.gz RFAZPTHDTHWQKS-UHFFFAOYSA-N -1 3 334.375 4.449 20 0 EIADHM CC(C)c1ccc(C(=O)N2CC[C@@](F)(c3ccccc3)C2)c([O-])c1 ZINC000669929622 1042370418 /nfs/dbraw/zinc/37/04/18/1042370418.db2.gz CSIQBHYRWMEXMR-FQEVSTJZSA-N -1 3 327.399 4.227 20 0 EIADHM CC(C)(C)c1ccc(S(=O)(=O)[N-]c2ccc3c(c2)CCCO3)cc1 ZINC000509586522 1042393470 /nfs/dbraw/zinc/39/34/70/1042393470.db2.gz HHANUEAFQMRVCM-UHFFFAOYSA-N -1 3 345.464 4.110 20 0 EIADHM Cc1cc(=O)[n-]c([C@@H](C)N2CCC(F)(c3cccc(Cl)c3)CC2)n1 ZINC000439324992 1042588524 /nfs/dbraw/zinc/58/85/24/1042588524.db2.gz SMCIRDWDFSHXTF-CYBMUJFWSA-N -1 3 349.837 4.166 20 0 EIADHM C[C@H](C(=O)[O-])[C@H](NCc1cnc(C2CCCC2)s1)c1ccccc1 ZINC000417559461 1042877360 /nfs/dbraw/zinc/87/73/60/1042877360.db2.gz IGPLPTYFSWTWBF-GUYCJALGSA-N -1 3 344.480 4.352 20 0 EIADHM Cc1cccc([C@H]2CCCN2Cc2cccc([O-])c2Br)n1 ZINC000560576367 1043203172 /nfs/dbraw/zinc/20/31/72/1043203172.db2.gz RYLNDWNNRXWKPF-OAHLLOKOSA-N -1 3 347.256 4.195 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2cccc(SC(F)F)c2)c(C)c1 ZINC000727362946 1043209914 /nfs/dbraw/zinc/20/99/14/1043209914.db2.gz IOGCFFOZQPFWTN-UHFFFAOYSA-N -1 3 343.420 4.419 20 0 EIADHM Cc1nc(-c2cccc(Cl)c2)sc1C(=O)Nc1ncccc1[O-] ZINC000022264303 1043223082 /nfs/dbraw/zinc/22/30/82/1043223082.db2.gz VCRNGVFSOWWUNZ-UHFFFAOYSA-N -1 3 345.811 4.125 20 0 EIADHM COc1ccc([C@H](C)NC(=O)c2cc([O-])c3ccccc3c2)cc1F ZINC000525923697 1043234170 /nfs/dbraw/zinc/23/41/70/1043234170.db2.gz CSEQEKDULYGXQV-LBPRGKRZSA-N -1 3 339.366 4.184 20 0 EIADHM Cc1cn(C2CCCCC2)[nH]c1=NC(=O)c1cc([O-])c2ccccc2c1 ZINC000525930740 1043237071 /nfs/dbraw/zinc/23/70/71/1043237071.db2.gz RFLTZXXVBNEUHD-UHFFFAOYSA-N -1 3 349.434 4.230 20 0 EIADHM CCOc1cccc([C@@H]2C[C@@H]2NC(=O)c2cc([O-])c3ccccc3c2)c1 ZINC000526921003 1043245901 /nfs/dbraw/zinc/24/59/01/1043245901.db2.gz FBLWHMWYOLGJOH-PMACEKPBSA-N -1 3 347.414 4.230 20 0 EIADHM COc1c2ccccc2oc1CNC(=O)c1cc([O-])c2ccccc2c1 ZINC000526931074 1043246495 /nfs/dbraw/zinc/24/64/95/1043246495.db2.gz XGPMRVJSFSSSDO-UHFFFAOYSA-N -1 3 347.370 4.230 20 0 EIADHM O=C(N[C@@H]1COc2ccc(Cl)cc21)c1cc([O-])c2ccccc2c1 ZINC000526914996 1043246516 /nfs/dbraw/zinc/24/65/16/1043246516.db2.gz QSLKSPJREUASCB-MRXNPFEDSA-N -1 3 339.778 4.062 20 0 EIADHM O=C(c1ccc(Cl)cc1)C1CCN(Cc2cc([O-])cc(F)c2)CC1 ZINC000186183826 1043255202 /nfs/dbraw/zinc/25/52/02/1043255202.db2.gz HDWLZIYUFGXEQX-UHFFFAOYSA-N -1 3 347.817 4.280 20 0 EIADHM CN(CC1(c2ccccc2)CC1)C(=O)c1cc([O-])c2ccccc2c1 ZINC000527470490 1043262418 /nfs/dbraw/zinc/26/24/18/1043262418.db2.gz XBPKWDRNURLEEQ-UHFFFAOYSA-N -1 3 331.415 4.349 20 0 EIADHM Cc1ccc([C@H]2CCN(C(=O)c3cc([O-])c4ccccc4c3)C2)cc1 ZINC000527463625 1043262755 /nfs/dbraw/zinc/26/27/55/1043262755.db2.gz ZTBKCYNBBUMXTJ-SFHVURJKSA-N -1 3 331.415 4.484 20 0 EIADHM O=C(c1ccccc1[O-])N(Cc1ccccc1C(F)(F)F)C1CC1 ZINC000220046794 1043289484 /nfs/dbraw/zinc/28/94/84/1043289484.db2.gz FETWWWOERNQUCQ-UHFFFAOYSA-N -1 3 335.325 4.216 20 0 EIADHM [O-]c1cccc(CN2CCC[C@H]2c2cccc3c2OCCO3)c1Cl ZINC000508159580 1043296081 /nfs/dbraw/zinc/29/60/81/1043296081.db2.gz JIRRSFGGYSNYBS-HNNXBMFYSA-N -1 3 345.826 4.154 20 0 EIADHM COc1ccc(C(=O)N2CCC[C@H]2c2ccc(Cl)cc2)c([O-])c1 ZINC000220313581 1043307800 /nfs/dbraw/zinc/30/78/00/1043307800.db2.gz GMUDPQZBHZANJI-INIZCTEOSA-N -1 3 331.799 4.032 20 0 EIADHM COc1c(C)cc(C)cc1S(=O)(=O)[N-]c1c(C)cccc1Cl ZINC000509217500 1043369529 /nfs/dbraw/zinc/36/95/29/1043369529.db2.gz KORFQRFRTYMHED-UHFFFAOYSA-N -1 3 339.844 4.075 20 0 EIADHM Cc1ccc(CN(C(=O)c2cc(=O)c3ccccc3[n-]2)C2CC2)cc1C ZINC000265912957 1043380803 /nfs/dbraw/zinc/38/08/03/1043380803.db2.gz ZKLCSSPGWGICML-UHFFFAOYSA-N -1 3 346.430 4.362 20 0 EIADHM CC(C)c1ccc(/C=C\CC(=O)NCc2ccc([O-])c(F)c2)cc1 ZINC000494305346 1043414977 /nfs/dbraw/zinc/41/49/77/1043414977.db2.gz AJFXGBKLDHPPEF-ARJAWSKDSA-N -1 3 327.399 4.374 20 0 EIADHM O=C(CCC1CCCCC1)[N-]OCc1coc(-c2ccc(F)cc2)n1 ZINC000730100199 1043446750 /nfs/dbraw/zinc/44/67/50/1043446750.db2.gz FKVIGWXFKKXZHX-UHFFFAOYSA-N -1 3 346.402 4.389 20 0 EIADHM O=C([N-][C@@H]1CCc2ccc(F)cc21)C(F)(F)c1cccc(Cl)c1 ZINC000730188439 1043474740 /nfs/dbraw/zinc/47/47/40/1043474740.db2.gz FXJLOQKGOYKMLM-OAHLLOKOSA-N -1 3 339.744 4.375 20 0 EIADHM CSc1ccncc1[N-]C(=O)c1cnc(-c2ccccc2)s1 ZINC000674258039 1043504335 /nfs/dbraw/zinc/50/43/35/1043504335.db2.gz XNTZVHYVIAPFJC-UHFFFAOYSA-N -1 3 327.434 4.179 20 0 EIADHM CSc1ccncc1[N-]C(=O)c1csc(-c2ccc(F)cc2)n1 ZINC000674256185 1043504915 /nfs/dbraw/zinc/50/49/15/1043504915.db2.gz QAYXNCIMCHEWCS-UHFFFAOYSA-N -1 3 345.424 4.318 20 0 EIADHM CCCc1nnc([N-]C(=O)c2csc(-c3ccccc3C)n2)s1 ZINC000066273816 1043629230 /nfs/dbraw/zinc/62/92/30/1043629230.db2.gz LIVZPNVBZZGJOC-UHFFFAOYSA-N -1 3 344.465 4.175 20 0 EIADHM CC1(C)CC(=O)c2cc(OC(=O)c3cccc(Cl)c3[O-])ccc2O1 ZINC001128734020 1043730017 /nfs/dbraw/zinc/73/00/17/1043730017.db2.gz YINZGDWQEWWSOB-UHFFFAOYSA-N -1 3 346.766 4.009 20 0 EIADHM CCc1ccc([O-])c(C(=O)N2CC[C@H](C(F)(F)F)C(C)(C)C2)c1 ZINC000190708527 1043730269 /nfs/dbraw/zinc/73/02/69/1043730269.db2.gz BZHJDNMKDZUOHL-AWEZNQCLSA-N -1 3 329.362 4.005 20 0 EIADHM Cc1nc(-c2ccc(C(=O)Nc3cc(F)ccc3[O-])cc2)cs1 ZINC000442568357 1043739260 /nfs/dbraw/zinc/73/92/60/1043739260.db2.gz OPXWXGBSFOWNOL-UHFFFAOYSA-N -1 3 328.368 4.216 20 0 EIADHM Cc1ccc(C(=O)N2CC(Cc3ccc(C(F)(F)F)cc3)C2)c([O-])c1 ZINC000674746281 1043860074 /nfs/dbraw/zinc/86/00/74/1043860074.db2.gz IKUOUKOBBXHGEP-UHFFFAOYSA-N -1 3 349.352 4.034 20 0 EIADHM C[C@@H](c1ccccc1Br)N1CCC[C@@H](CCC(=O)[O-])C1 ZINC000226455273 1044212356 /nfs/dbraw/zinc/21/23/56/1044212356.db2.gz CTKQASCBTLOYRI-STQMWFEESA-N -1 3 340.261 4.087 20 0 EIADHM CC(C)(C)c1nsc([N-]C(=O)c2ccc(-c3ccco3)s2)n1 ZINC000675780498 1044479801 /nfs/dbraw/zinc/47/98/01/1044479801.db2.gz HHPKOZGNLVERGJ-UHFFFAOYSA-N -1 3 333.438 4.409 20 0 EIADHM O=C([N-]c1c(F)cccc1F)c1csc(Cc2ccccc2F)n1 ZINC000117564943 1044482759 /nfs/dbraw/zinc/48/27/59/1044482759.db2.gz FCOJCCPPSCGQRN-UHFFFAOYSA-N -1 3 348.349 4.404 20 0 EIADHM COc1ccccc1[C@@H]([N-]c1nc2cc(C)ccc2o1)c1nccn1C ZINC000734141045 1044500944 /nfs/dbraw/zinc/50/09/44/1044500944.db2.gz CDNYOPJMDMKMSO-GOSISDBHSA-N -1 3 348.406 4.080 20 0 EIADHM S=c1nc(-c2ccccn2)[n-]n1CN(CC1CCCCC1)C1CC1 ZINC000735297410 1044786310 /nfs/dbraw/zinc/78/63/10/1044786310.db2.gz JNARZQYQGXWGRV-UHFFFAOYSA-N -1 3 343.500 4.005 20 0 EIADHM C[C@@H](c1ccc(F)cc1)N1CCC(C(=O)c2ccc([O-])cc2)CC1 ZINC000078657802 1044809818 /nfs/dbraw/zinc/80/98/18/1044809818.db2.gz JZWJPAKPZHVEJT-AWEZNQCLSA-N -1 3 327.399 4.187 20 0 EIADHM CCCc1cc(Cl)nc([N-][C@@H](c2ccccn2)C(F)(F)F)n1 ZINC001168482404 1044814814 /nfs/dbraw/zinc/81/48/14/1044814814.db2.gz VVSYWXZGMZUPOM-LBPRGKRZSA-N -1 3 330.741 4.193 20 0 EIADHM CC(C)c1ccc(C(C)(C)NC(=O)c2nnc3ccccc3c2[O-])cc1 ZINC000735657446 1044854454 /nfs/dbraw/zinc/85/44/54/1044854454.db2.gz IYSCJEAGCNPAHS-UHFFFAOYSA-N -1 3 349.434 4.124 20 0 EIADHM Cc1ccc([O-])c(C(=O)Nc2ccc(Oc3cccnc3)c(C)c2)c1 ZINC000303058800 1044943768 /nfs/dbraw/zinc/94/37/68/1044943768.db2.gz WWTJFJILWNHWGH-UHFFFAOYSA-N -1 3 334.375 4.449 20 0 EIADHM Cc1c(Br)ccc([N-]C(=O)c2ocnc2C(F)F)c1F ZINC001128511745 1044956193 /nfs/dbraw/zinc/95/61/93/1044956193.db2.gz CBDYHZOOXAKREJ-UHFFFAOYSA-N -1 3 349.106 4.075 20 0 EIADHM CC[C@@H]([N-]C(=O)C(F)(F)c1cccc(Cl)c1)c1nccs1 ZINC000737669908 1045015824 /nfs/dbraw/zinc/01/58/24/1045015824.db2.gz DINSXXQWEMTIOT-LLVKDONJSA-N -1 3 330.787 4.156 20 0 EIADHM CCn1c2ccccc2nc1[C@@H]1CCCN1C(=O)c1c(C)cccc1[O-] ZINC000625067470 1045067223 /nfs/dbraw/zinc/06/72/23/1045067223.db2.gz OYXDVGOGZWXVIK-KRWDZBQOSA-N -1 3 349.434 4.048 20 0 EIADHM CC[C@](C)([N-]C(=O)C(F)(F)c1cccc(Cl)c1)c1nccs1 ZINC000739602706 1045157345 /nfs/dbraw/zinc/15/73/45/1045157345.db2.gz NMPQPJFXOSSJAE-AWEZNQCLSA-N -1 3 344.814 4.330 20 0 EIADHM O=C([O-])CC[C@@H]1CCCCN1CCOc1c(Cl)cccc1Cl ZINC000315902125 1045412720 /nfs/dbraw/zinc/41/27/20/1045412720.db2.gz MDXMGMSZMUIPOH-LBPRGKRZSA-N -1 3 346.254 4.092 20 0 EIADHM [O-]c1ccc(NC(=S)Nc2ccc(C(F)(F)F)cc2)cc1F ZINC000168502852 1045560304 /nfs/dbraw/zinc/56/03/04/1045560304.db2.gz QWOBQBZEIJQMDK-UHFFFAOYSA-N -1 3 330.306 4.359 20 0 EIADHM C[C@@H](C1CC1)n1nccc1NC(=O)c1cc2sccc2c([O-])c1 ZINC000791345844 1045724906 /nfs/dbraw/zinc/72/49/06/1045724906.db2.gz DIUYYXMKIKWBGY-JTQLQIEISA-N -1 3 327.409 4.027 20 0 EIADHM CC[C@H](NC(=O)c1cc2sccc2c([O-])c1)c1nc(C)cs1 ZINC000791353780 1045729008 /nfs/dbraw/zinc/72/90/08/1045729008.db2.gz VFJVFVQSOORICT-LBPRGKRZSA-N -1 3 332.450 4.253 20 0 EIADHM CC[C@](C)(NC(=O)c1cc2sccc2c([O-])c1)c1nccs1 ZINC000791366631 1045731711 /nfs/dbraw/zinc/73/17/11/1045731711.db2.gz LCMBEJMNWSDUBU-INIZCTEOSA-N -1 3 332.450 4.119 20 0 EIADHM Cc1cc(=O)[n-]c(CSCc2ncc(-c3ccc(Cl)cc3)o2)n1 ZINC000763207923 1045742481 /nfs/dbraw/zinc/74/24/81/1045742481.db2.gz FLELSTHITJNAOC-UHFFFAOYSA-N -1 3 347.827 4.232 20 0 EIADHM Cc1cc(=O)[n-]c(CS[C@@H](C)c2ccc(OC(F)F)cc2)n1 ZINC000763209438 1045749492 /nfs/dbraw/zinc/74/94/92/1045749492.db2.gz QKSTXEDHEMNYNS-JTQLQIEISA-N -1 3 326.368 4.086 20 0 EIADHM Cc1ccc(CN(C)Cc2cc(=O)oc3cc([O-])c(Cl)cc23)cc1 ZINC000915878365 1045759168 /nfs/dbraw/zinc/75/91/68/1045759168.db2.gz PQVVWPFLEHRGIF-UHFFFAOYSA-N -1 3 343.810 4.092 20 0 EIADHM CC(C)(C)[C@H](NC(=O)c1cc(=O)c2ccccc2[n-]1)c1ccccc1 ZINC000056081425 1045778968 /nfs/dbraw/zinc/77/89/68/1045778968.db2.gz RLOAELLRKNCAHL-LJQANCHMSA-N -1 3 334.419 4.045 20 0 EIADHM O=C(N[C@H](c1ccccc1)C1CCCC1)c1cc(=O)c2ccccc2[n-]1 ZINC000056095279 1045783642 /nfs/dbraw/zinc/78/36/42/1045783642.db2.gz ZNNXFKWNRKWHKL-OAQYLSRUSA-N -1 3 346.430 4.189 20 0 EIADHM [O-]C(=NO[C@@H]1CCCCO1)Nc1ccc(OCC2CCCCC2)cc1 ZINC000763264931 1045801512 /nfs/dbraw/zinc/80/15/12/1045801512.db2.gz AJGUWCPDUDZYAM-GOSISDBHSA-N -1 3 348.443 4.225 20 0 EIADHM O=C([N-]O[C@@H]1CCCCO1)Nc1ccc(OCC2CCCCC2)cc1 ZINC000763264931 1045801518 /nfs/dbraw/zinc/80/15/18/1045801518.db2.gz AJGUWCPDUDZYAM-GOSISDBHSA-N -1 3 348.443 4.225 20 0 EIADHM Cc1c(Br)ccc(N)c1Nc1ccc([O-])c(F)c1F ZINC001212008839 1045830603 /nfs/dbraw/zinc/83/06/03/1045830603.db2.gz FLFYCMNJMNSOHD-UHFFFAOYSA-N -1 3 329.144 4.067 20 0 EIADHM CCOC(=O)c1cnc2c(cccc2Nc2ccc([O-])c(F)c2F)c1 ZINC001212013949 1045835301 /nfs/dbraw/zinc/83/53/01/1045835301.db2.gz RAUQPXFSKVCNBP-UHFFFAOYSA-N -1 3 344.317 4.139 20 0 EIADHM COc1cc(Br)cc(F)c1Nc1ccc([O-])c(F)c1F ZINC001212013651 1045835725 /nfs/dbraw/zinc/83/57/25/1045835725.db2.gz CLLWLRIEPOIRFN-UHFFFAOYSA-N -1 3 348.118 4.324 20 0 EIADHM CCOC(=O)Cc1ccc(Cl)c(Nc2ccc([O-])c(F)c2F)c1 ZINC001212016565 1045840639 /nfs/dbraw/zinc/84/06/39/1045840639.db2.gz WKGMFHYIPFGZER-UHFFFAOYSA-N -1 3 341.741 4.173 20 0 EIADHM CCOc1ccccc1[N-]S(=O)(=O)/C=C\c1cccc(Cl)c1 ZINC000768867453 1045850239 /nfs/dbraw/zinc/85/02/39/1045850239.db2.gz RFVDBWFSWFZVLU-KHPPLWFESA-N -1 3 337.828 4.151 20 0 EIADHM CC[C@@H](NC(=O)c1cc([O-])c2ccccc2c1)c1ccccc1OC ZINC000792056470 1045852231 /nfs/dbraw/zinc/85/22/31/1045852231.db2.gz FCXXUMHYYDNMFV-GOSISDBHSA-N -1 3 335.403 4.435 20 0 EIADHM C[C@H]1CC[C@H](C(F)(F)F)CN1C(=O)c1cc([O-])c2ccccc2c1 ZINC000792308386 1045887415 /nfs/dbraw/zinc/88/74/15/1045887415.db2.gz XPCYPNLPXMAAKT-FZMZJTMJSA-N -1 3 337.341 4.348 20 0 EIADHM C[C@H]1CC[C@@H](C(F)(F)F)CN1C(=O)c1cc([O-])c2ccccc2c1 ZINC000792308388 1045887586 /nfs/dbraw/zinc/88/75/86/1045887586.db2.gz XPCYPNLPXMAAKT-SMDDNHRTSA-N -1 3 337.341 4.348 20 0 EIADHM Cc1sc2[n-]c([C@H](C)OC(=O)C[C@H]3CCC[C@@H]3C)nc(=O)c2c1C ZINC000769187062 1045892148 /nfs/dbraw/zinc/89/21/48/1045892148.db2.gz USZBYXZMYQEABX-XHVZSJERSA-N -1 3 348.468 4.444 20 0 EIADHM CCN(Cc1ccccc1)Cc1cc(=O)oc2cc([O-])c(Cl)cc12 ZINC000916143118 1045932379 /nfs/dbraw/zinc/93/23/79/1045932379.db2.gz NBDQPLZZCZPMDG-UHFFFAOYSA-N -1 3 343.810 4.174 20 0 EIADHM CCc1cccc(C(=O)N2CCC[C@@H]2c2ccc(F)c(F)c2)c1[O-] ZINC000769829935 1046088377 /nfs/dbraw/zinc/08/83/77/1046088377.db2.gz BVESEYFJNFGRCN-QGZVFWFLSA-N -1 3 331.362 4.210 20 0 EIADHM CCN(C[C@@H](O)c1ccc(C)cc1)C(=O)c1ccc(C(C)C)cc1[O-] ZINC000769952474 1046108822 /nfs/dbraw/zinc/10/88/22/1046108822.db2.gz URMGJRDGHZFOGQ-HXUWFJFHSA-N -1 3 341.451 4.020 20 0 EIADHM O=C([O-])CCCNCc1nc(-c2cc(Cl)ccc2Cl)cs1 ZINC000263397564 1046281518 /nfs/dbraw/zinc/28/15/18/1046281518.db2.gz HBRMOYVEFLUVPB-UHFFFAOYSA-N -1 3 345.251 4.071 20 0 EIADHM O=C([O-])[C@@H]1C[C@@H]2CCCC[C@@H]2N1Cc1csc(Cl)c1Cl ZINC000263454821 1046290080 /nfs/dbraw/zinc/29/00/80/1046290080.db2.gz ANPWSXLAYGWPLK-LSJOCFKGSA-N -1 3 334.268 4.273 20 0 EIADHM CCc1ccc([O-])c(C(=O)N(C)[C@@H](COC)c2ccc(Cl)cc2)c1 ZINC000428601986 1046327583 /nfs/dbraw/zinc/32/75/83/1046327583.db2.gz OWOKCDRBOLGZED-KRWDZBQOSA-N -1 3 347.842 4.068 20 0 EIADHM CCCCc1ccc(C(=O)CCC(=O)[N-]OCc2ccccc2)cc1 ZINC000916739918 1046346088 /nfs/dbraw/zinc/34/60/88/1046346088.db2.gz CMNSXBZBBVCKTF-UHFFFAOYSA-N -1 3 339.435 4.240 20 0 EIADHM CC12CC3(C)CC(C)(C1)CC(C(=O)[N-]OCc1cccnc1)(C2)C3 ZINC000772187890 1046580553 /nfs/dbraw/zinc/58/05/53/1046580553.db2.gz LSZPFBFAOAJIDX-UHFFFAOYSA-N -1 3 328.456 4.016 20 0 EIADHM Cc1sc2[n-]c([C@@H](C)OC(=O)[C@H]3CCCC3(C)C)nc(=O)c2c1C ZINC000772608433 1046673338 /nfs/dbraw/zinc/67/33/38/1046673338.db2.gz MPHUKUWWNKBCEQ-ZYHUDNBSSA-N -1 3 348.468 4.444 20 0 EIADHM Cc1sc2[n-]c([C@@H](C)OC(=O)[C@@H]3CCCC3(C)C)nc(=O)c2c1C ZINC000772608431 1046674139 /nfs/dbraw/zinc/67/41/39/1046674139.db2.gz MPHUKUWWNKBCEQ-PWSUYJOCSA-N -1 3 348.468 4.444 20 0 EIADHM CC1(C)CN(Cc2cccc([O-])c2Br)[C@@H]1c1cccnc1 ZINC000459561726 1046776441 /nfs/dbraw/zinc/77/64/41/1046776441.db2.gz RWBAZNFWPAIFBI-MRXNPFEDSA-N -1 3 347.256 4.133 20 0 EIADHM [O-]c1cccc(CNc2ccc([C@@H]3CCOC3)cc2)c1Br ZINC000459582619 1046778773 /nfs/dbraw/zinc/77/87/73/1046778773.db2.gz DZLOEHYUFVCWDQ-CQSZACIVSA-N -1 3 348.240 4.271 20 0 EIADHM O=C(COC(=O)c1cc2occc2[n-]1)c1ccc(Cl)cc1Cl ZINC000786029987 1046803874 /nfs/dbraw/zinc/80/38/74/1046803874.db2.gz KMHBMBPPCWJVAQ-UHFFFAOYSA-N -1 3 338.146 4.107 20 0 EIADHM O=C(OCc1ncc(-c2cccc(Cl)c2)o1)c1cc2occc2[n-]1 ZINC000786032047 1046803950 /nfs/dbraw/zinc/80/39/50/1046803950.db2.gz GMJDUCCNCWEBGX-UHFFFAOYSA-N -1 3 342.738 4.426 20 0 EIADHM C[C@H](OC(=O)c1cc2occc2[n-]1)C(=O)Nc1ccc2ccccc2c1 ZINC000786031121 1046804158 /nfs/dbraw/zinc/80/41/58/1046804158.db2.gz NBAJWBSKCWOFCE-LBPRGKRZSA-N -1 3 348.358 4.098 20 0 EIADHM CO[C@H](C)c1nc(COC(=O)c2cc3sccc3c([O-])c2)cs1 ZINC000786135515 1046815740 /nfs/dbraw/zinc/81/57/40/1046815740.db2.gz BXZUHZYQFHAWOO-SECBINFHSA-N -1 3 349.433 4.128 20 0 EIADHM C[C@H](OC(=O)c1cc2sccc2c([O-])c1)C(=O)c1ccccc1 ZINC000786134304 1046815756 /nfs/dbraw/zinc/81/57/56/1046815756.db2.gz RFQHIVKSRQWCDI-NSHDSACASA-N -1 3 326.373 4.035 20 0 EIADHM CCOc1cc(CNc2cc(F)c(OC)c(F)c2)cc(Cl)c1[O-] ZINC000917400796 1046868038 /nfs/dbraw/zinc/86/80/38/1046868038.db2.gz SPPHDRMXVJJGIU-UHFFFAOYSA-N -1 3 343.757 4.343 20 0 EIADHM O=C(Nc1cc(Cl)c([O-])cc1F)c1cccc(CN2CCCC2)c1 ZINC000805258098 1046872989 /nfs/dbraw/zinc/87/29/89/1046872989.db2.gz CVHAUBBDAPBTTQ-UHFFFAOYSA-N -1 3 348.805 4.033 20 0 EIADHM O=C([N-][C@@H](c1ccccc1)c1ccc(Cl)c(Cl)c1)C(F)F ZINC000787099350 1046913654 /nfs/dbraw/zinc/91/36/54/1046913654.db2.gz HCDHQPFMRJWEDG-ZDUSSCGKSA-N -1 3 330.161 4.464 20 0 EIADHM Cc1nc(Cc2ccccc2)sc1C(=O)Nc1cccc([O-])c1F ZINC000128560359 1046939218 /nfs/dbraw/zinc/93/92/18/1046939218.db2.gz ZCFMPWHZNLEAII-UHFFFAOYSA-N -1 3 342.395 4.139 20 0 EIADHM Cc1cc(C(=O)Nc2cccc([O-])c2F)ccc1NC(=O)CC(C)C ZINC000128678374 1047017316 /nfs/dbraw/zinc/01/73/16/1047017316.db2.gz FHDCGKGGXNWSHD-UHFFFAOYSA-N -1 3 344.386 4.077 20 0 EIADHM CCCOc1ccc(C(=O)Nc2cccc([O-])c2F)cc1OCCC ZINC000128727409 1047045485 /nfs/dbraw/zinc/04/54/85/1047045485.db2.gz PRWMIBLPAIZHAN-UHFFFAOYSA-N -1 3 347.386 4.361 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)OCCC(Cl)(Cl)Cl ZINC000787848460 1047059516 /nfs/dbraw/zinc/05/95/16/1047059516.db2.gz OGJZKWMCBUUDMI-UHFFFAOYSA-N -1 3 343.609 4.158 20 0 EIADHM O=C(Nc1cccc([O-])c1F)[C@@H]1C[C@@H]1c1cccc(C(F)(F)F)c1 ZINC000128842687 1047111753 /nfs/dbraw/zinc/11/17/53/1047111753.db2.gz VEVYRBDXRLFLHN-VXGBXAGGSA-N -1 3 339.288 4.292 20 0 EIADHM O=C(NCc1ccccc1OC(F)F)c1cc2sccc2c([O-])c1 ZINC000788272778 1047155105 /nfs/dbraw/zinc/15/51/05/1047155105.db2.gz ZKVQWJDCLFIMKJ-UHFFFAOYSA-N -1 3 349.358 4.138 20 0 EIADHM CC(C)Oc1ccccc1CNC(=O)c1cc2sccc2c([O-])c1 ZINC000788288671 1047160484 /nfs/dbraw/zinc/16/04/84/1047160484.db2.gz CBFKZGBZQUYXQO-UHFFFAOYSA-N -1 3 341.432 4.324 20 0 EIADHM Cc1cc(OCCCC(=O)Nc2cccc([O-])c2F)ccc1Cl ZINC000128975321 1047207930 /nfs/dbraw/zinc/20/79/30/1047207930.db2.gz ZXSJLRGTUTUTSL-UHFFFAOYSA-N -1 3 337.778 4.291 20 0 EIADHM O=C(Nc1cccc([O-])c1F)[C@H]1C[C@H]1c1ccccc1C(F)(F)F ZINC000129262660 1047341629 /nfs/dbraw/zinc/34/16/29/1047341629.db2.gz JXQCNCSHLSGSTR-QWRGUYRKSA-N -1 3 339.288 4.292 20 0 EIADHM CCOCCC1(C(=O)Nc2ccc([O-])c(C(F)(F)F)c2)CCCC1 ZINC000476170441 1047398065 /nfs/dbraw/zinc/39/80/65/1047398065.db2.gz SNEZVUIZCPQLCF-UHFFFAOYSA-N -1 3 345.361 4.337 20 0 EIADHM CCCCOc1ccc(C(=O)N(C)CCc2ccccc2F)c([O-])c1 ZINC000789757662 1047468731 /nfs/dbraw/zinc/46/87/31/1047468731.db2.gz ASJRXOZTXYKQDT-UHFFFAOYSA-N -1 3 345.414 4.025 20 0 EIADHM O=C(Nc1cccc([O-])c1F)c1cncc(-c2ccc(Cl)cc2)c1 ZINC000129769915 1047504471 /nfs/dbraw/zinc/50/44/71/1047504471.db2.gz JKRUZKWIHFYFOX-UHFFFAOYSA-N -1 3 342.757 4.499 20 0 EIADHM O=C(Nc1ccc(Br)cc1[O-])c1cccc(Cl)c1F ZINC000130883164 1047810853 /nfs/dbraw/zinc/81/08/53/1047810853.db2.gz WRYHSEUOLDYFLB-UHFFFAOYSA-N -1 3 344.567 4.200 20 0 EIADHM Cc1ccc(Cl)c([N-]S(=O)(=O)c2ccccc2OC(F)F)c1 ZINC000131022618 1047821187 /nfs/dbraw/zinc/82/11/87/1047821187.db2.gz UDIWORIZNVBHPG-UHFFFAOYSA-N -1 3 347.770 4.051 20 0 EIADHM O=S(=O)(/C=C\c1cccc(Cl)c1)[N-]c1cc(F)cc(F)c1F ZINC000814212186 1047890317 /nfs/dbraw/zinc/89/03/17/1047890317.db2.gz HTTVOZPQFOOAEQ-PLNGDYQASA-N -1 3 347.745 4.170 20 0 EIADHM Cc1ccsc1-c1nsc([N-]C(=O)c2cccc(F)c2F)n1 ZINC000131564405 1048041302 /nfs/dbraw/zinc/04/13/02/1048041302.db2.gz KURFEZBWHCNKQJ-UHFFFAOYSA-N -1 3 337.376 4.106 20 0 EIADHM Cc1cccc(C(=O)Nc2cccc(-c3cn4c(n3)CCCC4)c2)c1[O-] ZINC000919755991 1048047111 /nfs/dbraw/zinc/04/71/11/1048047111.db2.gz GURLYMDVXQGGAL-UHFFFAOYSA-N -1 3 347.418 4.153 20 0 EIADHM CCCCNc1ccccc1C(=O)Nc1cccc(C(C)=O)c1[O-] ZINC000556894226 1048118136 /nfs/dbraw/zinc/11/81/36/1048118136.db2.gz PDUUHQKDLDQDLG-UHFFFAOYSA-N -1 3 326.396 4.059 20 0 EIADHM CC(=O)c1cccc(NC(=O)CCCCOc2cccc(C)c2)c1[O-] ZINC000556893102 1048119748 /nfs/dbraw/zinc/11/97/48/1048119748.db2.gz RKBAIRJNMCFLLE-UHFFFAOYSA-N -1 3 341.407 4.091 20 0 EIADHM Cc1ccc(C(=O)Nc2cc(Cl)ccc2[O-])c(Br)c1 ZINC000132284214 1048247776 /nfs/dbraw/zinc/24/77/76/1048247776.db2.gz PCNLKNHUULSBNQ-UHFFFAOYSA-N -1 3 340.604 4.369 20 0 EIADHM CC1(C)CN(C(=O)c2cc3sccc3c([O-])c2)[C@@H]1c1ccco1 ZINC001170786076 1048465439 /nfs/dbraw/zinc/46/54/39/1048465439.db2.gz BFXJPJIPHDKHLO-MRXNPFEDSA-N -1 3 327.405 4.423 20 0 EIADHM CCc1noc(C)c1[N-]C(=O)c1sc(-c2ccc(C)o2)nc1C ZINC000132777507 1048493066 /nfs/dbraw/zinc/49/30/66/1048493066.db2.gz YOMVKMLXTTYNOP-UHFFFAOYSA-N -1 3 331.397 4.131 20 0 EIADHM O=C(CCc1ccc(Cl)c(Cl)c1)NCc1ccc([O-])c(F)c1 ZINC000132889095 1048526209 /nfs/dbraw/zinc/52/62/09/1048526209.db2.gz SQCBIZRWGIPGHH-UHFFFAOYSA-N -1 3 342.197 4.087 20 0 EIADHM Cc1ccc(-c2csc(NC(=O)Cc3ccc([O-])c(F)c3)n2)s1 ZINC001144369327 1048619630 /nfs/dbraw/zinc/61/96/30/1048619630.db2.gz XYJFSDJGWYKDFX-UHFFFAOYSA-N -1 3 348.424 4.206 20 0 EIADHM Cc1ccc(NC(=O)c2ccc(C(=O)OCc3ccccc3)[n-]2)cc1C ZINC001135421205 1048721186 /nfs/dbraw/zinc/72/11/86/1048721186.db2.gz AITMODLVGLFCGH-UHFFFAOYSA-N -1 3 348.402 4.241 20 0 EIADHM CC(C)Cc1ccc([C@H](C)NC(=O)Cc2ccc([O-])c(F)c2)cc1 ZINC001144633309 1048767052 /nfs/dbraw/zinc/76/70/52/1048767052.db2.gz PGWVBAACNGYSDM-AWEZNQCLSA-N -1 3 329.415 4.150 20 0 EIADHM O=C(c1cc([O-])ccc1Cl)N1CCC[C@@H]1c1ccc(F)c(F)c1 ZINC000810395983 1048772819 /nfs/dbraw/zinc/77/28/19/1048772819.db2.gz IHSREOQPCXIVNN-MRXNPFEDSA-N -1 3 337.753 4.301 20 0 EIADHM CCc1nc(COC(=O)c2cc3cc(Cl)sc3[n-]2)cs1 ZINC000810576873 1048821870 /nfs/dbraw/zinc/82/18/70/1048821870.db2.gz TUPKHPRZRKCEPG-UHFFFAOYSA-N -1 3 326.830 4.259 20 0 EIADHM O=C([N-][C@@H]1CCCc2occc21)C(F)(F)c1cccc(Cl)c1 ZINC000921025507 1048834914 /nfs/dbraw/zinc/83/49/14/1048834914.db2.gz UWAZRKHQKJAXMQ-CYBMUJFWSA-N -1 3 325.742 4.219 20 0 EIADHM CC(C)Oc1c(F)cc(NCc2c(F)ccc([O-])c2F)cc1F ZINC000816567991 1048836915 /nfs/dbraw/zinc/83/69/15/1048836915.db2.gz RPGRTCBAQVELPT-UHFFFAOYSA-N -1 3 329.293 4.348 20 0 EIADHM CCCCOC(=O)c1ccc(NC(=O)c2ccc(C)c(C)c2[O-])cc1 ZINC001135648156 1048838904 /nfs/dbraw/zinc/83/89/04/1048838904.db2.gz XJEDTHRJNBSTEL-UHFFFAOYSA-N -1 3 341.407 4.218 20 0 EIADHM O=C([O-])c1cccc(-c2nc(CN3CCC4(CCCC4)C3)cs2)c1 ZINC000846244234 1048848015 /nfs/dbraw/zinc/84/80/15/1048848015.db2.gz HBLCWVCEPMZZOC-UHFFFAOYSA-N -1 3 342.464 4.274 20 0 EIADHM O=C([N-]c1nc2c(s1)CCCCCC2)c1conc1C(F)(F)F ZINC000816898568 1048876033 /nfs/dbraw/zinc/87/60/33/1048876033.db2.gz DIFWYVIBBCOIFD-UHFFFAOYSA-N -1 3 345.346 4.061 20 0 EIADHM C[C@@H](OC(=O)c1cc(Cl)c(Cl)[n-]1)C(=O)c1cccc(Cl)c1 ZINC000828613879 1048882126 /nfs/dbraw/zinc/88/21/26/1048882126.db2.gz KQPFKKAVCJZCQN-SSDOTTSWSA-N -1 3 346.597 4.403 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N1CC(F)(c2ccccc2F)C1 ZINC000816940617 1048882798 /nfs/dbraw/zinc/88/27/98/1048882798.db2.gz IOCUVBXOLXSYJG-UHFFFAOYSA-N -1 3 339.341 4.005 20 0 EIADHM O=C(N[C@H]1C[C@H](c2ccc(F)cc2)C1)c1cc2sccc2c([O-])c1 ZINC000817223250 1048909485 /nfs/dbraw/zinc/90/94/85/1048909485.db2.gz NLYGHENRAHFVLK-NNUKFRKNSA-N -1 3 341.407 4.422 20 0 EIADHM Cc1ccc(C(=O)Nc2nnc(-c3cc(C)cc(C)c3)s2)c([O-])c1 ZINC001146233500 1049013104 /nfs/dbraw/zinc/01/31/04/1049013104.db2.gz OMLYINGPJDBYLO-UHFFFAOYSA-N -1 3 339.420 4.088 20 0 EIADHM O=C(Nc1ccc(OCC2CC2)cc1)c1cc2c(cc1[O-])CCCC2 ZINC001146389025 1049021230 /nfs/dbraw/zinc/02/12/30/1049021230.db2.gz MXYBYEMWTFKROU-UHFFFAOYSA-N -1 3 337.419 4.312 20 0 EIADHM O=C(OC[C@H]1OCCc2ccccc21)c1cc2cc(Cl)sc2[n-]1 ZINC000811394894 1049051846 /nfs/dbraw/zinc/05/18/46/1049051846.db2.gz LWQDRSVBKYUGHO-CQSZACIVSA-N -1 3 347.823 4.354 20 0 EIADHM Cc1sc2[n-]c([C@H](C)OC(=O)[C@H]3CC34CCCC4)nc(=O)c2c1C ZINC000747733902 1049204430 /nfs/dbraw/zinc/20/44/30/1049204430.db2.gz XRBJLZRIVXNFRI-CMPLNLGQSA-N -1 3 346.452 4.198 20 0 EIADHM CC[C@@H](C)C[C@H](C)NC(=O)c1c[n-]c(=NC(=O)OC(C)(C)C)s1 ZINC001147860980 1049229691 /nfs/dbraw/zinc/22/96/91/1049229691.db2.gz MSWVAGHJFXUBHK-MNOVXSKESA-N -1 3 341.477 4.045 20 0 EIADHM CCc1cccc(C(=O)Nc2cccc(Oc3ccccn3)c2)c1[O-] ZINC001148105058 1049263243 /nfs/dbraw/zinc/26/32/43/1049263243.db2.gz JUVKYCDOWWKFKN-UHFFFAOYSA-N -1 3 334.375 4.394 20 0 EIADHM Cc1ccnc(NC(=O)c2cc(CCc3ccccc3)ccc2[O-])c1 ZINC001136247373 1049355322 /nfs/dbraw/zinc/35/53/22/1049355322.db2.gz VDDDIVGCIGWBQQ-UHFFFAOYSA-N -1 3 332.403 4.133 20 0 EIADHM CCc1ccc(C(C)(C)NC(=O)CCCc2ccc([O-])c(F)c2)cc1 ZINC001149020883 1049409883 /nfs/dbraw/zinc/40/98/83/1049409883.db2.gz XSBLQOJIOOCIGP-UHFFFAOYSA-N -1 3 343.442 4.468 20 0 EIADHM O=S(=O)(/C=C\c1ccccc1Cl)[N-]c1cc2c(cn1)CCCC2 ZINC000812330178 1049430543 /nfs/dbraw/zinc/43/05/43/1049430543.db2.gz MJSPTIDMVUJSDB-KTKRTIGZSA-N -1 3 348.855 4.026 20 0 EIADHM Cc1ccc([O-])c(C(=O)Nc2ccc3[nH]c(-c4ccco4)nc3c2)c1 ZINC001136325353 1049473422 /nfs/dbraw/zinc/47/34/22/1049473422.db2.gz RUPPFGMLBQOHBV-UHFFFAOYSA-N -1 3 333.347 4.089 20 0 EIADHM O=C([N-]c1nocc1C1CC1)c1csc(-c2ccc(F)c(F)c2)n1 ZINC001133283961 1049473428 /nfs/dbraw/zinc/47/34/28/1049473428.db2.gz DNIQQGZMTNNFDJ-UHFFFAOYSA-N -1 3 347.346 4.206 20 0 EIADHM CC(C)(C)c1ncc(/C=C/C(=O)Nc2c([O-])cccc2Cl)s1 ZINC000820511025 1049518360 /nfs/dbraw/zinc/51/83/60/1049518360.db2.gz VNPJBEKKQGQHOE-BQYQJAHWSA-N -1 3 336.844 4.452 20 0 EIADHM CC(=O)c1ccc(C(=O)Nc2ccc(Oc3ccccc3)nc2)cc1[O-] ZINC001136353595 1049526526 /nfs/dbraw/zinc/52/65/26/1049526526.db2.gz MQCWMIPRNMZWNR-UHFFFAOYSA-N -1 3 348.358 4.034 20 0 EIADHM Cc1occc1CNC(=O)c1cc(CCc2ccccc2)ccc1[O-] ZINC001136488680 1049676322 /nfs/dbraw/zinc/67/63/22/1049676322.db2.gz SOQNZQYHNTVWSN-UHFFFAOYSA-N -1 3 335.403 4.009 20 0 EIADHM O=c1cc(CN2Cc3ccc(Cl)cc3C2)nc(-c2ccccc2)[n-]1 ZINC001171018117 1049847280 /nfs/dbraw/zinc/84/72/80/1049847280.db2.gz MWMGMELJCQTRAT-UHFFFAOYSA-N -1 3 337.810 4.018 20 0 EIADHM CSc1ccc([O-])c(C(=O)NCC(C)(C)Cc2ccccc2)c1 ZINC001136786814 1049882173 /nfs/dbraw/zinc/88/21/73/1049882173.db2.gz NFXBELQSAGWWGD-UHFFFAOYSA-N -1 3 329.465 4.113 20 0 EIADHM O=c1ccn(-c2ccc(Nc3ccc(C4CCOCC4)cc3)cc2)[n-]1 ZINC001212655803 1049891205 /nfs/dbraw/zinc/89/12/05/1049891205.db2.gz BJIMUFZFXGNEGO-UHFFFAOYSA-N -1 3 335.407 4.216 20 0 EIADHM Cc1cc(C(=O)[N-]c2nnc(CCC(C)C)s2)c(C(F)(F)F)o1 ZINC000617095564 1049949734 /nfs/dbraw/zinc/94/97/34/1049949734.db2.gz UIJVHRKNYJMULU-UHFFFAOYSA-N -1 3 347.362 4.299 20 0 EIADHM O=C(Nc1ccc2c(c1)CCC2)Nc1c([O-])cccc1Br ZINC001185763723 1050154139 /nfs/dbraw/zinc/15/41/39/1050154139.db2.gz OODNSTKVORVEHU-UHFFFAOYSA-N -1 3 347.212 4.287 20 0 EIADHM C[C@@H](OC(=O)c1cc(Cl)c(Cl)[n-]1)c1nc2ccccc2o1 ZINC000181787942 1050338654 /nfs/dbraw/zinc/33/86/54/1050338654.db2.gz LXQMWBTWNODZBE-SSDOTTSWSA-N -1 3 325.151 4.381 20 0 EIADHM Cc1cc([O-])c(NC(=O)NCC2CCCCC2)cc1Br ZINC001186880739 1050432174 /nfs/dbraw/zinc/43/21/74/1050432174.db2.gz HPLRJVISUDZZPB-UHFFFAOYSA-N -1 3 341.249 4.165 20 0 EIADHM O=C(Nc1cccc(Br)c1)Nc1cc([O-])cc(Cl)c1 ZINC001187464111 1050546326 /nfs/dbraw/zinc/54/63/26/1050546326.db2.gz LJDNSKRFDXPPNR-UHFFFAOYSA-N -1 3 341.592 4.452 20 0 EIADHM CC(=O)c1cccc([O-])c1NC(=O)Nc1cccc(Br)c1 ZINC001187464081 1050547020 /nfs/dbraw/zinc/54/70/20/1050547020.db2.gz JVQMYCQHONIRIZ-UHFFFAOYSA-N -1 3 349.184 4.001 20 0 EIADHM CC(C)Nc1ccccc1NC(=O)CCCc1ccc([O-])c(F)c1 ZINC000618883914 1050567276 /nfs/dbraw/zinc/56/72/76/1050567276.db2.gz CLZHOFZECQXLIN-UHFFFAOYSA-N -1 3 330.403 4.313 20 0 EIADHM CCc1ccc([O-])c(C(=O)N2CCC[C@@]3(C=Cc4ccccc4O3)C2)c1 ZINC001179422976 1050698748 /nfs/dbraw/zinc/69/87/48/1050698748.db2.gz MNCLHFSRZVOWPV-JOCHJYFZSA-N -1 3 349.430 4.035 20 0 EIADHM CCc1nocc1CSc1nnc([N-]c2ccccc2F)s1 ZINC001188114869 1050701529 /nfs/dbraw/zinc/70/15/29/1050701529.db2.gz NLMCZPZMUQMHCE-UHFFFAOYSA-N -1 3 336.417 4.264 20 0 EIADHM COCc1cccc(Nc2cc(Br)cc(F)c2[O-])c1 ZINC001174095879 1050725104 /nfs/dbraw/zinc/72/51/04/1050725104.db2.gz QRCNFNWULOHYAP-UHFFFAOYSA-N -1 3 326.165 4.184 20 0 EIADHM CCc1cccc(C(=O)Nc2ccccc2Oc2ccccn2)c1[O-] ZINC001179619325 1050733405 /nfs/dbraw/zinc/73/34/05/1050733405.db2.gz TXBBCQJSXLPLSQ-UHFFFAOYSA-N -1 3 334.375 4.394 20 0 EIADHM COc1ccc(NC(=O)Nc2nc3c(cccc3[O-])s2)cc1Cl ZINC001188433605 1050766355 /nfs/dbraw/zinc/76/63/55/1050766355.db2.gz IDZQZQVUWFLIIR-UHFFFAOYSA-N -1 3 349.799 4.308 20 0 EIADHM Cc1cccc([O-])c1C(=O)N1CCC2(CCCc3ccccc32)CC1 ZINC001188640714 1050819890 /nfs/dbraw/zinc/81/98/90/1050819890.db2.gz XBVSGCLLOVJUQD-UHFFFAOYSA-N -1 3 335.447 4.211 20 0 EIADHM COc1cc([C@@H](C)NC(=O)c2c(C)cccc2[O-])cc2ccccc21 ZINC001179986213 1050841489 /nfs/dbraw/zinc/84/14/89/1050841489.db2.gz DJMWGAYHPDHNEB-CQSZACIVSA-N -1 3 335.403 4.353 20 0 EIADHM O=C(Nc1ccc(OCc2ccccc2)cc1)Nc1cncc([O-])c1 ZINC001189147208 1050916430 /nfs/dbraw/zinc/91/64/30/1050916430.db2.gz DLBSUFBOHZMMAH-UHFFFAOYSA-N -1 3 335.363 4.010 20 0 EIADHM COC(=O)c1cnc(SCc2c(C)ccc3cc(C)ccc32)[n-]1 ZINC001189166099 1050916574 /nfs/dbraw/zinc/91/65/74/1050916574.db2.gz JLBHSAOTPPPLFA-UHFFFAOYSA-N -1 3 326.421 4.259 20 0 EIADHM CCCCOc1ccc(NC(=O)Nc2ncc([O-])cc2Cl)cc1 ZINC001189295329 1050948236 /nfs/dbraw/zinc/94/82/36/1050948236.db2.gz OLVULRGHOIBGJN-UHFFFAOYSA-N -1 3 335.791 4.264 20 0 EIADHM Cc1ccc(C(C)C)c(OCC(=O)Nc2cc([O-])cc(Cl)c2)c1 ZINC001180512233 1051013816 /nfs/dbraw/zinc/01/38/16/1051013816.db2.gz PDSAMYPFAOTXPB-UHFFFAOYSA-N -1 3 333.815 4.495 20 0 EIADHM COC(=O)c1cccc([O-])c1NC(=O)Nc1ccccc1C(C)(C)C ZINC001189593198 1051017074 /nfs/dbraw/zinc/01/70/74/1051017074.db2.gz FQZJALOVEGJIIH-UHFFFAOYSA-N -1 3 342.395 4.120 20 0 EIADHM O=C(Nc1ccc([O-])cc1F)c1ccccc1C(=O)c1cccs1 ZINC000183251678 1051040708 /nfs/dbraw/zinc/04/07/08/1051040708.db2.gz FIWXENNFSSOTOG-UHFFFAOYSA-N -1 3 341.363 4.076 20 0 EIADHM Cc1oc(-c2ccsc2)nc1CC(=O)Nc1ccc(Cl)cc1[O-] ZINC000153446584 1051043784 /nfs/dbraw/zinc/04/37/84/1051043784.db2.gz XAFOYPSKXVRZHB-UHFFFAOYSA-N -1 3 348.811 4.252 20 0 EIADHM O=S(=O)([N-]c1ccccc1)c1ccc(OCc2ccccc2)cc1 ZINC000620473696 1051138606 /nfs/dbraw/zinc/13/86/06/1051138606.db2.gz FCUKGAKWAOMZJU-UHFFFAOYSA-N -1 3 339.416 4.066 20 0 EIADHM CC(=O)c1cccc(OCCCC(=O)Nc2ccc(Cl)cc2[O-])c1 ZINC000153672378 1051213687 /nfs/dbraw/zinc/21/36/87/1051213687.db2.gz UDELTBISYFYYFX-UHFFFAOYSA-N -1 3 347.798 4.046 20 0 EIADHM CC(=O)OCc1cccc(C)c1Nc1nc2c(cccc2[O-])s1 ZINC001212767450 1051242316 /nfs/dbraw/zinc/24/23/16/1051242316.db2.gz GUTALGWFQBDVKC-UHFFFAOYSA-N -1 3 328.393 4.117 20 0 EIADHM O=C([N-]c1cc(C(F)(F)F)no1)c1nc(-c2ccccc2)cs1 ZINC001191040170 1051327965 /nfs/dbraw/zinc/32/79/65/1051327965.db2.gz SVDLRETYFJKNJQ-UHFFFAOYSA-N -1 3 339.298 4.069 20 0 EIADHM COc1cc(Br)cc(F)c1Nc1c(F)cc([O-])cc1F ZINC001175099434 1051345489 /nfs/dbraw/zinc/34/54/89/1051345489.db2.gz GTIPFYCVCCBAGF-UHFFFAOYSA-N -1 3 348.118 4.324 20 0 EIADHM COc1cc(F)cc(Br)c1Nc1c(F)cc([O-])cc1F ZINC001175099334 1051346009 /nfs/dbraw/zinc/34/60/09/1051346009.db2.gz AVBNCHVXYWXJAB-UHFFFAOYSA-N -1 3 348.118 4.324 20 0 EIADHM [O-]c1cc(F)c(Nc2cc(F)ccc2OC[C@H]2CCCO2)c(F)c1 ZINC001175100533 1051347955 /nfs/dbraw/zinc/34/79/55/1051347955.db2.gz WWYYRJLCOFUTRL-GFCCVEGCSA-N -1 3 339.313 4.111 20 0 EIADHM O=C(Nc1cc([O-])cc(Cl)c1)c1nc(-c2ccccc2)cs1 ZINC001191047472 1051348093 /nfs/dbraw/zinc/34/80/93/1051348093.db2.gz BYCXVAFQYRELLQ-UHFFFAOYSA-N -1 3 330.796 4.421 20 0 EIADHM [O-]c1cc(F)c(Nc2cccc(-c3nc(CO)cs3)c2)c(F)c1 ZINC001175102344 1051350359 /nfs/dbraw/zinc/35/03/59/1051350359.db2.gz JQFWTYXYZQCZPO-UHFFFAOYSA-N -1 3 334.347 4.030 20 0 EIADHM O=C(Cc1ccc2[nH]c3ccccc3c2c1)Nc1ccc(F)c([O-])c1 ZINC001182066832 1051389040 /nfs/dbraw/zinc/38/90/40/1051389040.db2.gz QJRTXPYIQRMDGF-UHFFFAOYSA-N -1 3 334.350 4.347 20 0 EIADHM CCO[C@H]1C[C@@H](N(C)C(=O)c2cc3sccc3c([O-])c2)C12CCC2 ZINC000774064212 1051438646 /nfs/dbraw/zinc/43/86/46/1051438646.db2.gz CVDRFLMHMSBRPU-SJORKVTESA-N -1 3 345.464 4.027 20 0 EIADHM CC(=O)c1ccc(Nc2cc(Br)cc(F)c2[O-])cc1F ZINC001175235653 1051464545 /nfs/dbraw/zinc/46/45/45/1051464545.db2.gz QVNLFGUFHZJNLZ-UHFFFAOYSA-N -1 3 342.139 4.379 20 0 EIADHM Cc1cc(=O)[n-]c([C@@H](C)Sc2nc3ccccc3n2C(F)F)n1 ZINC000155920868 1051476268 /nfs/dbraw/zinc/47/62/68/1051476268.db2.gz WLVQWEKRSHIWJH-SECBINFHSA-N -1 3 336.367 4.089 20 0 EIADHM O=S(=O)(CC1CCCC1)[N-]c1cc(C2CCCCC2)ccc1O ZINC001191535812 1051476499 /nfs/dbraw/zinc/47/64/99/1051476499.db2.gz SUHARUZDNSUYMQ-UHFFFAOYSA-N -1 3 337.485 4.372 20 0 EIADHM Cc1cc(C)c(Nc2c(F)ccc([O-])c2F)c(Br)n1 ZINC001175263372 1051501618 /nfs/dbraw/zinc/50/16/18/1051501618.db2.gz TUWNIHWZECOQQV-UHFFFAOYSA-N -1 3 329.144 4.188 20 0 EIADHM O=C(c1cccc(Nc2c(F)ccc([O-])c2F)c1)N1CCCCC1 ZINC001175269042 1051502610 /nfs/dbraw/zinc/50/26/10/1051502610.db2.gz YGYGOUPTIBVPDF-UHFFFAOYSA-N -1 3 332.350 4.040 20 0 EIADHM [O-]c1ccc(F)c(Nc2ccc(OC[C@@H]3CCCO3)c(F)c2)c1F ZINC001175268109 1051503351 /nfs/dbraw/zinc/50/33/51/1051503351.db2.gz HTUNDHYCQPXFKM-NSHDSACASA-N -1 3 339.313 4.111 20 0 EIADHM CC(=O)N1CC(C)(C)c2ccc(Nc3c(F)ccc([O-])c3F)cc21 ZINC001175269003 1051503747 /nfs/dbraw/zinc/50/37/47/1051503747.db2.gz WAFWMIIPHCVHKV-UHFFFAOYSA-N -1 3 332.350 4.058 20 0 EIADHM Cc1cc(O)c(Nc2c(F)ccc([O-])c2F)cc1Br ZINC001175267783 1051503775 /nfs/dbraw/zinc/50/37/75/1051503775.db2.gz GIGBWBGWSWSMLS-UHFFFAOYSA-N -1 3 330.128 4.191 20 0 EIADHM COC(=O)c1ccc(Nc2c(F)ccc([O-])c2F)c(C(F)(F)F)c1 ZINC001175266066 1051503924 /nfs/dbraw/zinc/50/39/24/1051503924.db2.gz ULQRQZASPSLPAY-UHFFFAOYSA-N -1 3 347.239 4.219 20 0 EIADHM COC(=O)c1cc(Cl)cc(Nc2c(F)ccc([O-])c2F)c1C ZINC001175269842 1051506041 /nfs/dbraw/zinc/50/60/41/1051506041.db2.gz NUXSAZCLLLEQKU-UHFFFAOYSA-N -1 3 327.714 4.162 20 0 EIADHM Cc1cccc(Nc2c(F)ccc([O-])c2F)c1N1CCCCC1=O ZINC001175269117 1051506115 /nfs/dbraw/zinc/50/61/15/1051506115.db2.gz CKGQCKXAPAXOFK-UHFFFAOYSA-N -1 3 332.350 4.239 20 0 EIADHM COC(=O)c1cccc2c(Nc3c(F)ccc([O-])c3F)cccc12 ZINC001175269986 1051507432 /nfs/dbraw/zinc/50/74/32/1051507432.db2.gz QFRAOWDDBLMQGG-UHFFFAOYSA-N -1 3 329.302 4.354 20 0 EIADHM COc1cc(Br)c(Nc2c(F)ccc([O-])c2F)cc1F ZINC001175270379 1051507939 /nfs/dbraw/zinc/50/79/39/1051507939.db2.gz YXKTWQYPDAKCNU-UHFFFAOYSA-N -1 3 348.118 4.324 20 0 EIADHM CCN(Cc1cc(=O)oc2c(C)c([O-])ccc12)c1cc(C)ccc1C ZINC001191647075 1051509566 /nfs/dbraw/zinc/50/95/66/1051509566.db2.gz ZILBIBGJURDPGJ-UHFFFAOYSA-N -1 3 337.419 4.450 20 0 EIADHM CC(C)(C)c1ccc(C(=O)N2CCC3(CCOC3(C)C)CC2)c([O-])c1 ZINC001192322512 1051689665 /nfs/dbraw/zinc/68/96/65/1051689665.db2.gz BNPTVSSLVAEWRY-UHFFFAOYSA-N -1 3 345.483 4.111 20 0 EIADHM C[C@H]1CCN(C(=O)c2ccc(C(C)(C)C)cc2[O-])CCC1(F)F ZINC001192314812 1051689682 /nfs/dbraw/zinc/68/96/82/1051689682.db2.gz TZPANMQJXGTTQM-LBPRGKRZSA-N -1 3 325.399 4.197 20 0 EIADHM COc1cc(F)c(Nc2cccc([O-])c2Br)c(F)c1 ZINC001175725422 1051743289 /nfs/dbraw/zinc/74/32/89/1051743289.db2.gz CZSLQRPPYLVSDU-UHFFFAOYSA-N -1 3 330.128 4.185 20 0 EIADHM CCCC[C@H](C)NC(=O)Nc1cc(Br)c(C)cc1[O-] ZINC001193065675 1051860447 /nfs/dbraw/zinc/86/04/47/1051860447.db2.gz XNSIPLFVFXDQHN-JTQLQIEISA-N -1 3 329.238 4.163 20 0 EIADHM C[C@@H](NC(=O)Nc1nc2c(cccc2[O-])s1)c1ccc(F)cc1 ZINC001193091112 1051875031 /nfs/dbraw/zinc/87/50/31/1051875031.db2.gz MNDLBLOXFSOOBR-SECBINFHSA-N -1 3 331.372 4.024 20 0 EIADHM CC(=O)c1cccc([O-])c1NC(=O)c1c[nH]c(-c2ccc(C)cc2)c1 ZINC001193778940 1051985127 /nfs/dbraw/zinc/98/51/27/1051985127.db2.gz BMTDTYLMUSWRFS-UHFFFAOYSA-N -1 3 334.375 4.151 20 0 EIADHM CC(C)(CNC(=O)c1cc(Cc2ccccc2)ccc1[O-])CC(F)F ZINC001176331893 1051994604 /nfs/dbraw/zinc/99/46/04/1051994604.db2.gz NFGBUUAUAYOOFO-UHFFFAOYSA-N -1 3 347.405 4.394 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2ccnc(C3CC3)c2)c2ccccc12 ZINC001193833703 1052006557 /nfs/dbraw/zinc/00/65/57/1052006557.db2.gz GLZFVKFRPRYOBU-UHFFFAOYSA-N -1 3 338.432 4.221 20 0 EIADHM COc1ccc(F)c([N-]S(=O)(=O)c2ccc(C)c3ccccc32)c1 ZINC001193862083 1052019021 /nfs/dbraw/zinc/01/90/21/1052019021.db2.gz AIBLDZPWPHZVPP-UHFFFAOYSA-N -1 3 345.395 4.097 20 0 EIADHM CC1=C[C@@H]2[C@H]([C@@H](C)C(=O)NCc3ncccc3[O-])CC[C@@H](C)[C@@H]2CC1 ZINC001184502571 1052032720 /nfs/dbraw/zinc/03/27/20/1052032720.db2.gz CLIXTBXDAKFEGV-ZBRFXRBCSA-N -1 3 342.483 4.058 20 0 EIADHM CCOC(=O)c1cnoc1[N-]C(=O)Nc1c(C)cccc1C(C)(C)C ZINC001184573347 1052046468 /nfs/dbraw/zinc/04/64/68/1052046468.db2.gz BSAKESXDDKGFRK-UHFFFAOYSA-N -1 3 345.399 4.101 20 0 EIADHM O=C(Nc1ccc(F)c([O-])c1)c1ccc(OCC2CC2)c(Cl)c1 ZINC001194200365 1052103891 /nfs/dbraw/zinc/10/38/91/1052103891.db2.gz PJMZRECTYTWDFI-UHFFFAOYSA-N -1 3 335.762 4.226 20 0 EIADHM [O-]c1cc2ccccc2cc1-c1nc(C2Cc3ccccc3C2)no1 ZINC000327536116 1052117831 /nfs/dbraw/zinc/11/78/31/1052117831.db2.gz QARCKSDGFQLIFW-UHFFFAOYSA-N -1 3 328.371 4.478 20 0 EIADHM CC(C)CN(Cc1cc(=O)[n-]c(C2CC2)n1)c1cccc(Cl)c1 ZINC001194348587 1052129691 /nfs/dbraw/zinc/12/96/91/1052129691.db2.gz MOAFTCAECLDDPL-UHFFFAOYSA-N -1 3 331.847 4.376 20 0 EIADHM CC(C)[C@H](NC(=O)Cc1ccc([O-])c(F)c1)c1ccc(Cl)cc1 ZINC000622289692 1052185239 /nfs/dbraw/zinc/18/52/39/1052185239.db2.gz AXUNEYKVUGEVJA-SFHVURJKSA-N -1 3 335.806 4.241 20 0 EIADHM Cc1ccc(F)c(NC(=O)Nc2c([O-])cccc2Br)c1 ZINC001185255214 1052203972 /nfs/dbraw/zinc/20/39/72/1052203972.db2.gz JCZGWKQSIVRTQJ-UHFFFAOYSA-N -1 3 339.164 4.246 20 0 EIADHM CC(C)(C)[C@H]1CCCC[C@H]1[N-]S(=O)(=O)c1cc(F)ccc1Cl ZINC001185319348 1052208815 /nfs/dbraw/zinc/20/88/15/1052208815.db2.gz XRMBTNFIEQJBNF-GXTWGEPZSA-N -1 3 347.883 4.362 20 0 EIADHM CCc1cccc(C(=O)N(CC(C)C)c2cccc(OC)c2)c1[O-] ZINC000622334829 1052213694 /nfs/dbraw/zinc/21/36/94/1052213694.db2.gz DLPQKJOUJXNSMX-UHFFFAOYSA-N -1 3 327.424 4.266 20 0 EIADHM CC(C)(C)Oc1cccc(CNC(=O)c2cc([O-])ccc2Cl)c1 ZINC001177071776 1052224211 /nfs/dbraw/zinc/22/42/11/1052224211.db2.gz YNRFLIMVJQAIIA-UHFFFAOYSA-N -1 3 333.815 4.153 20 0 EIADHM CC[C@@H](Cc1ccc(C)cc1)N(CC)C(=O)Cc1ccc([O-])c(F)c1 ZINC000622395383 1052252054 /nfs/dbraw/zinc/25/20/54/1052252054.db2.gz MBMHMWUUHOHBRS-SFHVURJKSA-N -1 3 343.442 4.252 20 0 EIADHM CCc1ccc(C(=O)N(C)[C@@H](CC)Cc2ccc(C)cc2)c([O-])c1 ZINC000622397059 1052252291 /nfs/dbraw/zinc/25/22/91/1052252291.db2.gz ZZYGYDMHWZNHCG-SFHVURJKSA-N -1 3 325.452 4.356 20 0 EIADHM O=C(Nc1cc(Br)ccc1[O-])C12CCC(F)(CC1)CC2 ZINC001185529029 1052257518 /nfs/dbraw/zinc/25/75/18/1052257518.db2.gz HOHSZZSOGSBUFV-UHFFFAOYSA-N -1 3 342.208 4.156 20 0 EIADHM COc1cc(C)c([N-]S(=O)(=O)c2ccc(Cl)c(C)c2)c(C)c1 ZINC001185529655 1052257594 /nfs/dbraw/zinc/25/75/94/1052257594.db2.gz JTULNLJDLCRRLI-UHFFFAOYSA-N -1 3 339.844 4.075 20 0 EIADHM C[C@@H](NCc1ccccc1F)c1cc(Br)cc(F)c1[O-] ZINC000184855870 1052265548 /nfs/dbraw/zinc/26/55/48/1052265548.db2.gz HIUVLZIYVMOUFW-SECBINFHSA-N -1 3 342.183 4.284 20 0 EIADHM O=C(Cc1ccc([O-])c(F)c1)N1CCC[C@@H]1CCC1CCCCC1 ZINC000622447396 1052279746 /nfs/dbraw/zinc/27/97/46/1052279746.db2.gz HBMLJALEZNUWDE-QGZVFWFLSA-N -1 3 333.447 4.425 20 0 EIADHM Cc1ccc(C(=O)N[C@@H](CC(F)(F)F)c2ccc(F)cc2)c([O-])c1 ZINC000622477621 1052287915 /nfs/dbraw/zinc/28/79/15/1052287915.db2.gz FPIAGXUBSNDEHP-AWEZNQCLSA-N -1 3 341.304 4.263 20 0 EIADHM O=C(NC1CCC(F)(F)CC1)c1cc(Cc2ccccc2)ccc1[O-] ZINC000622470353 1052293224 /nfs/dbraw/zinc/29/32/24/1052293224.db2.gz QYMCPTJJZHWJJE-UHFFFAOYSA-N -1 3 345.389 4.291 20 0 EIADHM CC(C)(C)c1cccc2c1OCCN2C(=O)c1cc([O-])ccc1Cl ZINC000622541402 1052320416 /nfs/dbraw/zinc/32/04/16/1052320416.db2.gz PDJFDGCITRHQBW-UHFFFAOYSA-N -1 3 345.826 4.382 20 0 EIADHM Cc1cc(C(=O)N=c2cc(-c3cccc(Cl)c3)[n-][nH]2)c(C)s1 ZINC000622892282 1052524526 /nfs/dbraw/zinc/52/45/26/1052524526.db2.gz JNQLNEHTTYADMP-UHFFFAOYSA-N -1 3 331.828 4.083 20 0 EIADHM Cc1ccc(-c2nc(C)c(C(=O)Nc3cc(F)ccc3[O-])s2)o1 ZINC000174884195 1052577044 /nfs/dbraw/zinc/57/70/44/1052577044.db2.gz MTKNPOAQFBELQZ-UHFFFAOYSA-N -1 3 332.356 4.117 20 0 EIADHM CSc1ccccc1C(=O)Nc1cc(Br)ccc1[O-] ZINC000176192446 1052613591 /nfs/dbraw/zinc/61/35/91/1052613591.db2.gz CMKYEPFPZAAHMR-UHFFFAOYSA-N -1 3 338.226 4.129 20 0 EIADHM CSc1ccc(NC(=O)/C(C#N)=C\c2ccc([O-])cc2)cc1Cl ZINC000185792288 1052708668 /nfs/dbraw/zinc/70/86/68/1052708668.db2.gz FLHGURXOWCMTED-WQLSENKSSA-N -1 3 344.823 4.313 20 0 EIADHM CCc1cc(=O)[n-]c(CN[C@@H](C)c2ccc(SC(C)C)cc2)n1 ZINC000182099147 1052913849 /nfs/dbraw/zinc/91/38/49/1052913849.db2.gz OLSSPISBMGWKKQ-ZDUSSCGKSA-N -1 3 331.485 4.096 20 0 EIADHM O=C(N[C@H](CC1CCC1)c1ccccc1)c1c[n-]c2ccccc2c1=O ZINC000183606394 1052979357 /nfs/dbraw/zinc/97/93/57/1052979357.db2.gz GCKXBZVDBRLWEY-HXUWFJFHSA-N -1 3 346.430 4.189 20 0 EIADHM COc1ccc(C(=O)Nc2cc(F)ccc2[O-])cc1OC1CCCC1 ZINC000183780600 1052983996 /nfs/dbraw/zinc/98/39/96/1052983996.db2.gz OPFOBNZPEZYFTP-UHFFFAOYSA-N -1 3 345.370 4.114 20 0 EIADHM COc1ccc(C(=O)Nc2cccc([O-])c2F)cc1OC1CCCC1 ZINC000183804351 1052984730 /nfs/dbraw/zinc/98/47/30/1052984730.db2.gz YADUPPMUQMZLEF-UHFFFAOYSA-N -1 3 345.370 4.114 20 0 EIADHM CC[C@H](c1ccc(Cl)cc1)N(C)Cc1nc(=O)c2sccc2[n-]1 ZINC000194985106 1053050019 /nfs/dbraw/zinc/05/00/19/1053050019.db2.gz UDHCCBFXLZLEPI-CQSZACIVSA-N -1 3 347.871 4.221 20 0 EIADHM CC(C)c1cccc(S(=O)(=O)[N-]c2ccc(Cl)nc2Cl)c1 ZINC001195117012 1053281358 /nfs/dbraw/zinc/28/13/58/1053281358.db2.gz UYZPPTWSLJYUIO-UHFFFAOYSA-N -1 3 345.251 4.313 20 0 EIADHM C[C@@H]1CCC[C@H]([C@H](CNCc2csc(C3CC3)n2)CC(=O)[O-])C1 ZINC000864534227 1053311744 /nfs/dbraw/zinc/31/17/44/1053311744.db2.gz SJGWGJNBKWZQMY-SNPRPXQTSA-N -1 3 336.501 4.027 20 0 EIADHM Cc1ccc(Cl)c(S(=O)(=O)[N-]CC2CCC=CCC2)c1Cl ZINC001195210010 1053334337 /nfs/dbraw/zinc/33/43/37/1053334337.db2.gz UREDSTQODSDNQU-UHFFFAOYSA-N -1 3 348.295 4.327 20 0 EIADHM COc1ccc(Cl)c([N-]S(=O)(=O)c2c(C)cccc2Cl)c1 ZINC001195267572 1053354029 /nfs/dbraw/zinc/35/40/29/1053354029.db2.gz GOKSAFVLBNTZKY-UHFFFAOYSA-N -1 3 346.235 4.111 20 0 EIADHM CC[C@H](C)CO[N-]C(=O)CCC(=O)c1cc(Cl)sc1Cl ZINC000794851644 1053553041 /nfs/dbraw/zinc/55/30/41/1053553041.db2.gz GNAWXZIBGVLBIM-QMMMGPOBSA-N -1 3 338.256 4.112 20 0 EIADHM Cc1sc2[n-]c([C@@H](C)OC(=O)[C@H](C)CC(C)C)nc(=O)c2c1C ZINC000765527007 1053620619 /nfs/dbraw/zinc/62/06/19/1053620619.db2.gz IJZWDHPWWHWSLC-MWLCHTKSSA-N -1 3 336.457 4.300 20 0 EIADHM O=C([N-]Cc1cccc(Cl)c1)C(F)(F)c1ccc(Cl)cc1 ZINC001317851475 1053626146 /nfs/dbraw/zinc/62/61/46/1053626146.db2.gz DUDIDDSPOICGLY-UHFFFAOYSA-N -1 3 330.161 4.402 20 0 EIADHM Cc1cccc(NC(=S)Nc2cc(=O)n(-c3ccccc3)[n-]2)c1C ZINC001196393235 1053653986 /nfs/dbraw/zinc/65/39/86/1053653986.db2.gz YKUPRPPCPXMIHP-UHFFFAOYSA-N -1 3 338.436 4.004 20 0 EIADHM CC[C@@H](NC(=O)c1cc([O-])c2ccccc2c1)c1ccc(OC)cc1 ZINC000471645321 1053677194 /nfs/dbraw/zinc/67/71/94/1053677194.db2.gz DYLQQUXKTQNANK-LJQANCHMSA-N -1 3 335.403 4.435 20 0 EIADHM O=C(Nc1ccccc1N1CCCC1)c1cc([O-])c2ccccc2c1 ZINC000471637307 1053677370 /nfs/dbraw/zinc/67/73/70/1053677370.db2.gz VXCOOVOCXUHUOH-UHFFFAOYSA-N -1 3 332.403 4.398 20 0 EIADHM O=C(Nc1cccc(-c2cc[nH]n2)c1)c1cc([O-])c2ccccc2c1 ZINC000471693751 1053691498 /nfs/dbraw/zinc/69/14/98/1053691498.db2.gz PXAXWDYFCBXABX-UHFFFAOYSA-N -1 3 329.359 4.188 20 0 EIADHM O=C(Nc1cccc(OC(F)F)c1)c1cc([O-])c2ccccc2c1 ZINC000471743094 1053700721 /nfs/dbraw/zinc/70/07/21/1053700721.db2.gz ABLYLTGTQYEJCO-UHFFFAOYSA-N -1 3 329.302 4.399 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N1CCc2c1cc(F)cc2F ZINC000471786275 1053727623 /nfs/dbraw/zinc/72/76/23/1053727623.db2.gz HNXHYKTWHOHUEC-UHFFFAOYSA-N -1 3 325.314 4.027 20 0 EIADHM O=C(c1cc2sccc2c([O-])c1)N1CCC(c2ccco2)CC1 ZINC000855291387 1053897384 /nfs/dbraw/zinc/89/73/84/1053897384.db2.gz HZPADXOBYCVWSJ-UHFFFAOYSA-N -1 3 327.405 4.220 20 0 EIADHM [O-]c1ccc(NC(=S)Nc2ccc(OC(F)(F)F)cc2)cc1F ZINC001197516561 1053921533 /nfs/dbraw/zinc/92/15/33/1053921533.db2.gz IMECJEPZNGBRQM-UHFFFAOYSA-N -1 3 346.305 4.239 20 0 EIADHM CCCN(CC(C)C)C(=O)Nc1ccc(-c2cc(=O)[n-]c(C)n2)cc1 ZINC000339082533 1053938370 /nfs/dbraw/zinc/93/83/70/1053938370.db2.gz SMGPYZMDWMIYRZ-UHFFFAOYSA-N -1 3 342.443 4.058 20 0 EIADHM Cc1ccc(NC(=S)Nc2cc(Br)ccc2[O-])cc1 ZINC001197923166 1054023158 /nfs/dbraw/zinc/02/31/58/1054023158.db2.gz KOXDKBXJCKMKJO-UHFFFAOYSA-N -1 3 337.242 4.272 20 0 EIADHM CCCCCC[C@@H](CC)CN(C)C(=O)c1cc(=O)[n-]c(C2CC2)n1 ZINC000856300418 1054052369 /nfs/dbraw/zinc/05/23/69/1054052369.db2.gz OGVVLFTVEGZCQR-CQSZACIVSA-N -1 3 333.476 4.128 20 0 EIADHM O=C(NCC1([C@@H]2CCCCO2)CCC1)c1cc([O-])c2ccccc2c1 ZINC000871044079 1054148391 /nfs/dbraw/zinc/14/83/91/1054148391.db2.gz DSEAOQNXNRTAGB-IBGZPJMESA-N -1 3 339.435 4.015 20 0 EIADHM COc1ccccc1C(C)(C)NC(=O)c1cc([O-])c2ccccc2c1 ZINC000472024261 1054209677 /nfs/dbraw/zinc/20/96/77/1054209677.db2.gz FKONCYTWLPRVJI-UHFFFAOYSA-N -1 3 335.403 4.219 20 0 EIADHM COc1cccc(F)c1[C@@H](C)NC(=O)c1cc([O-])c2ccccc2c1 ZINC000472212913 1054254968 /nfs/dbraw/zinc/25/49/68/1054254968.db2.gz NKBDDPAWRPDVNW-GFCCVEGCSA-N -1 3 339.366 4.184 20 0 EIADHM C[C@@H](NCc1cccc(OCC(F)(F)F)c1)c1cccc([O-])c1F ZINC000872024007 1054338865 /nfs/dbraw/zinc/33/88/65/1054338865.db2.gz XFEUPBXUVRNIIK-LLVKDONJSA-N -1 3 343.320 4.323 20 0 EIADHM C[C@H](NCc1ccccc1OCC(F)(F)F)c1cccc([O-])c1F ZINC000872023956 1054339298 /nfs/dbraw/zinc/33/92/98/1054339298.db2.gz LXMWSYCGZBFSFK-NSHDSACASA-N -1 3 343.320 4.323 20 0 EIADHM C[C@H](N[C@@H](c1ccc(F)cc1)[C@@H]1CCCO1)c1cccc([O-])c1F ZINC000872028583 1054344588 /nfs/dbraw/zinc/34/45/88/1054344588.db2.gz KRWSIASQEWXGEA-KHDYIWLOSA-N -1 3 333.378 4.241 20 0 EIADHM CC[C@@H](C)C(=O)Nc1cccc(CN[C@H](C)c2cccc([O-])c2F)c1 ZINC000872046647 1054357784 /nfs/dbraw/zinc/35/77/84/1054357784.db2.gz KBNUICLKLJPUEH-ZIAGYGMSSA-N -1 3 344.430 4.367 20 0 EIADHM CC(C)C[C@@H](NC(=O)c1c[n-]c2ccccc2c1=O)c1ccccc1 ZINC000046017247 1054359789 /nfs/dbraw/zinc/35/97/89/1054359789.db2.gz MBPAEEWKZMPVEN-LJQANCHMSA-N -1 3 334.419 4.045 20 0 EIADHM C[C@@H](Nc1cccc(OC[C@@H]2CCCO2)c1)c1cccc([O-])c1F ZINC000872057340 1054369006 /nfs/dbraw/zinc/36/90/06/1054369006.db2.gz XUXVCBSRQYHRJU-CJNGLKHVSA-N -1 3 331.387 4.262 20 0 EIADHM CC[C@H](N[C@H](C)c1cccc([O-])c1F)c1cccc(OC)c1OC ZINC000872092453 1054386599 /nfs/dbraw/zinc/38/65/99/1054386599.db2.gz NPFMRCCQLGYZRF-DOMZBBRYSA-N -1 3 333.403 4.350 20 0 EIADHM O=C([O-])c1csc(CN2CCC[C@H](c3ccc(F)c(F)c3)C2)c1 ZINC000872160792 1054413694 /nfs/dbraw/zinc/41/36/94/1054413694.db2.gz KKHHDMQZYHWRRG-LBPRGKRZSA-N -1 3 337.391 4.104 20 0 EIADHM CCc1oc(C(=O)[O-])cc1CN1CCC(c2ccc(F)cc2)CC1 ZINC000872163430 1054416939 /nfs/dbraw/zinc/41/69/39/1054416939.db2.gz GQKVHTMHRBQMDH-UHFFFAOYSA-N -1 3 331.387 4.059 20 0 EIADHM CCc1oc(C(=O)[O-])cc1CN1CCC(c2cccc(F)c2)CC1 ZINC000872165816 1054418693 /nfs/dbraw/zinc/41/86/93/1054418693.db2.gz MABYDSOQQXZGSM-UHFFFAOYSA-N -1 3 331.387 4.059 20 0 EIADHM CC(C)(C)c1nsc([N-]C(=O)c2ccc(C(F)(F)F)s2)n1 ZINC000671695930 1054421917 /nfs/dbraw/zinc/42/19/17/1054421917.db2.gz VHCAOWWFTYMQLB-UHFFFAOYSA-N -1 3 335.376 4.168 20 0 EIADHM CC[C@@H](C)c1ccccc1NC(=O)[C@@H](C)OC(=O)c1ccc([O-])cc1 ZINC000005061032 1054482867 /nfs/dbraw/zinc/48/28/67/1054482867.db2.gz AJQYFFYTMUZIRV-ZIAGYGMSSA-N -1 3 341.407 4.090 20 0 EIADHM [O-]c1ccc(Br)cc1NC(=S)NCC1CCCCC1 ZINC001199923545 1054496585 /nfs/dbraw/zinc/49/65/85/1054496585.db2.gz ZTYOHDLKYQHOQW-UHFFFAOYSA-N -1 3 343.290 4.021 20 0 EIADHM CCCCCc1nnc([N-]C(=O)c2c(C)occ2C(F)(F)F)s1 ZINC000874135376 1054629120 /nfs/dbraw/zinc/62/91/20/1054629120.db2.gz WFKZEMRMIVQZNN-UHFFFAOYSA-N -1 3 347.362 4.443 20 0 EIADHM COc1cc(C2(C(=O)Nc3cc(Cl)ccc3[O-])CC2)ccc1C ZINC000060330265 1054671492 /nfs/dbraw/zinc/67/14/92/1054671492.db2.gz SLUQIYVIMHMXSK-UHFFFAOYSA-N -1 3 331.799 4.033 20 0 EIADHM C[C@@H](NC(=O)c1cc(=O)c2ccccc2[n-]1)c1cccc2ccccc21 ZINC000061206693 1054747496 /nfs/dbraw/zinc/74/74/96/1054747496.db2.gz NZWIIDINNWSQPT-CQSZACIVSA-N -1 3 342.398 4.172 20 0 EIADHM Cc1sc2[n-]c([C@@H](C)OC(=O)[C@@H]3CCCC34CC4)nc(=O)c2c1C ZINC000860177040 1054782461 /nfs/dbraw/zinc/78/24/61/1054782461.db2.gz LZKUOMXVDXEOKI-PWSUYJOCSA-N -1 3 346.452 4.198 20 0 EIADHM C[C@H](CC(=O)[N-]OCc1ccc(C(F)(F)F)cc1)c1ccco1 ZINC000860313154 1054800922 /nfs/dbraw/zinc/80/09/22/1054800922.db2.gz UONSOPAXNZVQCJ-LLVKDONJSA-N -1 3 327.302 4.040 20 0 EIADHM Cc1cccc([O-])c1C(=O)N1CCC(c2ccnc3ccccc32)CC1 ZINC000861881192 1054996717 /nfs/dbraw/zinc/99/67/17/1054996717.db2.gz ZZBLXCUQLZSRAP-UHFFFAOYSA-N -1 3 346.430 4.269 20 0 EIADHM O=C(Nc1ccccc1Cl)Nc1cc(Br)ccc1[O-] ZINC001202063671 1055003911 /nfs/dbraw/zinc/00/39/11/1055003911.db2.gz PEYMASZXHOBDFQ-UHFFFAOYSA-N -1 3 341.592 4.452 20 0 EIADHM O=C(Nc1ccc([O-])c(Br)c1)Nc1c(F)cccc1F ZINC001202041607 1055016946 /nfs/dbraw/zinc/01/69/46/1055016946.db2.gz DLKPXAAVHWJXJZ-UHFFFAOYSA-N -1 3 343.127 4.077 20 0 EIADHM O=C(Nc1ccc(C(F)(F)F)cc1[O-])Nc1c(F)cccc1F ZINC001202042211 1055016985 /nfs/dbraw/zinc/01/69/85/1055016985.db2.gz QIPFEVVEQSFXJT-UHFFFAOYSA-N -1 3 332.228 4.333 20 0 EIADHM C[C@H](NC(=O)Nc1c([O-])cccc1Br)c1ccccc1 ZINC001202506221 1055026116 /nfs/dbraw/zinc/02/61/16/1055026116.db2.gz QFFWJVNHBMZEPD-JTQLQIEISA-N -1 3 335.201 4.037 20 0 EIADHM CCOc1ccccc1NC(=O)Nc1c([O-])cccc1C(F)(F)F ZINC001202147076 1055050817 /nfs/dbraw/zinc/05/08/17/1055050817.db2.gz PPTZWISTBMGIDR-UHFFFAOYSA-N -1 3 340.301 4.454 20 0 EIADHM C[C@@H](CC(C)(C)c1ccccc1)NC(=O)c1cc(=O)c2ccccc2[n-]1 ZINC000068933446 1055100622 /nfs/dbraw/zinc/10/06/22/1055100622.db2.gz GMNPCOGDQREVLS-HNNXBMFYSA-N -1 3 348.446 4.014 20 0 EIADHM COc1cc(CNC(=O)Nc2ccc(Cl)cc2)cc(Cl)c1[O-] ZINC001202383402 1055158032 /nfs/dbraw/zinc/15/80/32/1055158032.db2.gz OHGZSQZVQPRRMR-UHFFFAOYSA-N -1 3 341.194 4.029 20 0 EIADHM CC(C)Sc1ccc(Cl)cc1[N-]C(=O)c1nccn2ccnc12 ZINC000073422842 1055182034 /nfs/dbraw/zinc/18/20/34/1055182034.db2.gz KPRKMYMVCVROJS-UHFFFAOYSA-N -1 3 346.843 4.136 20 0 EIADHM Cc1ccc([C@@H]2CCCCN2Cc2nnc(-c3ccccc3[O-])o2)cc1 ZINC000878129254 1055191821 /nfs/dbraw/zinc/19/18/21/1055191821.db2.gz IGXFKDOZKNZDGU-SFHVURJKSA-N -1 3 349.434 4.478 20 0 EIADHM [O-]c1ccccc1-c1nnc(CN[C@H](c2ccccc2)C2CCC2)o1 ZINC000878238202 1055218845 /nfs/dbraw/zinc/21/88/45/1055218845.db2.gz NOHZUFWDXBGPRL-LJQANCHMSA-N -1 3 335.407 4.073 20 0 EIADHM CC(C)N(Cc1nnc(-c2ccccc2[O-])o1)[C@@H](C)c1ccsc1 ZINC000878722380 1055383589 /nfs/dbraw/zinc/38/35/89/1055383589.db2.gz FUPUTPGKDLTBQL-ZDUSSCGKSA-N -1 3 343.452 4.475 20 0 EIADHM COc1ccc2nc(-c3ccc(C)c(Br)c3)[n-]c(=O)c2c1 ZINC000507034955 1056034481 /nfs/dbraw/zinc/03/44/81/1056034481.db2.gz JSDBUNJQCOYODW-UHFFFAOYSA-N -1 3 345.196 4.082 20 0 EIADHM CCC[C@@]1(C)CCCN(Cc2nc3c4ccccc4oc3c(=O)[n-]2)C1 ZINC000072896130 1056506732 /nfs/dbraw/zinc/50/67/32/1056506732.db2.gz PUAFKQOKVRTLBT-FQEVSTJZSA-N -1 3 339.439 4.484 20 0 EIADHM O=C([O-])c1ccoc1CN1CCC(CCc2ccc(F)cc2F)CC1 ZINC000656190828 1056690645 /nfs/dbraw/zinc/69/06/45/1056690645.db2.gz GQNXPEZTDUPZDZ-UHFFFAOYSA-N -1 3 349.377 4.101 20 0 EIADHM CCCOCc1nc(=O)c2c(-c3ccc(C)cc3C)csc2[n-]1 ZINC000063579745 1056822304 /nfs/dbraw/zinc/82/23/04/1056822304.db2.gz JHLNGHXZDJTTDA-UHFFFAOYSA-N -1 3 328.437 4.195 20 0 EIADHM Cc1sc2[n-]c([C@H](C)OC(=O)[C@H](C)c3ccco3)nc(=O)c2c1C ZINC000745134101 1059738671 /nfs/dbraw/zinc/73/86/71/1059738671.db2.gz ZAYCZDSKALCJKV-ZJUUUORDSA-N -1 3 346.408 4.015 20 0 EIADHM Cc1sc2[n-]c([C@H](C)OC(=O)[C@@H]3CCC[C@@H](C)C3)nc(=O)c2c1C ZINC000745157869 1059759417 /nfs/dbraw/zinc/75/94/17/1059759417.db2.gz LAGDXQHAZKKHFH-SUZMYJTESA-N -1 3 348.468 4.444 20 0 EIADHM O=C(OCC1CCOCC1)c1cc(-c2ccccc2)cc(Cl)c1[O-] ZINC000746080627 1060005442 /nfs/dbraw/zinc/00/54/42/1060005442.db2.gz YIEJLXWPCZMPLM-UHFFFAOYSA-N -1 3 346.810 4.296 20 0 EIADHM Cc1noc(C(F)(F)F)c1C(=O)[N-]c1ncc(C(C)(C)C)s1 ZINC000746316848 1060123647 /nfs/dbraw/zinc/12/36/47/1060123647.db2.gz PDACSJKTLXADFO-UHFFFAOYSA-N -1 3 333.335 4.008 20 0 EIADHM CCOC(=O)c1oc2ncccc2c1Nc1ccc(Cl)c([O-])c1 ZINC001212589258 1060770513 /nfs/dbraw/zinc/77/05/13/1060770513.db2.gz CMNVYZHPJHSVJL-UHFFFAOYSA-N -1 3 332.743 4.107 20 0 EIADHM CCOC(=O)c1ncc(Cl)cc1Nc1ccc(Cl)c([O-])c1 ZINC001212590430 1060826920 /nfs/dbraw/zinc/82/69/20/1060826920.db2.gz MFJXFPWZUPBUDR-UHFFFAOYSA-N -1 3 327.167 4.014 20 0 EIADHM CC(=O)N1CC2(CC2)c2ccc(Nc3ccc(Cl)c([O-])c3)cc21 ZINC001212592398 1060889399 /nfs/dbraw/zinc/88/93/99/1060889399.db2.gz NSRHJOOLVLIWPQ-UHFFFAOYSA-N -1 3 328.799 4.187 20 0 EIADHM O=C(Cc1ccccc1C(F)(F)F)Nc1cc(Cl)ccc1[O-] ZINC000040849160 213392580 /nfs/dbraw/zinc/39/25/80/213392580.db2.gz IUXXHXSRINJGEL-UHFFFAOYSA-N -1 3 329.705 4.246 20 0 EIADHM Cc1sc2[n-]c(-c3ccccn3)nc(=O)c2c1-c1ccc(F)cc1 ZINC000020369439 202040538 /nfs/dbraw/zinc/04/05/38/202040538.db2.gz YYKPOIZTPBKWHL-UHFFFAOYSA-N -1 3 337.379 4.161 20 0 EIADHM C/C(=C\C(=O)Nc1cccc([O-])c1F)c1ccccc1OC(F)F ZINC000179148874 1032066367 /nfs/dbraw/zinc/06/63/67/1032066367.db2.gz RABBMRYHWXYCMP-MDZDMXLPSA-N -1 3 337.297 4.175 20 0 EIADHM CCOc1cc(CN2CCOC[C@@H]2c2ccccc2)cc(Cl)c1[O-] ZINC000459373625 1032083816 /nfs/dbraw/zinc/08/38/16/1032083816.db2.gz LCIWCSGDDREIDF-QGZVFWFLSA-N -1 3 347.842 4.018 20 0 EIADHM CCC[C@H](NC(=O)Cc1ccc([O-])c(F)c1)c1ccc(F)cc1F ZINC000450102095 1032299531 /nfs/dbraw/zinc/29/95/31/1032299531.db2.gz QIMRBDRAPAPWAV-INIZCTEOSA-N -1 3 337.341 4.010 20 0 EIADHM CN(Cc1nnc(-c2ccccc2[O-])o1)Cc1cccc2ccccc21 ZINC001167049563 1018863651 /nfs/dbraw/zinc/86/36/51/1018863651.db2.gz PVBQFOYBFUDVBI-UHFFFAOYSA-N -1 3 345.402 4.227 20 0 EIADHM COc1cc(C)c(S(=O)(=O)[N-]c2cccc(C)c2C)cc1Cl ZINC000432779744 1032793583 /nfs/dbraw/zinc/79/35/83/1032793583.db2.gz LHGIBBVCOIKZSY-UHFFFAOYSA-N -1 3 339.844 4.075 20 0 EIADHM COCc1cccc([N-]S(=O)(=O)c2c(C)c(C)c(C)c(C)c2C)c1 ZINC000026547347 1019231063 /nfs/dbraw/zinc/23/10/63/1019231063.db2.gz IXGRFIWKKXMBRI-UHFFFAOYSA-N -1 3 347.480 4.176 20 0 EIADHM O=[S@@](Cc1ccc(Br)cc1Cl)c1ccc([O-])cc1 ZINC000108085881 1019335430 /nfs/dbraw/zinc/33/54/30/1019335430.db2.gz DJXJSXYVWJKCFE-GOSISDBHSA-N -1 3 345.645 4.116 20 0 EIADHM C[C@H](c1ccc(OC(F)(F)F)cc1)[S@@](=O)c1ccc([O-])cc1 ZINC000108086546 1019340815 /nfs/dbraw/zinc/34/08/15/1019340815.db2.gz GGGXMFACHFINRG-STFLBKPXSA-N -1 3 330.327 4.160 20 0 EIADHM C[C@H](NC(=O)CCCc1ccc([O-])c(F)c1)C1CCC(F)(F)CC1 ZINC000655341069 1019724789 /nfs/dbraw/zinc/72/47/89/1019724789.db2.gz MPRVUXOXFUQITO-LBPRGKRZSA-N -1 3 343.389 4.184 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1ccc(Oc2cccnc2)cc1 ZINC000063296914 1019819829 /nfs/dbraw/zinc/81/98/29/1019819829.db2.gz GFDVNFJAJZYVOG-UHFFFAOYSA-N -1 3 340.766 4.485 20 0 EIADHM CCCCc1nnc([N-]C(=O)c2cc(F)c(F)cc2Cl)s1 ZINC000014661105 1019968212 /nfs/dbraw/zinc/96/82/12/1019968212.db2.gz QXOCWSWZZCURAM-UHFFFAOYSA-N -1 3 331.775 4.065 20 0 EIADHM O=C(Nc1ccc([O-])c(-c2nc3ccccc3s2)c1)[C@@H]1CC12CC2 ZINC000643339028 1032894806 /nfs/dbraw/zinc/89/48/06/1032894806.db2.gz BELMBIBBSRPHBQ-ZDUSSCGKSA-N -1 3 336.416 4.408 20 0 EIADHM COC(=O)c1cnc2ccc(Nc3cccc(Cl)c3[O-])cc2c1 ZINC001210223588 1020961925 /nfs/dbraw/zinc/96/19/25/1020961925.db2.gz UCEDTUHIFWTOMW-UHFFFAOYSA-N -1 3 328.755 4.124 20 0 EIADHM C[C@H]1CCN(Cc2cc(Br)ccc2C(=O)[O-])CC1(C)C ZINC000579967339 1021035828 /nfs/dbraw/zinc/03/58/28/1021035828.db2.gz DNVXQOZHVOEZMP-NSHDSACASA-N -1 3 340.261 4.015 20 0 EIADHM O=C(Nc1c([O-])cccc1Cl)c1cnn(-c2cccc(Cl)c2)c1 ZINC000580176591 1021740227 /nfs/dbraw/zinc/74/02/27/1021740227.db2.gz VKJNVFPPOAKITM-UHFFFAOYSA-N -1 3 348.189 4.137 20 0 EIADHM Cc1ccc(NC(=O)C(C)C)cc1NC(=O)c1cc([O-])ccc1Cl ZINC000431746319 1021743590 /nfs/dbraw/zinc/74/35/90/1021743590.db2.gz UEEFEIMXKKNDAI-UHFFFAOYSA-N -1 3 346.814 4.201 20 0 EIADHM Cc1oc(-c2cccs2)nc1CN1CCC[C@@H](C(C)(C)C(=O)[O-])C1 ZINC000325460258 1021762311 /nfs/dbraw/zinc/76/23/11/1021762311.db2.gz RBFBTJLZTSEACX-CYBMUJFWSA-N -1 3 348.468 4.034 20 0 EIADHM O=C([O-])C[C@H](NCc1cccc(F)c1)c1cccc(C(F)(F)F)c1 ZINC000340685033 1021992658 /nfs/dbraw/zinc/99/26/58/1021992658.db2.gz UTYFXDXSALBDFV-HNNXBMFYSA-N -1 3 341.304 4.150 20 0 EIADHM FC(F)(F)[C@@H](C[C@@H]1CCCO1)[N-]c1nc(-c2ccccc2)ns1 ZINC000656224493 1022056623 /nfs/dbraw/zinc/05/66/23/1022056623.db2.gz JVEHHLBGFPLDPF-NWDGAFQWSA-N -1 3 343.374 4.117 20 0 EIADHM CCC[C@@H]1[C@@H](C)CCCN1Cc1nc2cc(C(=O)[O-])ccc2n1CC ZINC000580560854 1022212874 /nfs/dbraw/zinc/21/28/74/1022212874.db2.gz AJMDRTIRFOUMPS-WMLDXEAASA-N -1 3 343.471 4.155 20 0 EIADHM O=C([N-]c1c(F)cc(Cl)cc1F)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000180358443 1022474136 /nfs/dbraw/zinc/47/41/36/1022474136.db2.gz UVVSPBDOJKHUAM-UHFFFAOYSA-N -1 3 347.104 4.432 20 0 EIADHM O=C(Nc1ccc2oc(C3CC3)nc2c1)c1cc([O-])ccc1Cl ZINC000431894168 1022931959 /nfs/dbraw/zinc/93/19/59/1022931959.db2.gz NIABVXCLVSYGPZ-UHFFFAOYSA-N -1 3 328.755 4.317 20 0 EIADHM Cc1c(F)cccc1-c1noc(C=C([O-])c2ccccc2Cl)n1 ZINC001211646820 1023203610 /nfs/dbraw/zinc/20/36/10/1023203610.db2.gz ARUNANJBDQOJPW-UHFFFAOYSA-N -1 3 330.746 4.263 20 0 EIADHM CC(C)[C@H](NC(=O)CCCc1ccc([O-])c(F)c1)c1ccccc1 ZINC000468544514 1023216304 /nfs/dbraw/zinc/21/63/04/1023216304.db2.gz SORANJBDZPUSIP-FQEVSTJZSA-N -1 3 329.415 4.368 20 0 EIADHM CCCOc1ccc(CNCc2cc(F)c(C(=O)[O-])c(F)c2)c(C)c1 ZINC000656567536 1023243602 /nfs/dbraw/zinc/24/36/02/1023243602.db2.gz SQBVNYCECIYTOI-UHFFFAOYSA-N -1 3 349.377 4.050 20 0 EIADHM O=C(NC[C@@H]1CC[C@@H]2C[C@@H]2C1)c1cc(Oc2ccccc2)ccc1[O-] ZINC001167711914 1023257348 /nfs/dbraw/zinc/25/73/48/1023257348.db2.gz VHMWEOMLKQPQIP-OAGGEKHMSA-N -1 3 337.419 4.351 20 0 EIADHM O=C([N-]c1c(F)cc(Br)cc1F)c1cccc(F)c1F ZINC000088168228 1023351037 /nfs/dbraw/zinc/35/10/37/1023351037.db2.gz BCQANMZPZSFINL-UHFFFAOYSA-N -1 3 348.093 4.258 20 0 EIADHM CC(C)=CCSC[C@@H](NCc1cc(Cl)ccc1Cl)C(=O)[O-] ZINC000417627945 1023387482 /nfs/dbraw/zinc/38/74/82/1023387482.db2.gz QATRCCNWYBBPBF-CQSZACIVSA-N -1 3 348.295 4.236 20 0 EIADHM CC(C)(C)c1nc(CNCCC2(CC(=O)[O-])CCCCC2)cs1 ZINC000417649391 1023391484 /nfs/dbraw/zinc/39/14/84/1023391484.db2.gz LHGQHZGLJFMQMH-UHFFFAOYSA-N -1 3 338.517 4.346 20 0 EIADHM O=C([O-])c1cc(CN2CCC(c3ccc(Cl)cc3)CC2)cs1 ZINC000581613012 1023421868 /nfs/dbraw/zinc/42/18/68/1023421868.db2.gz OIXOIJPRVUXBGH-UHFFFAOYSA-N -1 3 335.856 4.479 20 0 EIADHM CC(C)(C)c1nc(COC(=O)c2cccc3[n-]c(C(F)F)nc32)co1 ZINC000924085868 1023426567 /nfs/dbraw/zinc/42/65/67/1023426567.db2.gz VYWOTUAXSQQXQW-UHFFFAOYSA-N -1 3 349.337 4.143 20 0 EIADHM C[C@H]1c2c(F)cccc2CCN1Cc1cc(=O)[n-]c(-c2ccccc2)n1 ZINC001167475275 1023466375 /nfs/dbraw/zinc/46/63/75/1023466375.db2.gz YXVAMWHPKKEVJS-AWEZNQCLSA-N -1 3 349.409 4.108 20 0 EIADHM C[C@H](NC(=O)CCCc1ccc([O-])c(F)c1)c1ccccc1Cl ZINC000468575009 1023477089 /nfs/dbraw/zinc/47/70/89/1023477089.db2.gz JCNWDSVZANJEJX-LBPRGKRZSA-N -1 3 335.806 4.385 20 0 EIADHM CCc1cccc(F)c1CN1CCC(C(=O)c2ccc([O-])cc2)CC1 ZINC000684356279 1023477860 /nfs/dbraw/zinc/47/78/60/1023477860.db2.gz WFFRQJYEPNKQJI-UHFFFAOYSA-N -1 3 341.426 4.189 20 0 EIADHM CC[C@H](c1ccc(Cl)cc1)N1C[C@H](C(=O)[O-])C[C@H](C(F)(F)F)C1 ZINC000656757422 1023499554 /nfs/dbraw/zinc/49/95/54/1023499554.db2.gz QGJVFUMJOOUKBG-MBNYWOFBSA-N -1 3 349.780 4.376 20 0 EIADHM C[C@@H](C(=O)Nc1cccc([O-])c1F)c1ccc(Br)cc1 ZINC000129980044 1023623636 /nfs/dbraw/zinc/62/36/36/1023623636.db2.gz ZYJZCOWIKGBRCR-SECBINFHSA-N -1 3 338.176 4.036 20 0 EIADHM CC[C@@H](C)Oc1ccc([N-]S(=O)(=O)c2cc(C)ccc2C)cc1 ZINC000511701747 1023833394 /nfs/dbraw/zinc/83/33/94/1023833394.db2.gz QYXNLELDDPWPJF-OAHLLOKOSA-N -1 3 333.453 4.282 20 0 EIADHM CN(CCCCc1ccccc1)Cc1c(Cl)cccc1C(=O)[O-] ZINC000581948877 1023921804 /nfs/dbraw/zinc/92/18/04/1023921804.db2.gz FXORDSOYESGUCS-UHFFFAOYSA-N -1 3 331.843 4.493 20 0 EIADHM CC(C)N(Cc1coc(-c2ccc(C(=O)[O-])cc2)n1)CC1CCC1 ZINC000581948892 1023924496 /nfs/dbraw/zinc/92/44/96/1023924496.db2.gz GNJJKEJJWKUIMW-UHFFFAOYSA-N -1 3 328.412 4.050 20 0 EIADHM CCCCCOc1ccc(S(=O)(=O)[N-]c2ccccc2C)cc1 ZINC000063146434 1023958635 /nfs/dbraw/zinc/95/86/35/1023958635.db2.gz LQVZMSQWERDYTC-UHFFFAOYSA-N -1 3 333.453 4.365 20 0 EIADHM Cc1cc(=O)[n-]c(C(C)(C)NCc2ccc(-c3cccs3)cc2)n1 ZINC000660750862 1024043205 /nfs/dbraw/zinc/04/32/05/1024043205.db2.gz GGXIJGJVELYTGR-UHFFFAOYSA-N -1 3 339.464 4.244 20 0 EIADHM CCCOc1ccc(Nc2cc(=O)n(-c3ccccc3)[n-]2)cc1F ZINC001211667592 1024090468 /nfs/dbraw/zinc/09/04/68/1024090468.db2.gz BRNKMGFGHWPDPR-UHFFFAOYSA-N -1 3 327.359 4.249 20 0 EIADHM CCN(Cc1ccc(C(=O)[O-])cc1Br)C1CCCCC1 ZINC000226718256 1024120181 /nfs/dbraw/zinc/12/01/81/1024120181.db2.gz IRBLAYCBOXYQGO-UHFFFAOYSA-N -1 3 340.261 4.302 20 0 EIADHM O=C(Cc1ccc(Br)s1)Nc1cc(Cl)ccc1[O-] ZINC000129438193 1024595216 /nfs/dbraw/zinc/59/52/16/1024595216.db2.gz OEAAZKMKPHENQM-UHFFFAOYSA-N -1 3 346.633 4.051 20 0 EIADHM O=C([O-])[C@H]1CN(CCSc2ccc(Cl)cc2)Cc2ccccc21 ZINC000652470786 1024843683 /nfs/dbraw/zinc/84/36/83/1024843683.db2.gz JNWHUYPPLGAOKL-KRWDZBQOSA-N -1 3 347.867 4.116 20 0 EIADHM Cc1cc(CN2CCCC[C@@H]2Cc2ccccc2F)oc1C(=O)[O-] ZINC000652507500 1024859760 /nfs/dbraw/zinc/85/97/60/1024859760.db2.gz FRSFTOPCTVJWQJ-OAHLLOKOSA-N -1 3 331.387 4.023 20 0 EIADHM C[C@H]1CN(Cc2cc(C(=O)[O-])ccc2Cl)CCc2ccc(F)cc21 ZINC000652510658 1024861760 /nfs/dbraw/zinc/86/17/60/1024861760.db2.gz HIBBYIVYNWRKPN-LBPRGKRZSA-N -1 3 347.817 4.339 20 0 EIADHM CC(C)c1occc1C(=O)Nc1nnc(-c2cc3ccccc3o2)[n-]1 ZINC000684604551 1024990880 /nfs/dbraw/zinc/99/08/80/1024990880.db2.gz WCHPWJSIFDNITR-UHFFFAOYSA-N -1 3 336.351 4.187 20 0 EIADHM CC(C)c1occc1C(=O)Nc1n[n-]c(-c2cc3ccccc3o2)n1 ZINC000684604551 1024990890 /nfs/dbraw/zinc/99/08/90/1024990890.db2.gz WCHPWJSIFDNITR-UHFFFAOYSA-N -1 3 336.351 4.187 20 0 EIADHM CC1(C)CC[C@H](NC(=O)Cc2ccc([O-])c(F)c2)c2ccccc21 ZINC001625907328 1025056193 /nfs/dbraw/zinc/05/61/93/1025056193.db2.gz FONLUNRZOSGGPL-KRWDZBQOSA-N -1 3 327.399 4.003 20 0 EIADHM Cc1cc(=O)[n-]c([C@@H](C)SCc2ccc(Br)cc2)n1 ZINC000610861042 1025077321 /nfs/dbraw/zinc/07/73/21/1025077321.db2.gz REZHXDPTXLCRFV-SNVBAGLBSA-N -1 3 339.258 4.248 20 0 EIADHM Cc1csc([C@@H](C)/N=C/c2cc(Br)ccc2[O-])n1 ZINC000067734956 1025235353 /nfs/dbraw/zinc/23/53/53/1025235353.db2.gz CUQIIHWECDFEFQ-UXWFALKESA-N -1 3 325.231 4.100 20 0 EIADHM C[C@H](NCc1cc(C(=O)[O-])cs1)c1cccc(C(F)(F)F)c1 ZINC000317069516 1025434857 /nfs/dbraw/zinc/43/48/57/1025434857.db2.gz MXMFIRUQLRQTGX-VIFPVBQESA-N -1 3 329.343 4.316 20 0 EIADHM CC(C)=CCCSc1nc2c(cnn2Cc2ccccc2)c(=O)[n-]1 ZINC000657284242 1025596636 /nfs/dbraw/zinc/59/66/36/1025596636.db2.gz MERFVOQMLQDFRZ-UHFFFAOYSA-N -1 3 340.452 4.029 20 0 EIADHM Cc1ccc(NCc2cc([O-])cc(F)c2)c(OCC(F)(F)F)c1 ZINC000472080670 1025691297 /nfs/dbraw/zinc/69/12/97/1025691297.db2.gz RKHNRMHZXDLSGT-UHFFFAOYSA-N -1 3 329.293 4.393 20 0 EIADHM COc1cc(C(=O)Nc2ccc(Cl)cc2[O-])cc(OC)c1C(C)C ZINC000512017889 1025730900 /nfs/dbraw/zinc/73/09/00/1025730900.db2.gz LUFHKKHBVCLNJB-UHFFFAOYSA-N -1 3 349.814 4.439 20 0 EIADHM COc1ccc([N-]S(=O)(=O)c2c(C)c(C)cc(C)c2C)c(C)c1 ZINC000014223738 1025774460 /nfs/dbraw/zinc/77/44/60/1025774460.db2.gz KAEPYXAMNGMXOL-UHFFFAOYSA-N -1 3 333.453 4.038 20 0 EIADHM O=C([O-])CCCCCCCNCc1ccc(F)cc1Br ZINC000277373565 1025824022 /nfs/dbraw/zinc/82/40/22/1025824022.db2.gz QMUIVCWDICHLTK-UHFFFAOYSA-N -1 3 346.240 4.103 20 0 EIADHM CC(C)CN(Cc1cccc(Cl)c1)C(=O)c1ccc(O)cc1[O-] ZINC001167840912 1025874104 /nfs/dbraw/zinc/87/41/04/1025874104.db2.gz VDRVVGZAYPGBIY-UHFFFAOYSA-N -1 3 333.815 4.050 20 0 EIADHM Cc1ccc([C@@H]2C[C@@H](C)N(C(=O)c3cc(=O)c4ccccc4[n-]3)C2)cc1 ZINC000279080993 1026057572 /nfs/dbraw/zinc/05/75/72/1026057572.db2.gz SOLWMEVLQUXWDD-NVXWUHKLSA-N -1 3 346.430 4.267 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1ccc(OCC(F)(F)F)cc1 ZINC000111210461 1026096974 /nfs/dbraw/zinc/09/69/74/1026096974.db2.gz BXTHWIDBZKNSRZ-UHFFFAOYSA-N -1 3 345.704 4.239 20 0 EIADHM Cc1cc([O-])ccc1-c1nc(=O)c2c3c(sc2[nH]1)SCCC3 ZINC000277484483 1026198504 /nfs/dbraw/zinc/19/85/04/1026198504.db2.gz LAJDBSREEHOVDE-UHFFFAOYSA-N -1 3 330.434 4.116 20 0 EIADHM O=C(Nc1cccc(OC(F)(F)F)c1)c1cc([O-])ccc1Cl ZINC000320012879 1026331771 /nfs/dbraw/zinc/33/17/71/1026331771.db2.gz FSCJPZSFFCMYNP-UHFFFAOYSA-N -1 3 331.677 4.197 20 0 EIADHM COc1ccc2cc(CNCc3c(F)ccc([O-])c3F)ccc2c1 ZINC000509734135 1026389672 /nfs/dbraw/zinc/38/96/72/1026389672.db2.gz IHDRCVWGJCZWSR-UHFFFAOYSA-N -1 3 329.346 4.122 20 0 EIADHM O=C([O-])C[C@@H](NCc1cc(Cl)cc(Cl)c1)c1ccsc1 ZINC000426684171 1026474490 /nfs/dbraw/zinc/47/44/90/1026474490.db2.gz XVHCNEMMRFATBQ-CYBMUJFWSA-N -1 3 330.236 4.361 20 0 EIADHM CO[C@@H](c1ccccc1Cl)[C@@H](C)NCc1c(F)ccc([O-])c1F ZINC000512216076 1026489408 /nfs/dbraw/zinc/48/94/08/1026489408.db2.gz ADUDVOGXVIOVFR-BMLIUANNSA-N -1 3 341.785 4.190 20 0 EIADHM O=C([O-])[C@@H](NCc1ccc(OCC2CC2)cc1)c1cccc(Cl)c1 ZINC000426743130 1026524924 /nfs/dbraw/zinc/52/49/24/1026524924.db2.gz MWCVPEKZTNQDTB-SFHVURJKSA-N -1 3 345.826 4.044 20 0 EIADHM COc1ccccc1[C@H](NCc1ccc(-c2ccccc2)cc1)C(=O)[O-] ZINC000426774738 1026553185 /nfs/dbraw/zinc/55/31/85/1026553185.db2.gz PVFDYWRLZWQRAN-NRFANRHFSA-N -1 3 347.414 4.278 20 0 EIADHM CC(C)COc1cccc(CN[C@H](CC(=O)[O-])c2ccccc2)c1 ZINC000426780277 1026556046 /nfs/dbraw/zinc/55/60/46/1026556046.db2.gz QANFTNHWKOKLMM-LJQANCHMSA-N -1 3 327.424 4.027 20 0 EIADHM O=C([O-])[C@H](NCc1cc(Cl)cc(C(F)(F)F)c1)c1ccsc1 ZINC000426785508 1026557357 /nfs/dbraw/zinc/55/73/57/1026557357.db2.gz XUHAIQOIQRZCFS-GFCCVEGCSA-N -1 3 349.761 4.336 20 0 EIADHM O=C([O-])C[C@H](NCc1ccc(Cl)s1)c1cccc(Cl)c1 ZINC000426791432 1026566004 /nfs/dbraw/zinc/56/60/04/1026566004.db2.gz IKEDVNPUIBJDLT-LBPRGKRZSA-N -1 3 330.236 4.361 20 0 EIADHM O=C([O-])[C@@H](NCc1cccc(OC2CCCC2)c1)c1cccc(F)c1 ZINC000426803043 1026571634 /nfs/dbraw/zinc/57/16/34/1026571634.db2.gz ZVVFOENXBRTMSP-IBGZPJMESA-N -1 3 343.398 4.063 20 0 EIADHM Cc1cc([C@@H](NCc2ccc(F)c(Cl)c2)C(=O)[O-])ccc1Cl ZINC000426808441 1026572530 /nfs/dbraw/zinc/57/25/30/1026572530.db2.gz MLODPQKNMAHQQO-OAHLLOKOSA-N -1 3 342.197 4.356 20 0 EIADHM Cc1ccc2[nH]c(CN[C@H](CC(=O)[O-])c3ccc(F)cc3)cc2c1C ZINC000426821783 1026579291 /nfs/dbraw/zinc/57/92/91/1026579291.db2.gz WQDJMMDBJIHVOZ-LJQANCHMSA-N -1 3 340.398 4.229 20 0 EIADHM O=C(Nc1cccc([O-])c1F)c1c(F)cc(C(F)(F)F)cc1F ZINC000582462085 1026669810 /nfs/dbraw/zinc/66/98/10/1026669810.db2.gz NWPUPIJNBGEXLA-UHFFFAOYSA-N -1 3 335.203 4.081 20 0 EIADHM COC(=O)c1cnc(S[C@H]2CCc3c2cc(Cl)cc3Cl)[n-]1 ZINC000432664069 1026688427 /nfs/dbraw/zinc/68/84/27/1026688427.db2.gz DHASPCBWMYGRPA-LBPRGKRZSA-N -1 3 343.235 4.283 20 0 EIADHM COC(=O)c1cnc(S[C@@H](Cc2ccccc2)c2ccccc2)[n-]1 ZINC000432666161 1026699981 /nfs/dbraw/zinc/69/99/81/1026699981.db2.gz REXQENBKJFNMJF-KRWDZBQOSA-N -1 3 338.432 4.272 20 0 EIADHM Cc1ccccc1-c1cc(=NC(=O)Cc2csc3ccccc23)[nH][n-]1 ZINC000512340635 1026747681 /nfs/dbraw/zinc/74/76/81/1026747681.db2.gz BUIMXPLRNZSSMC-UHFFFAOYSA-N -1 3 347.443 4.203 20 0 EIADHM CS[C@@H]1CCCCN([C@H](C(=O)[O-])c2cc(Cl)cc(Cl)c2)C1 ZINC000519602340 1026763805 /nfs/dbraw/zinc/76/38/05/1026763805.db2.gz HYPLBUJDOUYJPC-KGLIPLIRSA-N -1 3 348.295 4.337 20 0 EIADHM Cc1ccccc1-c1cc(=NC(=O)c2csc3ccccc23)[nH][n-]1 ZINC000512349293 1026767428 /nfs/dbraw/zinc/76/74/28/1026767428.db2.gz UMYCZFHTLIQURO-UHFFFAOYSA-N -1 3 333.416 4.274 20 0 EIADHM O=c1ccnc(C(=Cc2cc(F)cc(Cl)c2)Cc2ccccc2)[n-]1 ZINC000432695332 1026786225 /nfs/dbraw/zinc/78/62/25/1026786225.db2.gz PJVAOEHETHXOHK-DHDCSXOGSA-N -1 3 340.785 4.346 20 0 EIADHM O=C(Nc1c2c(cc3c1CCC3)CCC2)c1cc([O-])ccc1Cl ZINC000357576862 1026828073 /nfs/dbraw/zinc/82/80/73/1026828073.db2.gz ZGPMRIHDKMAUQH-UHFFFAOYSA-N -1 3 327.811 4.275 20 0 EIADHM CCC[C@H]1CCCCN1Cc1coc(-c2ccc(C(=O)[O-])cc2)n1 ZINC000582612227 1026858463 /nfs/dbraw/zinc/85/84/63/1026858463.db2.gz RGIMZVZKAGDIEX-KRWDZBQOSA-N -1 3 328.412 4.194 20 0 EIADHM Cc1c(C(=O)Nc2cc(Cl)ccc2[O-])cnn1-c1ccccc1C ZINC000440945728 1027130327 /nfs/dbraw/zinc/13/03/27/1027130327.db2.gz CAIYSBGBFSCGIV-UHFFFAOYSA-N -1 3 341.798 4.100 20 0 EIADHM O=C(CCc1cccc(F)c1F)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000440992592 1027176725 /nfs/dbraw/zinc/17/67/25/1027176725.db2.gz ZKMMMYCUJPXVMK-UHFFFAOYSA-N -1 3 345.267 4.261 20 0 EIADHM CSc1ccc([O-])c(C(=O)N2CCC(C)=C(c3ccco3)C2)c1 ZINC000614537068 1027189730 /nfs/dbraw/zinc/18/97/30/1027189730.db2.gz LCLUDSBPPOJFBJ-UHFFFAOYSA-N -1 3 329.421 4.027 20 0 EIADHM CCc1noc(C)c1C(=O)[N-]c1cc(F)ccc1SCC(F)F ZINC000078189191 1027200605 /nfs/dbraw/zinc/20/06/05/1027200605.db2.gz LPNUERRLXRHEEK-UHFFFAOYSA-N -1 3 344.358 4.294 20 0 EIADHM O=C(Nc1ccc([O-])c(C(F)(F)F)c1)[C@H]1CCCc2ccccc21 ZINC000440983695 1027208306 /nfs/dbraw/zinc/20/83/06/1027208306.db2.gz QRGSEAPCQPVXLM-AWEZNQCLSA-N -1 3 335.325 4.470 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@H](CC)c3cccs3)nc2)n1 ZINC000302675662 1027359100 /nfs/dbraw/zinc/35/91/00/1027359100.db2.gz PSHVPLBMFNLJFY-CQSZACIVSA-N -1 3 340.452 4.431 20 0 EIADHM CCC1(CC)[C@H](OC)C[C@@H]1N(C)Cc1cc(C(=O)[O-])ccc1Cl ZINC000566361257 1027380448 /nfs/dbraw/zinc/38/04/48/1027380448.db2.gz HCEPMUGDEZLFLU-JKSUJKDBSA-N -1 3 339.863 4.064 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)N[C@H]1CCC[C@H](c2ccccc2)C1 ZINC000487486415 1027475904 /nfs/dbraw/zinc/47/59/04/1027475904.db2.gz POIJNTJMNCXWMY-IRXDYDNUSA-N -1 3 342.414 4.057 20 0 EIADHM CCn1c2ccc(C(=O)[O-])cc2nc1CN1CCC[C@@H]1CCC(C)C ZINC000514609844 1027580251 /nfs/dbraw/zinc/58/02/51/1027580251.db2.gz MUAAMQYDMOTDIL-MRXNPFEDSA-N -1 3 343.471 4.155 20 0 EIADHM Cc1cc2cc[nH]c2cc1NC(=O)c1ccc2c(c1[O-])OC(C)(C)C2 ZINC000444450264 1027812216 /nfs/dbraw/zinc/81/22/16/1027812216.db2.gz OTDZVGDAHCGSAA-UHFFFAOYSA-N -1 3 336.391 4.148 20 0 EIADHM C[C@H]1C[C@@H](CCNC(=O)c2cc(=O)c3ccccc3[n-]2)CC(C)(C)C1 ZINC000444465864 1027817431 /nfs/dbraw/zinc/81/74/31/1027817431.db2.gz SZMPEMAHLFDKGN-LSDHHAIUSA-N -1 3 340.467 4.110 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)Nc1nc(C2CCC2)cs1 ZINC000444527649 1027856885 /nfs/dbraw/zinc/85/68/85/1027856885.db2.gz OUFGHWAKKYNGSU-UHFFFAOYSA-N -1 3 334.416 4.217 20 0 EIADHM O=C(c1ccccc1[O-])N1CCCC[C@@H]1c1nc(-c2ccccc2)c[nH]1 ZINC000188713316 1028019686 /nfs/dbraw/zinc/01/96/86/1028019686.db2.gz GZZRHXIBWQTFNG-GOSISDBHSA-N -1 3 347.418 4.150 20 0 EIADHM C[C@@H](CC(=O)[N-]OCCC(F)(F)F)c1ccccc1C(F)(F)F ZINC000162847648 1028468218 /nfs/dbraw/zinc/46/82/18/1028468218.db2.gz KZYFXHQILOPERQ-VIFPVBQESA-N -1 3 343.267 4.199 20 0 EIADHM [O-]c1ccccc1-c1nc(-c2ccc(Br)cc2F)no1 ZINC000445449175 1028538129 /nfs/dbraw/zinc/53/81/29/1028538129.db2.gz UJGJRGYYAHSCKM-UHFFFAOYSA-N -1 3 335.132 4.011 20 0 EIADHM COc1cc(OC)cc(-c2noc(-c3cc4ccccc4cc3[O-])n2)c1 ZINC000445449865 1028538158 /nfs/dbraw/zinc/53/81/58/1028538158.db2.gz QCMIYOZQCRDHAK-UHFFFAOYSA-N -1 3 348.358 4.280 20 0 EIADHM O=C(N=c1cc(-c2cc(Cl)cc(Cl)c2)[n-][nH]1)c1ccsc1 ZINC000524047754 1028604403 /nfs/dbraw/zinc/60/44/03/1028604403.db2.gz WBDLNGSDYQGCTC-UHFFFAOYSA-N -1 3 338.219 4.119 20 0 EIADHM Cc1cc(N2CCCC[C@H]2C)ccc1[N-]S(=O)(=O)c1ccccc1 ZINC000150995608 1028754533 /nfs/dbraw/zinc/75/45/33/1028754533.db2.gz QWDAYTFJIHTDGL-MRXNPFEDSA-N -1 3 344.480 4.175 20 0 EIADHM [O-]c1c(F)cc(Nc2cc(F)c(OCC3CC3)c(F)c2)cc1F ZINC001213388629 1028846292 /nfs/dbraw/zinc/84/62/92/1028846292.db2.gz DHCWCGPJESQWCZ-UHFFFAOYSA-N -1 3 327.277 4.481 20 0 EIADHM COc1cc(C)c(Nc2cc(F)c([O-])c(F)c2)cc1Br ZINC001213388632 1028846830 /nfs/dbraw/zinc/84/68/30/1028846830.db2.gz DIAVLJWMZILZLJ-UHFFFAOYSA-N -1 3 344.155 4.494 20 0 EIADHM CC(C)OCCOCc1cccc(NCc2ccc([O-])c(F)c2)c1 ZINC000892348284 1029007849 /nfs/dbraw/zinc/00/78/49/1029007849.db2.gz CENLXBSNHSQFFW-UHFFFAOYSA-N -1 3 333.403 4.085 20 0 EIADHM C[C@H]1CCC[C@H](CCN(CCC(=O)[O-])Cc2cccc(F)c2F)C1 ZINC000583758086 1029131467 /nfs/dbraw/zinc/13/14/67/1029131467.db2.gz SRGTZSJSYMWLFF-LSDHHAIUSA-N -1 3 339.426 4.458 20 0 EIADHM CC1CCC(OC2CCN(Cc3ccc(C(=O)[O-])c(F)c3)CC2)CC1 ZINC000583883928 1029327849 /nfs/dbraw/zinc/32/78/49/1029327849.db2.gz LYPKQKQTPMWREL-UHFFFAOYSA-N -1 3 349.446 4.084 20 0 EIADHM CCCC(=O)[C@H](CCC)Oc1c([O-])cc(Br)cc1F ZINC001227589057 1029361383 /nfs/dbraw/zinc/36/13/83/1029361383.db2.gz YJCFBDAKYLYDED-ZDUSSCGKSA-N -1 3 333.197 4.211 20 0 EIADHM Cc1cc(S(=O)(=O)[N-]c2ccc(OC(C)(C)C)cc2)ccc1F ZINC000525009629 1029383637 /nfs/dbraw/zinc/38/36/37/1029383637.db2.gz AHOGEKCQFRLESN-UHFFFAOYSA-N -1 3 337.416 4.112 20 0 EIADHM Cc1noc(C(C)C)c1[N-]C(=O)c1ccc(Br)s1 ZINC000928788160 1029464401 /nfs/dbraw/zinc/46/44/01/1029464401.db2.gz BENYYHKCLDHZRM-UHFFFAOYSA-N -1 3 329.219 4.183 20 0 EIADHM CC(C)[C@@H](CC1CCCCC1)C(=O)Nc1nnc(C(F)(F)F)[n-]1 ZINC000525235674 1029536334 /nfs/dbraw/zinc/53/63/34/1029536334.db2.gz UACJQZMQIPHGHV-LLVKDONJSA-N -1 3 332.370 4.005 20 0 EIADHM CC(C)[C@@H](CC1CCCCC1)C(=O)Nc1nc(C(F)(F)F)n[n-]1 ZINC000525235674 1029536341 /nfs/dbraw/zinc/53/63/41/1029536341.db2.gz UACJQZMQIPHGHV-LLVKDONJSA-N -1 3 332.370 4.005 20 0 EIADHM Cc1ccc([N-]S(=O)(=O)c2cc(C)cc3cccnc32)c(Cl)c1 ZINC000614736579 1029638418 /nfs/dbraw/zinc/63/84/18/1029638418.db2.gz BDAPTWAMGYOMPG-UHFFFAOYSA-N -1 3 346.839 4.306 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(NCc3ccc(Cl)cc3)nc2)n1 ZINC000301175970 1029681538 /nfs/dbraw/zinc/68/15/38/1029681538.db2.gz MEDUROZYEYVIAJ-UHFFFAOYSA-N -1 3 340.814 4.072 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@@H]3CCCc4ccccc43)nc2)n1 ZINC000301192701 1029684193 /nfs/dbraw/zinc/68/41/93/1029684193.db2.gz XJKAQJVKHOLZHJ-GOSISDBHSA-N -1 3 346.434 4.296 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N3CCC[C@@H]3CC(C)(C)C)nc2)n1 ZINC000301409794 1029728038 /nfs/dbraw/zinc/72/80/38/1029728038.db2.gz OGMPUKLOZAXASX-MRXNPFEDSA-N -1 3 340.471 4.212 20 0 EIADHM CC(C)(C)OC(=O)c1cccc(C(=O)Nc2c([O-])cccc2Cl)c1 ZINC000584320166 1029734342 /nfs/dbraw/zinc/73/43/42/1029734342.db2.gz GHHRUNRPDDHMGF-UHFFFAOYSA-N -1 3 347.798 4.253 20 0 EIADHM CC[C@@H](C)c1cc(C(=O)[N-]c2nc(-c3ccccc3F)co2)on1 ZINC000360956580 1029918897 /nfs/dbraw/zinc/91/88/97/1029918897.db2.gz MODBQSMBUUCNMZ-SNVBAGLBSA-N -1 3 329.331 4.235 20 0 EIADHM CCc1cccc(C(=O)Nc2ccc(Oc3ncccn3)cc2C)c1[O-] ZINC000094057200 1030005433 /nfs/dbraw/zinc/00/54/33/1030005433.db2.gz LFEMIZAKLUOYNZ-UHFFFAOYSA-N -1 3 349.390 4.098 20 0 EIADHM CCOc1ccc([C@@H](C)NCc2cccc(C(=O)[O-])c2)cc1OCC ZINC000262949067 1030050841 /nfs/dbraw/zinc/05/08/41/1030050841.db2.gz APWWHTAZVILXIA-CQSZACIVSA-N -1 3 343.423 4.033 20 0 EIADHM Cc1nc(C(C)(C)C)sc1C(=O)[N-]c1nnc(-c2ccco2)s1 ZINC000148705354 1030108386 /nfs/dbraw/zinc/10/83/86/1030108386.db2.gz VQQKQPXQCRPGQZ-UHFFFAOYSA-N -1 3 348.453 4.113 20 0 EIADHM C[C@@H]1C[C@@H](C(=O)[O-])C[C@H](C)N1Cc1coc(-c2ccc(Cl)cc2)n1 ZINC000530178993 1030201654 /nfs/dbraw/zinc/20/16/54/1030201654.db2.gz KHVKOBBMTSVCTB-DABQJJPHSA-N -1 3 348.830 4.069 20 0 EIADHM C[C@H](CCC[C@H](C)C(=O)[O-])NCc1csc(-c2ccccc2)n1 ZINC000321391220 1030333086 /nfs/dbraw/zinc/33/30/86/1030333086.db2.gz WSGVRSMBBFXEKW-UONOGXRCSA-N -1 3 332.469 4.179 20 0 EIADHM O=C(Nc1cc(Br)ccc1[O-])C1(c2ccccc2)CCC1 ZINC000530777058 1030706943 /nfs/dbraw/zinc/70/69/43/1030706943.db2.gz FIXRADBHMWETKU-UHFFFAOYSA-N -1 3 346.224 4.215 20 0 EIADHM O=C(Nc1cc(F)ccc1[O-])c1ccccc1C(=O)c1ccccc1 ZINC000530895841 1030782889 /nfs/dbraw/zinc/78/28/89/1030782889.db2.gz HIHIZSRQWUHZNU-UHFFFAOYSA-N -1 3 335.334 4.015 20 0 EIADHM O=C([N-]c1nnc(C2CC2)s1)c1ccc(-c2ccc(F)cc2)o1 ZINC000021292565 1030817701 /nfs/dbraw/zinc/81/77/01/1030817701.db2.gz MQRYGNDVAMBJTB-UHFFFAOYSA-N -1 3 329.356 4.067 20 0 EIADHM CCc1oc2ccccc2c1CN(C)C(=O)Cc1ccc([O-])c(F)c1 ZINC000448610556 1030865461 /nfs/dbraw/zinc/86/54/61/1030865461.db2.gz JNDFSOWEQLTMPT-UHFFFAOYSA-N -1 3 341.382 4.041 20 0 EIADHM C[C@@H]1CCN(Cc2nc3c4ccccc4oc3c(=O)[n-]2)c2ccccc21 ZINC000042147023 1031104577 /nfs/dbraw/zinc/10/45/77/1031104577.db2.gz UVTXEBDLKNEQEH-CYBMUJFWSA-N -1 3 345.402 4.183 20 0 EIADHM C[C@H]1CCN(Cc2nc3c4ccccc4oc3c(=O)[n-]2)c2ccccc21 ZINC000042147024 1031105366 /nfs/dbraw/zinc/10/53/66/1031105366.db2.gz UVTXEBDLKNEQEH-ZDUSSCGKSA-N -1 3 345.402 4.183 20 0 EIADHM CCOc1cc([C@H]2Nc3ccccc3C(=O)N2CC)cc(Cl)c1[O-] ZINC000042186092 1031535264 /nfs/dbraw/zinc/53/52/64/1031535264.db2.gz WKUVGKRQFTYUQU-KRWDZBQOSA-N -1 3 346.814 4.031 20 0 EIADHM C[C@H](c1cccc(O)c1)N(C)Cc1cccc([O-])c1Br ZINC000459346952 1031872350 /nfs/dbraw/zinc/87/23/50/1031872350.db2.gz KVKPHIFBALWIEK-LLVKDONJSA-N -1 3 336.229 4.053 20 0 EIADHM C[C@@H](NCc1cc(=O)[n-]c(C2CC2)n1)c1ccc(Cl)cc1Cl ZINC000459352878 1031892681 /nfs/dbraw/zinc/89/26/81/1031892681.db2.gz SJOHQLOSDTUPJP-SECBINFHSA-N -1 3 338.238 4.217 20 0 EIADHM COc1c(C)cc(S(=O)(=O)[N-]c2cc(Cl)ccc2C)cc1C ZINC000512576607 1033417441 /nfs/dbraw/zinc/41/74/41/1033417441.db2.gz HQQQPHLPLYHLTI-UHFFFAOYSA-N -1 3 339.844 4.075 20 0 EIADHM CCN(C(=O)c1c[n-]c2c(Cl)cccc2c1=O)[C@H]1CCCC[C@@H]1C ZINC001143552796 1033774993 /nfs/dbraw/zinc/77/49/93/1033774993.db2.gz DZJJKWQWSXWQMN-LRDDRELGSA-N -1 3 346.858 4.222 20 0 EIADHM Cc1ccnc(-c2ccc(NC(=O)c3cc([O-])ccc3Cl)cc2)n1 ZINC000433342580 1034248807 /nfs/dbraw/zinc/24/88/07/1034248807.db2.gz LPKGGYSAZOHVEL-UHFFFAOYSA-N -1 3 339.782 4.063 20 0 EIADHM CCOc1cc(CNc2ccc(F)cc2OC)cc(Cl)c1[O-] ZINC000513573319 1035045094 /nfs/dbraw/zinc/04/50/94/1035045094.db2.gz VECGAGXCJGHMSM-UHFFFAOYSA-N -1 3 325.767 4.204 20 0 EIADHM COc1ccc([C@H]([N-]c2nc3cc(C)ccc3o2)c2nccn2C)cc1 ZINC000513652687 1035082394 /nfs/dbraw/zinc/08/23/94/1035082394.db2.gz NOTCHCDXJDOPAK-SFHVURJKSA-N -1 3 348.406 4.080 20 0 EIADHM O=C(Cc1cscc1Br)Nc1ccc(Cl)cc1[O-] ZINC000490651956 1035568429 /nfs/dbraw/zinc/56/84/29/1035568429.db2.gz ULQUEKJYJSVVON-UHFFFAOYSA-N -1 3 346.633 4.051 20 0 EIADHM O=C(Nc1ccc(N2CCCCC2)cc1)c1cc([O-])ccc1Cl ZINC000323858842 1035715731 /nfs/dbraw/zinc/71/57/31/1035715731.db2.gz QBAVCKTYXQOSEI-UHFFFAOYSA-N -1 3 330.815 4.288 20 0 EIADHM CCc1ccccc1C(=O)Nc1nnc(-c2cc3ccccc3o2)[n-]1 ZINC000485126796 1035716050 /nfs/dbraw/zinc/71/60/50/1035716050.db2.gz JHIUYGISSWHGFB-UHFFFAOYSA-N -1 3 332.363 4.033 20 0 EIADHM CCc1ccccc1C(=O)Nc1n[n-]c(-c2cc3ccccc3o2)n1 ZINC000485126796 1035716070 /nfs/dbraw/zinc/71/60/70/1035716070.db2.gz JHIUYGISSWHGFB-UHFFFAOYSA-N -1 3 332.363 4.033 20 0 EIADHM Cc1noc(C)c1[N-]C(=O)c1csc(-c2cccc(Cl)c2)n1 ZINC000347417722 1035785117 /nfs/dbraw/zinc/78/51/17/1035785117.db2.gz VYMXSJJYSXFPRY-UHFFFAOYSA-N -1 3 333.800 4.321 20 0 EIADHM Cc1cc(OCCN[C@H](C(=O)[O-])c2ccccc2F)ccc1C(C)C ZINC000905374402 1035809365 /nfs/dbraw/zinc/80/93/65/1035809365.db2.gz CTTDGZSCFHCJBI-IBGZPJMESA-N -1 3 345.414 4.052 20 0 EIADHM CC(C)(C)c1ccc(CN2CCC(C(=O)[O-])(C(F)(F)F)CC2)s1 ZINC000905736863 1035879563 /nfs/dbraw/zinc/87/95/63/1035879563.db2.gz AFQJJWYKBKUEMW-UHFFFAOYSA-N -1 3 349.418 4.275 20 0 EIADHM O=C(c1ccccc1[O-])N1CCC[C@H]1c1cccc(Br)c1 ZINC000195703496 1035882117 /nfs/dbraw/zinc/88/21/17/1035882117.db2.gz XOYORUXJRJGJPH-HNNXBMFYSA-N -1 3 346.224 4.132 20 0 EIADHM COc1cc(/C=C2\CCc3cc(C#N)ccc3C2=O)cc(Cl)c1[O-] ZINC000078696922 1036295054 /nfs/dbraw/zinc/29/50/54/1036295054.db2.gz CDNGHVCSAGYFEI-VGOFMYFVSA-N -1 3 339.778 4.138 20 0 EIADHM C[C@H](SCc1cc(=O)[n-]c(C2CC2)n1)c1nc2ccccc2o1 ZINC000572017273 1036395544 /nfs/dbraw/zinc/39/55/44/1036395544.db2.gz QEBZIPZEIHZNNN-JTQLQIEISA-N -1 3 327.409 4.195 20 0 EIADHM CC(C)c1ccc(C(=O)N2CCC[C@@H](CC(F)(F)F)C2)c([O-])c1 ZINC000421964871 1036861559 /nfs/dbraw/zinc/86/15/59/1036861559.db2.gz NVVHWGFEIJWBBT-LBPRGKRZSA-N -1 3 329.362 4.320 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)N1CCC[C@H](CC(F)(F)F)C1 ZINC000421955396 1036868187 /nfs/dbraw/zinc/86/81/87/1036868187.db2.gz HLWCMZTZZSOZAV-CYBMUJFWSA-N -1 3 347.352 4.045 20 0 EIADHM CCc1ccc([C@@H](C)C(=O)Nc2ccc(Br)cc2[O-])cc1 ZINC000589943532 1036914030 /nfs/dbraw/zinc/91/40/30/1036914030.db2.gz FRZDVOSYNHCDCJ-LLVKDONJSA-N -1 3 348.240 4.459 20 0 EIADHM CCC[C@H]1CCCC[C@H]1C[N-]S(=O)(=O)c1cccc(Cl)c1F ZINC001212162415 1036976262 /nfs/dbraw/zinc/97/62/62/1036976262.db2.gz MZLIZPRWUOGVEC-STQMWFEESA-N -1 3 347.883 4.364 20 0 EIADHM CC(C)Cc1ccc(S(=O)(=O)[N-]c2c(O)cccc2Cl)cc1 ZINC000647919153 1037069040 /nfs/dbraw/zinc/06/90/40/1037069040.db2.gz OXIBCMRCKGKIPL-UHFFFAOYSA-N -1 3 339.844 4.045 20 0 EIADHM Cc1ccc(C(=O)Nc2ccc(Br)cc2[O-])cc1Cl ZINC000590701478 1037148883 /nfs/dbraw/zinc/14/88/83/1037148883.db2.gz VMCKAFZVJNZDTQ-UHFFFAOYSA-N -1 3 340.604 4.369 20 0 EIADHM CC(=O)c1ccc(C(=O)Nc2ccccc2OC(C)(C)C)cc1[O-] ZINC000668826752 1037364832 /nfs/dbraw/zinc/36/48/32/1037364832.db2.gz KPHSLBUVKCGXBB-UHFFFAOYSA-N -1 3 327.380 4.024 20 0 EIADHM CCOC(=O)N(C)c1ccc(NCc2c([O-])cccc2Cl)cc1 ZINC000157311336 1037453125 /nfs/dbraw/zinc/45/31/25/1037453125.db2.gz FSXHWJRGKBQRAP-UHFFFAOYSA-N -1 3 334.803 4.250 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N(C)Cc3cccc(C)c3C)nc2)n1 ZINC000488467901 1037615148 /nfs/dbraw/zinc/61/51/48/1037615148.db2.gz XLQQGWOHDOECLT-UHFFFAOYSA-N -1 3 348.450 4.060 20 0 EIADHM CC(C)CC1CCN(Cc2nc3c4ccccc4oc3c(=O)[n-]2)CC1 ZINC000760922546 1037721859 /nfs/dbraw/zinc/72/18/59/1037721859.db2.gz IKNHBHTVOKOJJU-UHFFFAOYSA-N -1 3 339.439 4.340 20 0 EIADHM Cc1cccc(-c2noc(-c3cc([O-])cc(Br)c3)n2)c1 ZINC000700840336 1037838706 /nfs/dbraw/zinc/83/87/06/1037838706.db2.gz ASYTVNBCTIYCCM-UHFFFAOYSA-N -1 3 331.169 4.180 20 0 EIADHM CCc1onc(C)c1[N-]C(=O)c1cnc(-c2ccc(F)c(F)c2)s1 ZINC000503679339 1037866796 /nfs/dbraw/zinc/86/67/96/1037866796.db2.gz JNUXIBOLUOBMJK-UHFFFAOYSA-N -1 3 349.362 4.199 20 0 EIADHM C[C@H]1CCc2c(sc3ncnc(NCc4ccc([O-])c(F)c4)c23)C1 ZINC000606156749 1037906465 /nfs/dbraw/zinc/90/64/65/1037906465.db2.gz MWUKTMIGEYPPNN-JTQLQIEISA-N -1 3 343.427 4.273 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)c1cc2c(cccc2Cl)s1 ZINC000606537203 1038153519 /nfs/dbraw/zinc/15/35/19/1038153519.db2.gz ZPPHTXMWODAWJB-UHFFFAOYSA-N -1 3 335.787 4.329 20 0 EIADHM Cc1nc(-c2cccs2)ccc1C(=O)Nc1cc(F)ccc1[O-] ZINC000533971141 1038770426 /nfs/dbraw/zinc/77/04/26/1038770426.db2.gz FUJAUIAUFDCTNS-UHFFFAOYSA-N -1 3 328.368 4.216 20 0 EIADHM C[C@@H](C(=O)N=c1cc(-c2cccc(Cl)c2)[n-][nH]1)c1cccc(F)c1 ZINC000608359534 1038801545 /nfs/dbraw/zinc/80/15/45/1038801545.db2.gz KXNZJNZXWKFQEE-LLVKDONJSA-N -1 3 343.789 4.033 20 0 EIADHM CCCCCCOc1cc(C)ccc1C[N-]C(=O)C(F)(F)C(F)F ZINC001126896472 1038881823 /nfs/dbraw/zinc/88/18/23/1038881823.db2.gz JIGVXJJFPLYPOQ-UHFFFAOYSA-N -1 3 349.368 4.471 20 0 EIADHM O=C(Nc1ccc([O-])c(C(F)(F)F)c1)[C@@H]1CC[C@H](C(F)(F)F)C1 ZINC000552116035 1039145642 /nfs/dbraw/zinc/14/56/42/1039145642.db2.gz ZVQZDQPHPIRIOB-SFYZADRCSA-N -1 3 341.251 4.328 20 0 EIADHM C[C@@H](CC(=O)Nc1c([O-])cccc1Cl)c1ccc(F)cc1F ZINC000552436727 1039515226 /nfs/dbraw/zinc/51/52/26/1039515226.db2.gz UGXUPAJHTPAODU-VIFPVBQESA-N -1 3 325.742 4.456 20 0 EIADHM Cc1ccc(-c2nc(C(=O)Nc3c([O-])cccc3Cl)cs2)o1 ZINC000552434608 1039515837 /nfs/dbraw/zinc/51/58/37/1039515837.db2.gz RDHYGZPJEYFEGS-UHFFFAOYSA-N -1 3 334.784 4.323 20 0 EIADHM O=C([O-])c1cc(Cl)ccc1CN1CCC2(CC(F)(F)C2)CC1 ZINC001142647003 1039663501 /nfs/dbraw/zinc/66/35/01/1039663501.db2.gz LNNKPXVBMOALOT-UHFFFAOYSA-N -1 3 329.774 4.050 20 0 EIADHM CCc1ccc([O-])c(C(=O)N(CC)[C@H](C)Cc2ccc(OC)cc2)c1 ZINC000537642480 1039724898 /nfs/dbraw/zinc/72/48/98/1039724898.db2.gz BMMPBZOCEWYZBF-OAHLLOKOSA-N -1 3 341.451 4.057 20 0 EIADHM CCc1ccc([O-])c(C(=O)N2CC[C@H](C(F)(F)F)C3(CCC3)C2)c1 ZINC000514202115 1039733536 /nfs/dbraw/zinc/73/35/36/1039733536.db2.gz SEDSPNXTZMMILT-HNNXBMFYSA-N -1 3 341.373 4.149 20 0 EIADHM CN(C(=O)c1cc([O-])ccc1Cl)c1cccc(OC(F)(F)F)c1 ZINC000555858004 1039743064 /nfs/dbraw/zinc/74/30/64/1039743064.db2.gz AJXCEDDMROPHKP-UHFFFAOYSA-N -1 3 345.704 4.221 20 0 EIADHM COc1cccc([C@H]2C[C@H](N(C)C(=O)c3cc([O-])ccc3Cl)C2)c1 ZINC000456919885 1039746687 /nfs/dbraw/zinc/74/66/87/1039746687.db2.gz IJJBYNPNXPWXAR-HDJSIYSDSA-N -1 3 345.826 4.072 20 0 EIADHM CC(C)C1(C(=O)Nc2ccc(C(=O)OC(C)(C)C)cc2[O-])CCC1 ZINC001142652655 1039796739 /nfs/dbraw/zinc/79/67/39/1039796739.db2.gz UNBNPKGNDXJFNB-UHFFFAOYSA-N -1 3 333.428 4.112 20 0 EIADHM O=C(c1cc([O-])ccc1Cl)N1CCC[C@H](Cc2ccccc2)C1 ZINC000555921427 1039809686 /nfs/dbraw/zinc/80/96/86/1039809686.db2.gz FPABELIMKGAYHL-OAHLLOKOSA-N -1 3 329.827 4.141 20 0 EIADHM O=S(=O)([N-]c1cc(F)ccc1Cl)c1cc(F)cc(Cl)c1 ZINC000535139414 1039997781 /nfs/dbraw/zinc/99/77/81/1039997781.db2.gz UTBTWEZBUXBMAN-UHFFFAOYSA-N -1 3 338.162 4.072 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1ccc(F)cc1OC(F)F ZINC000535443435 1040264356 /nfs/dbraw/zinc/26/43/56/1040264356.db2.gz RMVOFELZIGHFPS-UHFFFAOYSA-N -1 3 331.677 4.038 20 0 EIADHM O=C(COc1ccc(Cl)c(Cl)c1)Nc1cc(Cl)ccc1[O-] ZINC000060093448 1040264747 /nfs/dbraw/zinc/26/47/47/1040264747.db2.gz KQARZKIPMUJSBV-UHFFFAOYSA-N -1 3 346.597 4.370 20 0 EIADHM CCCc1cc(=O)[n-]c(C(=Cc2ccc(OCC(F)F)cc2)CC)n1 ZINC000435335560 1040289107 /nfs/dbraw/zinc/28/91/07/1040289107.db2.gz JAAUKWMFCOBNDT-GXDHUFHOSA-N -1 3 348.393 4.317 20 0 EIADHM Cc1ccc(C)c(S(=O)(=O)[N-]c2ccc(OC(C)(C)C)cc2)c1 ZINC000514853080 1040289741 /nfs/dbraw/zinc/28/97/41/1040289741.db2.gz ZYDHLBWKQZEYQZ-UHFFFAOYSA-N -1 3 333.453 4.282 20 0 EIADHM CCCc1cc(=O)[n-]c(C(=Cc2ccc(SC)c(OC)c2)CC)n1 ZINC000435338571 1040292333 /nfs/dbraw/zinc/29/23/33/1040292333.db2.gz GUEHLEQYNXWYPM-UVTDQMKNSA-N -1 3 344.480 4.404 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@H](C)c3ccsc3)nc2)n1 ZINC000669827135 1040489159 /nfs/dbraw/zinc/48/91/59/1040489159.db2.gz RKZKWOQEQMLHQW-LLVKDONJSA-N -1 3 326.425 4.041 20 0 EIADHM C[C@H]1CCCN(Cc2csc(-c3ccc(C(=O)[O-])cc3)n2)CC1 ZINC000515305857 1040635009 /nfs/dbraw/zinc/63/50/09/1040635009.db2.gz JNYAOZMVVIUGKL-ZDUSSCGKSA-N -1 3 330.453 4.130 20 0 EIADHM Cc1nc(-c2ccc(CNCc3c(F)ccc([O-])c3F)cc2)cs1 ZINC000551985439 1040745001 /nfs/dbraw/zinc/74/50/01/1040745001.db2.gz OTSBLXJDTYWKFU-UHFFFAOYSA-N -1 3 346.402 4.392 20 0 EIADHM CCc1cccc(C(=O)N(CC)[C@H](C)Cc2ccc(OC)cc2)c1[O-] ZINC000539844518 1040835786 /nfs/dbraw/zinc/83/57/86/1040835786.db2.gz AHAPNKMEGJSHLT-OAHLLOKOSA-N -1 3 341.451 4.057 20 0 EIADHM CC(C)[C@@H](C(=O)Nc1cc(Cl)c([O-])c(Cl)c1)N1CCCCC1 ZINC000539963372 1040960311 /nfs/dbraw/zinc/96/03/11/1040960311.db2.gz URRBTZVVBHWEBA-AWEZNQCLSA-N -1 3 345.270 4.148 20 0 EIADHM CCOc1ccc(S(=O)(=O)[N-]c2c(C)cc(C)cc2C)c(C)c1 ZINC000538003789 1040981817 /nfs/dbraw/zinc/98/18/17/1040981817.db2.gz CVRBOUWJSBDJTE-UHFFFAOYSA-N -1 3 333.453 4.120 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-][C@H](c2ccc(Cl)cc2)C2CCC2)o1 ZINC000538007225 1040984238 /nfs/dbraw/zinc/98/42/38/1040984238.db2.gz XREGFVZQZYMFCV-INIZCTEOSA-N -1 3 339.844 4.061 20 0 EIADHM COc1ccc([O-])c(C(=O)N2C[C@@H](c3ccccc3)c3ccccc32)c1 ZINC000436292907 1041059167 /nfs/dbraw/zinc/05/91/67/1041059167.db2.gz CUWHUFKRYUBGTA-IBGZPJMESA-N -1 3 345.398 4.193 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)N[C@H]1CCCCC12CCCC2 ZINC000462978368 1041179705 /nfs/dbraw/zinc/17/97/05/1041179705.db2.gz JRKSDHHPQAQYJD-SFHVURJKSA-N -1 3 333.447 4.473 20 0 EIADHM CCc1nc(CNC/C=C\c2c(C)cc(C)cc2C)ccc1C(=O)[O-] ZINC000903996142 1041254409 /nfs/dbraw/zinc/25/44/09/1041254409.db2.gz BGKAGARFCTWPRO-SREVYHEPSA-N -1 3 338.451 4.070 20 0 EIADHM O=C(c1cc([O-])ccc1Cl)N1C[C@@H]2CCCCN2c2ccccc21 ZINC000554647175 1041306702 /nfs/dbraw/zinc/30/67/02/1041306702.db2.gz ODTLGCQOVCLOIM-ZDUSSCGKSA-N -1 3 342.826 4.065 20 0 EIADHM COCc1ccccc1NC(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436526685 1041311368 /nfs/dbraw/zinc/31/13/68/1041311368.db2.gz RAOQYAYAUSMNJE-UHFFFAOYSA-N -1 3 347.414 4.382 20 0 EIADHM CC(=O)c1ccc(C(=O)Nc2cccc(OC3CCCC3)c2)cc1[O-] ZINC000436530667 1041312849 /nfs/dbraw/zinc/31/28/49/1041312849.db2.gz NRJVZWYHLFTBRC-UHFFFAOYSA-N -1 3 339.391 4.169 20 0 EIADHM [O-]c1ccccc1-c1nc(-c2cc(Br)ccc2F)no1 ZINC000436532530 1041318870 /nfs/dbraw/zinc/31/88/70/1041318870.db2.gz KIDGUFFNUXAISX-UHFFFAOYSA-N -1 3 335.132 4.011 20 0 EIADHM COc1ccc(C(=O)N(C)[C@@H](C)[C@@H](C)c2ccc(Cl)cc2)c([O-])c1 ZINC000436575495 1041338183 /nfs/dbraw/zinc/33/81/83/1041338183.db2.gz NPAMOHRJMPMTJU-OLZOCXBDSA-N -1 3 347.842 4.318 20 0 EIADHM Cc1nc(C)c(-c2csc(NC(=O)c3cccc(C)c3[O-])n2)s1 ZINC000436569138 1041348474 /nfs/dbraw/zinc/34/84/74/1041348474.db2.gz AIXZTHDIYVCYKG-UHFFFAOYSA-N -1 3 345.449 4.150 20 0 EIADHM CC(=O)c1ccc(C(=O)N(C)Cc2csc3ccccc23)cc1[O-] ZINC000436574273 1041352618 /nfs/dbraw/zinc/35/26/18/1041352618.db2.gz JZERDEUTCPXZEH-UHFFFAOYSA-N -1 3 339.416 4.082 20 0 EIADHM Cc1c[nH]c(-c2ccccc2NC(=O)c2cc3c(cc2[O-])CCCC3)n1 ZINC000436592863 1041352636 /nfs/dbraw/zinc/35/26/36/1041352636.db2.gz AFAGEGIXELVWGV-UHFFFAOYSA-N -1 3 347.418 4.222 20 0 EIADHM CC(C)c1ccc(C(=O)N2CC[C@@H](COc3ccccc3)C2)c([O-])c1 ZINC000436598039 1041355540 /nfs/dbraw/zinc/35/55/40/1041355540.db2.gz YDEBKEUOVOCSFR-MRXNPFEDSA-N -1 3 339.435 4.057 20 0 EIADHM CN(Cc1cccs1)C(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436580642 1041356905 /nfs/dbraw/zinc/35/69/05/1041356905.db2.gz CIRJPKMRMUVCIE-UHFFFAOYSA-N -1 3 337.444 4.317 20 0 EIADHM CC(C)c1ccc(C(=O)N2CCC(OCC3CCCC3)CC2)c([O-])c1 ZINC000436584865 1041360573 /nfs/dbraw/zinc/36/05/73/1041360573.db2.gz NZAWMKYYGKSDPS-UHFFFAOYSA-N -1 3 345.483 4.327 20 0 EIADHM C[C@H]1CCSCCN1C(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436603604 1041368725 /nfs/dbraw/zinc/36/87/25/1041368725.db2.gz MEXIDNIBMSJKON-AWEZNQCLSA-N -1 3 343.448 4.152 20 0 EIADHM CC(C)c1ccc([C@H]2CCCN2C(=O)c2ccc(O)cc2[O-])cc1 ZINC000436627497 1041379539 /nfs/dbraw/zinc/37/95/39/1041379539.db2.gz WLVQXQOYRFBXHR-GOSISDBHSA-N -1 3 325.408 4.199 20 0 EIADHM COc1ccc2c(c1)CCCCN2C(=O)c1ccc(C)c(C)c1[O-] ZINC000436619524 1041387857 /nfs/dbraw/zinc/38/78/57/1041387857.db2.gz RRRNWKNGVGBHNT-UHFFFAOYSA-N -1 3 325.408 4.001 20 0 EIADHM O=C(Nc1cccc(COC2CCCCC2)c1)c1c([O-])cccc1O ZINC000436649598 1041390277 /nfs/dbraw/zinc/39/02/77/1041390277.db2.gz VSYSITXHOSFNFI-UHFFFAOYSA-N -1 3 341.407 4.199 20 0 EIADHM Cc1ccc(C(=O)Nc2cc(-c3cncc(F)c3)ccc2C)c([O-])c1 ZINC000436623315 1041390533 /nfs/dbraw/zinc/39/05/33/1041390533.db2.gz DPRLUENGTBIDNN-UHFFFAOYSA-N -1 3 336.366 4.462 20 0 EIADHM Cc1cccc([C@@H]2CCCCCN2C(=O)c2ccc(O)cc2[O-])c1 ZINC000436623061 1041390552 /nfs/dbraw/zinc/39/05/52/1041390552.db2.gz FTGOGDAWNCSEPL-SFHVURJKSA-N -1 3 325.408 4.164 20 0 EIADHM O=C([N-]c1nc2ccccc2s1)c1c(F)c(F)cc(F)c1F ZINC000480559232 1041393025 /nfs/dbraw/zinc/39/30/25/1041393025.db2.gz CRZISWNQDRDINH-UHFFFAOYSA-N -1 3 326.274 4.105 20 0 EIADHM CCOc1ccccc1CN(C)C(=O)c1ccc(C(C)C)cc1[O-] ZINC000436670844 1041408065 /nfs/dbraw/zinc/40/80/65/1041408065.db2.gz GOLZKKCDRIROIW-UHFFFAOYSA-N -1 3 327.424 4.187 20 0 EIADHM O=C(c1ccc(O)cc1[O-])N1CCCCC[C@@H]1/C=C\c1ccccc1 ZINC000436677888 1041417870 /nfs/dbraw/zinc/41/78/70/1041417870.db2.gz FYGXGOOQQNPEJR-QXPKXGMISA-N -1 3 337.419 4.196 20 0 EIADHM CO[C@@H](C)c1cccc(NC(=O)c2ccc3c(c2[O-])OC(C)(C)C3)c1 ZINC000436679376 1041419389 /nfs/dbraw/zinc/41/93/89/1041419389.db2.gz GBJDJWQLRAJBTL-LBPRGKRZSA-N -1 3 341.407 4.065 20 0 EIADHM CC(C)c1ccc(C(=O)N[C@H](c2ccccc2)[C@@H]2CCOC2)c([O-])c1 ZINC000436762286 1041460178 /nfs/dbraw/zinc/46/01/78/1041460178.db2.gz BVQAHWPLDGNNLC-YLJYHZDGSA-N -1 3 339.435 4.023 20 0 EIADHM CCN(C(=O)c1cc(C)ccc1[O-])c1cccc(Br)c1 ZINC000436755779 1041466989 /nfs/dbraw/zinc/46/69/89/1041466989.db2.gz NQSDZBCQRQUZNF-UHFFFAOYSA-N -1 3 334.213 4.130 20 0 EIADHM CC(C)c1nn(C)cc1-c1noc(-c2ccc(C(C)C)cc2[O-])n1 ZINC000436777203 1041470872 /nfs/dbraw/zinc/47/08/72/1041470872.db2.gz BTFYPTGJCRORAB-UHFFFAOYSA-N -1 3 326.400 4.090 20 0 EIADHM C[C@H](NC(=O)c1cc(Oc2ccccc2)ccc1[O-])c1cccnc1 ZINC000436792386 1041485076 /nfs/dbraw/zinc/48/50/76/1041485076.db2.gz NNLPIWNZFMCBDS-AWEZNQCLSA-N -1 3 334.375 4.071 20 0 EIADHM CCc1ccc(C(=O)N2CCCCC[C@H]2[C@@H]2CCCCC2=O)c([O-])c1 ZINC000436832589 1041497977 /nfs/dbraw/zinc/49/79/77/1041497977.db2.gz SQFRJGOQACVWDA-WMZOPIPTSA-N -1 3 343.467 4.099 20 0 EIADHM Cc1ccc(C(=O)N2CCC([C@H](F)c3ccccc3F)CC2)c([O-])c1 ZINC000436838405 1041506189 /nfs/dbraw/zinc/50/61/89/1041506189.db2.gz KIHZTMMAIUGECO-IBGZPJMESA-N -1 3 345.389 4.403 20 0 EIADHM Cc1cccc(C(=O)Nc2ccccc2O[C@@H](C)C(F)(F)F)c1[O-] ZINC000436843681 1041513157 /nfs/dbraw/zinc/51/31/57/1041513157.db2.gz JTMOEHLPOYJDLH-NSHDSACASA-N -1 3 339.313 4.283 20 0 EIADHM CCc1cccc(C(=O)N(c2ccc(OC)cc2)[C@@H](C)C2CC2)c1[O-] ZINC000538741512 1041515883 /nfs/dbraw/zinc/51/58/83/1041515883.db2.gz IZNQGYOKASVOQY-AWEZNQCLSA-N -1 3 339.435 4.409 20 0 EIADHM CCSc1cccc(F)c1[N-]C(=O)c1ccc(OC(C)C)cn1 ZINC000484925033 1041523267 /nfs/dbraw/zinc/52/32/67/1041523267.db2.gz KHDAAZMCSSSEJO-UHFFFAOYSA-N -1 3 334.416 4.372 20 0 EIADHM COc1ccc([O-])c(-c2nc(C(C)(C)c3ccc(Cl)cc3)no2)c1 ZINC000436894074 1041534567 /nfs/dbraw/zinc/53/45/67/1041534567.db2.gz OXPGBYQBJRGSIR-UHFFFAOYSA-N -1 3 344.798 4.430 20 0 EIADHM CCc1ccc([O-])c(C(=O)N2CCCCC[C@@H]2[C@H]2CCCCC2=O)c1 ZINC000538784916 1041542762 /nfs/dbraw/zinc/54/27/62/1041542762.db2.gz QVMADPFZVWPUBA-SJLPKXTDSA-N -1 3 343.467 4.099 20 0 EIADHM Cc1ccc(-c2noc(-c3cc(Cc4ccccc4)ccc3[O-])n2)cn1 ZINC000436899655 1041553370 /nfs/dbraw/zinc/55/33/70/1041553370.db2.gz FFVWXZWKJVTBME-UHFFFAOYSA-N -1 3 343.386 4.403 20 0 EIADHM Cc1noc(-c2ccccc2)c1NC(=O)c1ccc2c(c1[O-])CCCC2 ZINC000436915263 1041554664 /nfs/dbraw/zinc/55/46/64/1041554664.db2.gz PPWSLJJEBRJCTI-UHFFFAOYSA-N -1 3 348.402 4.487 20 0 EIADHM Cc1cc(Br)ccc1Cc1noc(-c2ccccc2[O-])n1 ZINC000436945301 1041568921 /nfs/dbraw/zinc/56/89/21/1041568921.db2.gz PEOMPPGGUSJHSD-UHFFFAOYSA-N -1 3 345.196 4.104 20 0 EIADHM CCSc1nccnc1-c1noc(-c2ccc(C(C)C)cc2[O-])n1 ZINC000436956895 1041575075 /nfs/dbraw/zinc/57/50/75/1041575075.db2.gz URUIEFPHJFRXII-UHFFFAOYSA-N -1 3 342.424 4.135 20 0 EIADHM C[C@H](c1noc(-c2ccccc2[O-])n1)c1ccc(Br)cc1 ZINC000436956788 1041575367 /nfs/dbraw/zinc/57/53/67/1041575367.db2.gz PCUMVERHFRKSHP-JTQLQIEISA-N -1 3 345.196 4.357 20 0 EIADHM CC(=O)Nc1ccc(-c2noc(-c3cc4ccccc4cc3[O-])n2)cc1 ZINC000436994051 1041584927 /nfs/dbraw/zinc/58/49/27/1041584927.db2.gz ACIDNAUTCPKMIS-UHFFFAOYSA-N -1 3 345.358 4.221 20 0 EIADHM C[C@H](CC(=O)NCc1ccc([O-])c(F)c1)Cc1ccc(Cl)cc1 ZINC000539023433 1041611891 /nfs/dbraw/zinc/61/18/91/1041611891.db2.gz DEKQAEYEQJHOBW-LBPRGKRZSA-N -1 3 335.806 4.070 20 0 EIADHM CC1CCN(C(=O)c2ccc(NCc3cc([O-])cc(F)c3)cc2)CC1 ZINC000437252226 1041717190 /nfs/dbraw/zinc/71/71/90/1041717190.db2.gz PILUASUWFWOWGU-UHFFFAOYSA-N -1 3 342.414 4.016 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)N[C@H]1C[C@H](c2ccccc2F)C1 ZINC000437397017 1041787387 /nfs/dbraw/zinc/78/73/87/1041787387.db2.gz YVMIDCSCPQLPRT-SHTZXODSSA-N -1 3 345.389 4.056 20 0 EIADHM CC(=O)c1cccc(NC(=O)[C@@H](C)CCCc2ccccc2)c1[O-] ZINC000517228732 1041917083 /nfs/dbraw/zinc/91/70/83/1041917083.db2.gz XWURGWUKIAUKGR-AWEZNQCLSA-N -1 3 325.408 4.192 20 0 EIADHM COc1cccc(C(=O)Nc2ccc(OC(C)C)c(Cl)c2)c1[O-] ZINC000302927276 1042185297 /nfs/dbraw/zinc/18/52/97/1042185297.db2.gz CJHLAIXOSWDQKS-UHFFFAOYSA-N -1 3 335.787 4.094 20 0 EIADHM CC[C@@H](C)Oc1ccc([N-]S(=O)(=O)c2ccc(F)c(C)c2)cc1 ZINC000517937047 1042283272 /nfs/dbraw/zinc/28/32/72/1042283272.db2.gz NJZLEWKUKAOPEU-CYBMUJFWSA-N -1 3 337.416 4.112 20 0 EIADHM O=C([N-]c1nnc(-c2ccco2)s1)c1ccc(-c2ccccc2)o1 ZINC000542194701 1042337899 /nfs/dbraw/zinc/33/78/99/1042337899.db2.gz VBIFGRZNQNDXHM-UHFFFAOYSA-N -1 3 337.360 4.310 20 0 EIADHM Cc1ccccc1-c1cc(=NC(=O)[C@H](C)c2cccc(Cl)c2)[nH][n-]1 ZINC000439147403 1042519671 /nfs/dbraw/zinc/51/96/71/1042519671.db2.gz MWTYLSHXLLGABP-CYBMUJFWSA-N -1 3 339.826 4.203 20 0 EIADHM O=C([N-]c1cc(Cl)cc(F)c1F)c1cnc([C@H]2CCCO2)s1 ZINC000441567780 1042886411 /nfs/dbraw/zinc/88/64/11/1042886411.db2.gz FTWFZEYAWCDMGG-SNVBAGLBSA-N -1 3 344.770 4.179 20 0 EIADHM O=C(Nc1ccc(Br)cc1[O-])C1[C@H]2CCCCCC[C@H]12 ZINC001141622221 1042893078 /nfs/dbraw/zinc/89/30/78/1042893078.db2.gz HPVLQBCXXNWYCP-RYUDHWBXSA-N -1 3 338.245 4.310 20 0 EIADHM CCSCc1cc(C(=O)[N-]c2cc(Cl)cc(F)c2F)no1 ZINC000441582546 1042896121 /nfs/dbraw/zinc/89/61/21/1042896121.db2.gz RJJMATSDVPUKEE-UHFFFAOYSA-N -1 3 332.759 4.112 20 0 EIADHM Cc1noc(C)c1CSc1nnc([N-]c2ccccc2F)s1 ZINC000006901930 1042912610 /nfs/dbraw/zinc/91/26/10/1042912610.db2.gz FQWSPESWYGJHPS-UHFFFAOYSA-N -1 3 336.417 4.318 20 0 EIADHM CCCc1ccc(S(=O)(=O)[N-]c2ccc(OC(F)F)cc2)cc1 ZINC000007409106 1042936404 /nfs/dbraw/zinc/93/64/04/1042936404.db2.gz CJQYYZSTYFXVKG-UHFFFAOYSA-N -1 3 341.379 4.041 20 0 EIADHM O=C(NCc1ccc2ncccc2c1)c1cc([O-])c2ccccc2c1 ZINC000356142853 1043149755 /nfs/dbraw/zinc/14/97/55/1043149755.db2.gz SQVWVRRGZAOYGL-UHFFFAOYSA-N -1 3 328.371 4.024 20 0 EIADHM CC(C)COc1cccc(OCC(=O)Nc2cc(Cl)ccc2[O-])c1 ZINC000507916063 1043187973 /nfs/dbraw/zinc/18/79/73/1043187973.db2.gz ZOIHHWTVIWNGKE-UHFFFAOYSA-N -1 3 349.814 4.098 20 0 EIADHM Cc1nc(-c2cccc(C)c2)[nH]c1C(=O)Nc1ccc([O-])c(Cl)c1 ZINC000509178752 1043207069 /nfs/dbraw/zinc/20/70/69/1043207069.db2.gz OFHZGSRTFOPGHY-UHFFFAOYSA-N -1 3 341.798 4.305 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N1CC[C@H](Cc2ccccc2)C1 ZINC000525934109 1043237468 /nfs/dbraw/zinc/23/74/68/1043237468.db2.gz BBLCALAEUGTLBH-QGZVFWFLSA-N -1 3 331.415 4.250 20 0 EIADHM Cc1c2cc(F)ccc2sc1C(=O)NCc1ccc([O-])c(F)c1 ZINC000133193788 1043242434 /nfs/dbraw/zinc/24/24/34/1043242434.db2.gz ILQRRINUWSNHCF-UHFFFAOYSA-N -1 3 333.359 4.124 20 0 EIADHM O=C(N[C@H]1C[C@@H]1c1c(F)cccc1F)c1cc([O-])c2ccccc2c1 ZINC000526893952 1043244064 /nfs/dbraw/zinc/24/40/64/1043244064.db2.gz NSTPYEGRLQJECL-YOEHRIQHSA-N -1 3 339.341 4.110 20 0 EIADHM O=C(NCC1(c2cccc(F)c2)CC1)c1cc([O-])c2ccccc2c1 ZINC000526927185 1043245731 /nfs/dbraw/zinc/24/57/31/1043245731.db2.gz CQNPWOSONKUGGZ-UHFFFAOYSA-N -1 3 335.378 4.146 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N1CC[C@@H](COc2ccccc2)C1 ZINC000526923299 1043245868 /nfs/dbraw/zinc/24/58/68/1043245868.db2.gz RULYOSDGVPGWFH-MRXNPFEDSA-N -1 3 347.414 4.087 20 0 EIADHM CCC(=O)Nc1ccc(NC(=O)c2cc([O-])c3ccccc3c2)cc1 ZINC000527162620 1043251400 /nfs/dbraw/zinc/25/14/00/1043251400.db2.gz UBLBAWBWDIEOQP-UHFFFAOYSA-N -1 3 334.375 4.146 20 0 EIADHM O=C(Nc1ccc(N2CCCCC2)nc1)c1cc([O-])c2ccccc2c1 ZINC000527165848 1043251569 /nfs/dbraw/zinc/25/15/69/1043251569.db2.gz BULDZZOTBGCVFQ-UHFFFAOYSA-N -1 3 347.418 4.183 20 0 EIADHM Cc1ccccc1C1=CCN(C(=O)c2cc([O-])c3ccccc3c2)C1 ZINC000527172547 1043253637 /nfs/dbraw/zinc/25/36/37/1043253637.db2.gz JWBQXMZQOWBCOC-UHFFFAOYSA-N -1 3 329.399 4.393 20 0 EIADHM O=C(Oc1ccccc1OCC(F)(F)F)c1cc2ccsc2[n-]1 ZINC000727642907 1043255628 /nfs/dbraw/zinc/25/56/28/1043255628.db2.gz QMNPAUCIMDVXGH-UHFFFAOYSA-N -1 3 341.310 4.390 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)N1CCC[C@@H]1c1cccc(Cl)c1 ZINC000163688262 1043258864 /nfs/dbraw/zinc/25/88/64/1043258864.db2.gz APRMBOILLXPZSX-MRXNPFEDSA-N -1 3 348.805 4.231 20 0 EIADHM O=C(N[C@H](c1ccccc1)[C@@H]1CCCO1)c1cc([O-])c2ccccc2c1 ZINC000527450142 1043261026 /nfs/dbraw/zinc/26/10/26/1043261026.db2.gz PVUKNIALENOKBG-LEWJYISDSA-N -1 3 347.414 4.196 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N1CCS[C@H]2CCCC[C@H]21 ZINC000527467575 1043263362 /nfs/dbraw/zinc/26/33/62/1043263362.db2.gz YWLSBPPGZHPUSQ-AEFFLSMTSA-N -1 3 327.449 4.046 20 0 EIADHM Cc1c(NC(=O)c2cc([O-])c3ccccc3c2)cnn1C1CCCC1 ZINC000281117478 1043267609 /nfs/dbraw/zinc/26/76/09/1043267609.db2.gz FPBZMOXJKDHHKM-UHFFFAOYSA-N -1 3 335.407 4.418 20 0 EIADHM Cc1ccc([C@H]2CCCCN2C(=O)NCc2ccc([O-])c(F)c2)cc1 ZINC000465983204 1043285938 /nfs/dbraw/zinc/28/59/38/1043285938.db2.gz REEZCRHWKSFDQZ-GOSISDBHSA-N -1 3 342.414 4.277 20 0 EIADHM COc1ccc(C(=O)N(C2CC2)[C@@H]2CCCc3ccccc32)c([O-])c1 ZINC000220114615 1043292826 /nfs/dbraw/zinc/29/28/26/1043292826.db2.gz IDWIGJCTVAAFRP-LJQANCHMSA-N -1 3 337.419 4.083 20 0 EIADHM [O-]c1cccc(CN2CCC[C@@H]2c2cccc3c2OCCO3)c1Cl ZINC000508159581 1043297238 /nfs/dbraw/zinc/29/72/38/1043297238.db2.gz JIRRSFGGYSNYBS-OAHLLOKOSA-N -1 3 345.826 4.154 20 0 EIADHM Cc1nc(S(=O)(=O)[C@H](C)c2ccccc2F)[n-]c1-c1ccccc1 ZINC000186838619 1043312095 /nfs/dbraw/zinc/31/20/95/1043312095.db2.gz YJGWYOSWQHRSQL-CYBMUJFWSA-N -1 3 344.411 4.059 20 0 EIADHM Cc1[n-]c(S(=O)(=O)[C@H](C)c2ccccc2F)nc1-c1ccccc1 ZINC000186838619 1043312100 /nfs/dbraw/zinc/31/21/00/1043312100.db2.gz YJGWYOSWQHRSQL-CYBMUJFWSA-N -1 3 344.411 4.059 20 0 EIADHM C[C@H](OC(=O)c1cc(Cl)c(Cl)[n-]1)C(=O)c1cc(F)ccc1F ZINC000730298004 1043494626 /nfs/dbraw/zinc/49/46/26/1043494626.db2.gz VCDISCRJUZHYTO-LURJTMIESA-N -1 3 348.132 4.028 20 0 EIADHM O=S(=O)([N-]c1cc(Cl)cc(F)c1F)c1cccc(Cl)c1 ZINC000442232165 1043564334 /nfs/dbraw/zinc/56/43/34/1043564334.db2.gz ADFGFOOGVJUHMQ-UHFFFAOYSA-N -1 3 338.162 4.072 20 0 EIADHM Cc1cc(Cl)ccc1S(=O)(=O)[N-]c1ccc(OC(F)F)cc1 ZINC000521384455 1043740533 /nfs/dbraw/zinc/74/05/33/1043740533.db2.gz MMPUEYFDDRTRST-UHFFFAOYSA-N -1 3 347.770 4.051 20 0 EIADHM CC(C)(C)C[C@@H](NC(=O)c1nnc2ccccc2c1[O-])c1ccccc1 ZINC000731869884 1043842755 /nfs/dbraw/zinc/84/27/55/1043842755.db2.gz QAFQFTCCBJVYPW-QGZVFWFLSA-N -1 3 349.434 4.243 20 0 EIADHM Cc1ccccc1[C@@H](CC(C)C)NC(=O)c1nnc2ccccc2c1[O-] ZINC000732833965 1044019296 /nfs/dbraw/zinc/01/92/96/1044019296.db2.gz LLBFOOVMULBBIA-GOSISDBHSA-N -1 3 349.434 4.161 20 0 EIADHM CCc1cc2c(CNc3ccc4c(c3)CCC4)cc(=O)oc2cc1[O-] ZINC000007242574 1044119795 /nfs/dbraw/zinc/11/97/95/1044119795.db2.gz NNGFBUXBZPNODO-UHFFFAOYSA-N -1 3 335.403 4.162 20 0 EIADHM Cc1ccc([O-])c(C(=O)Nc2ccc3oc(C(F)(F)F)nc3c2)c1 ZINC000195748887 1044238082 /nfs/dbraw/zinc/23/80/82/1044238082.db2.gz XQHLCBJGHASUIN-UHFFFAOYSA-N -1 3 336.269 4.113 20 0 EIADHM [O-]c1ccc(-c2nc(-c3cc(C(F)(F)F)ccc3Cl)no2)nc1 ZINC001212557961 1044305238 /nfs/dbraw/zinc/30/52/38/1044305238.db2.gz KRLNCHKMAIWTMM-UHFFFAOYSA-N -1 3 341.676 4.176 20 0 EIADHM O=C([N-]Cc1nc(C2CC2)cs1)C(F)(F)c1cccc(Cl)c1 ZINC000766197643 1044408764 /nfs/dbraw/zinc/40/87/64/1044408764.db2.gz IRCCXTADOLZNQI-UHFFFAOYSA-N -1 3 342.798 4.082 20 0 EIADHM COc1cc(C(=O)[N-]c2cc(Cl)ccc2Oc2ccccc2)on1 ZINC000543400274 1044523124 /nfs/dbraw/zinc/52/31/24/1044523124.db2.gz XPETYCIQZCMKFT-UHFFFAOYSA-N -1 3 344.754 4.381 20 0 EIADHM CCc1cccc(C(=O)Nc2ccc3ccc(Cl)cc3n2)c1[O-] ZINC001626015609 1044550162 /nfs/dbraw/zinc/55/01/62/1044550162.db2.gz CIVYYABGYOAJCX-UHFFFAOYSA-N -1 3 326.783 4.409 20 0 EIADHM O=C(Nc1ccc(Br)cc1[O-])[C@@H]1CCCc2ccccc21 ZINC000642323596 1044661781 /nfs/dbraw/zinc/66/17/81/1044661781.db2.gz UKNDNNXNSKEHLO-CQSZACIVSA-N -1 3 346.224 4.213 20 0 EIADHM CCCOc1ccc(S(=O)(=O)[N-]c2ccc3[nH]c(C)cc3c2)cc1 ZINC000029048389 1044703461 /nfs/dbraw/zinc/70/34/61/1044703461.db2.gz UVJRWIILCMTYCN-UHFFFAOYSA-N -1 3 344.436 4.066 20 0 EIADHM COc1cccc(C(=O)Nc2nc(C)c(-c3ccccc3)s2)c1[O-] ZINC000914735890 1044718981 /nfs/dbraw/zinc/71/89/81/1044718981.db2.gz WKGJNZAKDJICER-UHFFFAOYSA-N -1 3 340.404 4.085 20 0 EIADHM CC(C)c1cc(Cl)nc([N-][C@H](c2ccccn2)C(F)(F)F)n1 ZINC001168478286 1044722668 /nfs/dbraw/zinc/72/26/68/1044722668.db2.gz AQRWSUOPGQFUOL-GFCCVEGCSA-N -1 3 330.741 4.364 20 0 EIADHM CCc1nnsc1C(=O)[N-]c1ccccc1SC1CCCC1 ZINC000071884811 1044820648 /nfs/dbraw/zinc/82/06/48/1044820648.db2.gz FNKFOTFVLIDSEB-UHFFFAOYSA-N -1 3 333.482 4.388 20 0 EIADHM Cc1cc(=O)[n-]c([C@H](C)Sc2ccc(Br)cc2)n1 ZINC000469807149 1044832746 /nfs/dbraw/zinc/83/27/46/1044832746.db2.gz FPIDTMAVZVGVLC-VIFPVBQESA-N -1 3 325.231 4.106 20 0 EIADHM Cc1ccc(C)c(NC(=O)[C@@H](C)OC(=O)c2cc3ccsc3[n-]2)c1 ZINC000914890320 1044852912 /nfs/dbraw/zinc/85/29/12/1044852912.db2.gz RNNFEGLJZDGRGU-GFCCVEGCSA-N -1 3 342.420 4.030 20 0 EIADHM O=C([O-])C[C@@H](NCc1cccc(C(F)(F)F)c1)c1cccs1 ZINC000315378478 1044877358 /nfs/dbraw/zinc/87/73/58/1044877358.db2.gz DEIBNBVQMJSZBO-GFCCVEGCSA-N -1 3 329.343 4.073 20 0 EIADHM CC(C)(C)C[C@H](NC(=O)c1cc(=O)c2ccccc2[n-]1)c1ccccc1 ZINC000053510525 1044899455 /nfs/dbraw/zinc/89/94/55/1044899455.db2.gz ZRCLIEWYIYUVOO-IBGZPJMESA-N -1 3 348.446 4.435 20 0 EIADHM Cc1cc(CO[N-]C(=O)Cc2cccc3ccccc32)c(C)s1 ZINC000738294471 1045056486 /nfs/dbraw/zinc/05/64/86/1045056486.db2.gz MWLGWRDBDPDRRH-UHFFFAOYSA-N -1 3 325.433 4.309 20 0 EIADHM C[C@@H](NC(=O)NCc1ccc([O-])c(F)c1)c1csc2ccccc21 ZINC000739007039 1045115602 /nfs/dbraw/zinc/11/56/02/1045115602.db2.gz SRPAPZFAWDYZDL-LLVKDONJSA-N -1 3 344.411 4.306 20 0 EIADHM [O-]c1ccc(F)c(CNc2ccccc2OCc2cscn2)c1F ZINC000509423662 1045152503 /nfs/dbraw/zinc/15/25/03/1045152503.db2.gz WYFAARMUYZXLSM-UHFFFAOYSA-N -1 3 348.374 4.318 20 0 EIADHM O=C(/C=C\Sc1cc(F)ccc1F)Nc1cc(F)ccc1[O-] ZINC000797958484 1045196960 /nfs/dbraw/zinc/19/69/60/1045196960.db2.gz KHFGFOHZQYOKKM-WAYWQWQTSA-N -1 3 325.311 4.054 20 0 EIADHM CC(C)Sc1ccc(Cl)cc1[N-]C(=O)c1nn(C)cc1Cl ZINC000625277376 1045217294 /nfs/dbraw/zinc/21/72/94/1045217294.db2.gz PJNRBKDDXIYQTB-UHFFFAOYSA-N -1 3 344.267 4.480 20 0 EIADHM CC(C)(C)c1nc(COC(=O)c2cc(Cl)c(Cl)[n-]2)cs1 ZINC000915384660 1045309985 /nfs/dbraw/zinc/30/99/85/1045309985.db2.gz GJDMJTUEJHLKLH-UHFFFAOYSA-N -1 3 333.240 4.433 20 0 EIADHM CC[C@@H](NC(=O)c1c[n-]c2ccccc2c1=O)c1ccc(Cl)cc1 ZINC000053792803 1045355183 /nfs/dbraw/zinc/35/51/83/1045355183.db2.gz LPOMQLGGQHNWOZ-MRXNPFEDSA-N -1 3 340.810 4.063 20 0 EIADHM O=C([N-]c1ccccc1SC(F)F)c1cc2nccnc2cc1F ZINC000791474595 1045752744 /nfs/dbraw/zinc/75/27/44/1045752744.db2.gz WBWBTZPEJZZVCS-UHFFFAOYSA-N -1 3 349.337 4.336 20 0 EIADHM CC(=O)c1cc(Br)ccc1Nc1ccc([O-])c(F)c1F ZINC001212007497 1045828013 /nfs/dbraw/zinc/82/80/13/1045828013.db2.gz JBPZGCCBHOBOSL-UHFFFAOYSA-N -1 3 342.139 4.379 20 0 EIADHM COc1cc(Br)c(F)cc1Nc1ccc([O-])c(F)c1F ZINC001212010887 1045831914 /nfs/dbraw/zinc/83/19/14/1045831914.db2.gz FHTMOWPBHHDVKB-UHFFFAOYSA-N -1 3 348.118 4.324 20 0 EIADHM CN1C(=O)CC(C)(C)c2cc(Nc3ccc([O-])c(F)c3F)ccc21 ZINC001212016194 1045838993 /nfs/dbraw/zinc/83/89/93/1045838993.db2.gz CUUWGJPYCBWOON-UHFFFAOYSA-N -1 3 332.350 4.058 20 0 EIADHM O=C(NCc1ccccc1N1CCCC1)c1cc([O-])c2ccccc2c1 ZINC000792078147 1045855259 /nfs/dbraw/zinc/85/52/59/1045855259.db2.gz VZDXQIJLEAQRMA-UHFFFAOYSA-N -1 3 346.430 4.076 20 0 EIADHM O=C([O-])[C@@H]1CCN(Cc2ccc(Cl)cc2Cl)[C@@H]2CCC[C@@H]21 ZINC000629373031 1045856935 /nfs/dbraw/zinc/85/69/35/1045856935.db2.gz IWHVDFYMMOBKRM-UMVBOHGHSA-N -1 3 328.239 4.069 20 0 EIADHM CCN1CCc2ccc(NC(=O)c3cc([O-])c4ccccc4c3)cc21 ZINC000792133656 1045864423 /nfs/dbraw/zinc/86/44/23/1045864423.db2.gz MJUYIQYECDKRPR-UHFFFAOYSA-N -1 3 332.403 4.180 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N1CCC[C@@H]1c1ccc(O)cc1 ZINC000792226645 1045878437 /nfs/dbraw/zinc/87/84/37/1045878437.db2.gz UOHJIDJWGDWHET-LJQANCHMSA-N -1 3 333.387 4.228 20 0 EIADHM C[C@H](Sc1nc2ccccc2s1)C(=O)Nc1cccc([O-])c1F ZINC000153846479 1045908012 /nfs/dbraw/zinc/90/80/12/1045908012.db2.gz VMYYIJRJDUCBPE-VIFPVBQESA-N -1 3 348.424 4.260 20 0 EIADHM C[C@H]1CCN(Cc2nc(=O)c3c(-c4ccco4)csc3[n-]2)C[C@H]1C ZINC000253556520 1046059192 /nfs/dbraw/zinc/05/91/92/1046059192.db2.gz ICKFEMJZTWCHJX-NWDGAFQWSA-N -1 3 343.452 4.135 20 0 EIADHM O=C(c1ccccc1[O-])N1CCC[C@@H]1c1ccccc1C(F)(F)F ZINC000769750554 1046068529 /nfs/dbraw/zinc/06/85/29/1046068529.db2.gz DCDJLZRZNXRYMX-OAHLLOKOSA-N -1 3 335.325 4.388 20 0 EIADHM CN(C)[C@H](C/N=C/c1cc(Cl)ccc1[O-])c1ccccc1Cl ZINC000005291747 1046228799 /nfs/dbraw/zinc/22/87/99/1046228799.db2.gz SDDBBTRPAHAOMY-OVEPSTSESA-N -1 3 337.250 4.421 20 0 EIADHM CC[C@@H](C)c1cc(C(=O)Nc2ccc([O-])c(C(F)(F)F)c2)on1 ZINC000125323193 1046300772 /nfs/dbraw/zinc/30/07/72/1046300772.db2.gz JAZBTDBKJIBWAI-MRVPVSSYSA-N -1 3 328.290 4.165 20 0 EIADHM O=C(Nc1ccc(SC(F)F)cc1)c1c[n-]c2ccccc2c1=O ZINC000033021295 1046344009 /nfs/dbraw/zinc/34/40/09/1046344009.db2.gz GSTOJYFSSOMEGR-UHFFFAOYSA-N -1 3 346.358 4.095 20 0 EIADHM Cc1ccc(-c2nnc([N-]C(=O)c3cc(F)ccc3F)s2)c(C)c1 ZINC000065084039 1046378989 /nfs/dbraw/zinc/37/89/89/1046378989.db2.gz YZISFCNNLTTWRQ-UHFFFAOYSA-N -1 3 345.374 4.352 20 0 EIADHM Cc1cccc(NC2CCN(Cc3c(F)ccc([O-])c3F)CC2)c1 ZINC000508717708 1046381749 /nfs/dbraw/zinc/38/17/49/1046381749.db2.gz JADVAWWLFZXPRQ-UHFFFAOYSA-N -1 3 332.394 4.055 20 0 EIADHM O=C(c1cc(Oc2ccccc2)ccc1[O-])N1CCC(F)(F)CC1 ZINC000794293273 1046398376 /nfs/dbraw/zinc/39/83/76/1046398376.db2.gz HHYFNWDDDMQHLL-UHFFFAOYSA-N -1 3 333.334 4.056 20 0 EIADHM Cc1onc(-c2c(Cl)cccc2Cl)c1C(=O)[N-]c1ccon1 ZINC000771481360 1046411211 /nfs/dbraw/zinc/41/12/11/1046411211.db2.gz HRPDYGAIMQWSRC-UHFFFAOYSA-N -1 3 338.150 4.197 20 0 EIADHM CC(C)(NCc1cccc([O-])c1Br)c1cccs1 ZINC000459407296 1046623962 /nfs/dbraw/zinc/62/39/62/1046623962.db2.gz HGFWGPNWRLABLD-UHFFFAOYSA-N -1 3 326.259 4.241 20 0 EIADHM Cc1ccc(Br)c(OC(=O)c2cccc(Cl)c2[O-])c1 ZINC001129785513 1046730711 /nfs/dbraw/zinc/73/07/11/1046730711.db2.gz UGDORTXORYVBHX-UHFFFAOYSA-N -1 3 341.588 4.336 20 0 EIADHM CCN(Cc1cccc([O-])c1Br)[C@@H](C)c1cccnc1 ZINC000459550105 1046770025 /nfs/dbraw/zinc/77/00/25/1046770025.db2.gz HDDOUFOGNLYIGN-LBPRGKRZSA-N -1 3 335.245 4.133 20 0 EIADHM O=C(Nc1cccc([O-])c1F)c1cc(-c2ccc(Cl)cc2)on1 ZINC000128226866 1046785987 /nfs/dbraw/zinc/78/59/87/1046785987.db2.gz MFNLHCJMNHCMAW-UHFFFAOYSA-N -1 3 332.718 4.092 20 0 EIADHM Cc1nc(-c2cccs2)ccc1C(=O)Nc1cccc([O-])c1F ZINC000128251890 1046788148 /nfs/dbraw/zinc/78/81/48/1046788148.db2.gz MWZPAOHHFOHQDS-UHFFFAOYSA-N -1 3 328.368 4.216 20 0 EIADHM O=C(OCc1ccc(OCc2cccnc2)cc1)c1cc2occc2[n-]1 ZINC000786033660 1046803909 /nfs/dbraw/zinc/80/39/09/1046803909.db2.gz RHTKKRHHMPLWOJ-UHFFFAOYSA-N -1 3 348.358 4.092 20 0 EIADHM Cc1ccc(-c2nnc([C@@H](C)OC(=O)c3cc4occc4[n-]3)o2)cc1 ZINC000786030957 1046803981 /nfs/dbraw/zinc/80/39/81/1046803981.db2.gz KKILMOMYLNMMBG-LLVKDONJSA-N -1 3 337.335 4.037 20 0 EIADHM O=C(CCC1CCCCC1)[N-]OCc1nc(C(F)(F)F)cs1 ZINC000154327644 1046814789 /nfs/dbraw/zinc/81/47/89/1046814789.db2.gz PTUPEGVYVDFNTO-UHFFFAOYSA-N -1 3 336.379 4.070 20 0 EIADHM CC(C)c1noc([C@@H](C)OC(=O)c2cc3sccc3c([O-])c2)n1 ZINC000786131105 1046814591 /nfs/dbraw/zinc/81/45/91/1046814591.db2.gz LDRLLMFWBFEPQR-SECBINFHSA-N -1 3 332.381 4.031 20 0 EIADHM O=C(OCc1cc(-c2ccco2)on1)c1cc2sccc2c([O-])c1 ZINC000786130736 1046814708 /nfs/dbraw/zinc/81/47/08/1046814708.db2.gz HJHCJCKUMNGHLH-UHFFFAOYSA-N -1 3 341.344 4.212 20 0 EIADHM O=C([N-]C1(c2cccc(F)c2)CCC1)C(F)(F)c1ccc(F)cc1 ZINC001130034664 1046837989 /nfs/dbraw/zinc/83/79/89/1046837989.db2.gz RRPXUGYYQWZHQA-UHFFFAOYSA-N -1 3 337.316 4.252 20 0 EIADHM Cc1cc(=O)[n-]c(-c2cccc(OC(=O)c3csc(Cl)c3)c2)n1 ZINC000786460986 1046842382 /nfs/dbraw/zinc/84/23/82/1046842382.db2.gz LDXSJOJYKNNRLN-UHFFFAOYSA-N -1 3 346.795 4.092 20 0 EIADHM COc1ccc(CCCCCC(=O)Nc2cccc([O-])c2F)cc1 ZINC000128390158 1046848776 /nfs/dbraw/zinc/84/87/76/1046848776.db2.gz CUAVMILDQWDEKN-UHFFFAOYSA-N -1 3 331.387 4.282 20 0 EIADHM Cc1cc(C)c(C(=O)CCCC(=O)[N-]OCc2ccccc2)c(C)c1 ZINC000917365608 1046854534 /nfs/dbraw/zinc/85/45/34/1046854534.db2.gz MLUXXYMRLRFLHV-UHFFFAOYSA-N -1 3 339.435 4.213 20 0 EIADHM Cc1cc(C)nc(SCc2cc(=O)oc3c(C)c([O-])ccc23)c1 ZINC000786742444 1046862781 /nfs/dbraw/zinc/86/27/81/1046862781.db2.gz WZICSKGCYRRBGA-UHFFFAOYSA-N -1 3 327.405 4.111 20 0 EIADHM Cc1c2cccc(C)c2oc1C(=O)N=c1cc(-c2ccccc2)[n-][nH]1 ZINC000497578823 1046862753 /nfs/dbraw/zinc/86/27/53/1046862753.db2.gz OHIUPNQKKFBFEA-UHFFFAOYSA-N -1 3 331.375 4.114 20 0 EIADHM COc1cc(C(=O)Nc2cccc([O-])c2F)ccc1OCCC(C)C ZINC000128463887 1046879993 /nfs/dbraw/zinc/87/99/93/1046879993.db2.gz OKEKLXQFHFPOEI-UHFFFAOYSA-N -1 3 347.386 4.217 20 0 EIADHM Cc1nc2cc(NC(=O)CCCc3ccc([O-])c(F)c3)ccc2s1 ZINC000787251626 1046959387 /nfs/dbraw/zinc/95/93/87/1046959387.db2.gz GDXBKEKLPOWDII-UHFFFAOYSA-N -1 3 344.411 4.411 20 0 EIADHM COc1cccc(C(=O)Nc2cccc(C3SCCS3)c2)c1[O-] ZINC000787803013 1047053602 /nfs/dbraw/zinc/05/36/02/1047053602.db2.gz FQACSBPFWPSJIR-UHFFFAOYSA-N -1 3 347.461 4.132 20 0 EIADHM Cc1ccccc1OCCN(C)C(=O)c1cc2sccc2c([O-])c1 ZINC000788267005 1047150414 /nfs/dbraw/zinc/15/04/14/1047150414.db2.gz JWQJUJNEKZMJLZ-UHFFFAOYSA-N -1 3 341.432 4.066 20 0 EIADHM O=C(c1cc2sccc2c([O-])c1)N(Cc1cccs1)C1CC1 ZINC000788275513 1047153010 /nfs/dbraw/zinc/15/30/10/1047153010.db2.gz FXIGBGZZLPJGLA-UHFFFAOYSA-N -1 3 329.446 4.473 20 0 EIADHM CC1(C)Oc2ccc(NC(=O)c3cc4sccc4c([O-])c3)cc2O1 ZINC000788280886 1047156607 /nfs/dbraw/zinc/15/66/07/1047156607.db2.gz JWNZMEZNRHIUGI-UHFFFAOYSA-N -1 3 341.388 4.367 20 0 EIADHM Cc1ccc(-c2nc(CN[C@@H](C)CCC[C@@H](C)C(=O)[O-])cs2)cc1 ZINC000325635432 1047287521 /nfs/dbraw/zinc/28/75/21/1047287521.db2.gz VIZYNHFEFCHGSG-CABCVRRESA-N -1 3 346.496 4.488 20 0 EIADHM CCCN(C)Cc1nc(=O)c2sc(-c3ccc(F)cc3)cc2[n-]1 ZINC000069092832 1047327901 /nfs/dbraw/zinc/32/79/01/1047327901.db2.gz QOGQLAHGPUSYKI-UHFFFAOYSA-N -1 3 331.416 4.045 20 0 EIADHM O=C(Nc1cccc([O-])c1F)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F ZINC000129263067 1047342220 /nfs/dbraw/zinc/34/22/20/1047342220.db2.gz JXQCNCSHLSGSTR-WDEREUQCSA-N -1 3 339.288 4.292 20 0 EIADHM CC[C@H](Nc1ccccc1)C(=O)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000476143054 1047372876 /nfs/dbraw/zinc/37/28/76/1047372876.db2.gz HVANPYFKGDWQTE-AWEZNQCLSA-N -1 3 338.329 4.240 20 0 EIADHM C[C@H]1CCc2[nH]c3ccc(C(=O)Nc4cccc([O-])c4F)cc3c2C1 ZINC000129433945 1047390783 /nfs/dbraw/zinc/39/07/83/1047390783.db2.gz RWJJOIWKUJIBLB-NSHDSACASA-N -1 3 338.382 4.390 20 0 EIADHM C[C@@H](O[N-]C(=O)CCC1CCCCC1)c1noc(-c2ccccc2)n1 ZINC000789592452 1047445724 /nfs/dbraw/zinc/44/57/24/1047445724.db2.gz VCNJOJLWLKJJKT-CQSZACIVSA-N -1 3 343.427 4.206 20 0 EIADHM CCc1c(C(=O)Nc2cc(Cl)ccc2[O-])cnn1C1CCCC1 ZINC000476313064 1047466368 /nfs/dbraw/zinc/46/63/68/1047466368.db2.gz IVHGSQJCGQNRAA-UHFFFAOYSA-N -1 3 333.819 4.172 20 0 EIADHM O=C([O-])C[C@H](NCc1ccc(SC(F)F)cc1)c1cccs1 ZINC000789897168 1047488173 /nfs/dbraw/zinc/48/81/73/1047488173.db2.gz GLVBAQSVKCWSFI-LBPRGKRZSA-N -1 3 343.420 4.368 20 0 EIADHM COc1ccc(CCCC(=O)Nc2c([O-])cccc2Cl)cc1OC ZINC000897847045 1047493881 /nfs/dbraw/zinc/49/38/81/1047493881.db2.gz QROOSCCPVWYXAZ-UHFFFAOYSA-N -1 3 349.814 4.024 20 0 EIADHM Fc1ccccc1[N-]c1nnc(SCOCC(F)(F)F)s1 ZINC000808012057 1047582556 /nfs/dbraw/zinc/58/25/56/1047582556.db2.gz IZHDELSAZBGLAD-UHFFFAOYSA-N -1 3 339.339 4.049 20 0 EIADHM CCc1ccc([O-])c(C(=O)N2CCC3(CC2)c2ccccc2N=C3C)c1 ZINC000898241368 1047591483 /nfs/dbraw/zinc/59/14/83/1047591483.db2.gz BHHVOFNZYDLFQG-UHFFFAOYSA-N -1 3 348.446 4.235 20 0 EIADHM CC(=O)c1cccc(NC(=O)c2ccc(SC(F)F)cc2)c1[O-] ZINC000808188500 1047622806 /nfs/dbraw/zinc/62/28/06/1047622806.db2.gz YQRYAKJKPIREFD-UHFFFAOYSA-N -1 3 337.347 4.162 20 0 EIADHM Cc1cc(C)c(C(=O)CCCC(=O)Nc2cccc([O-])c2F)c(C)c1 ZINC000556554200 1047817212 /nfs/dbraw/zinc/81/72/12/1047817212.db2.gz CNBNYJLFDBFHNR-UHFFFAOYSA-N -1 3 343.398 4.448 20 0 EIADHM [O-]C(=NO[C@H]1CCCCO1)Nc1ccc(SC2CCCC2)cc1 ZINC000154983462 1047843416 /nfs/dbraw/zinc/84/34/16/1047843416.db2.gz JRVYAVCHHSHAIH-INIZCTEOSA-N -1 3 336.457 4.301 20 0 EIADHM O=C([N-]O[C@H]1CCCCO1)Nc1ccc(SC2CCCC2)cc1 ZINC000154983462 1047843417 /nfs/dbraw/zinc/84/34/17/1047843417.db2.gz JRVYAVCHHSHAIH-INIZCTEOSA-N -1 3 336.457 4.301 20 0 EIADHM CCc1cccc(C(=O)Nc2ccc(F)cc2OCC2CC2)c1[O-] ZINC001136855192 1047854919 /nfs/dbraw/zinc/85/49/19/1047854919.db2.gz XCPGGCJRODGOJB-UHFFFAOYSA-N -1 3 329.371 4.135 20 0 EIADHM CC(=O)c1cccc(NC(=O)c2cc3cc(F)ccc3s2)c1[O-] ZINC000556891539 1048134629 /nfs/dbraw/zinc/13/46/29/1048134629.db2.gz CJTRPEVTUKALBJ-UHFFFAOYSA-N -1 3 329.352 4.201 20 0 EIADHM Cc1oc(C(C)C)nc1C(=O)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000556935176 1048281495 /nfs/dbraw/zinc/28/14/95/1048281495.db2.gz BFMVGVPMSPOQFZ-UHFFFAOYSA-N -1 3 328.290 4.083 20 0 EIADHM C[C@H](NCc1cccc([O-])c1Cl)[C@H](O)c1c(F)cccc1Cl ZINC000815128262 1048340732 /nfs/dbraw/zinc/34/07/32/1048340732.db2.gz UIMTXNVCWIRFGH-FVMDXXJSSA-N -1 3 344.213 4.050 20 0 EIADHM C[C@@H](NCc1cccc([O-])c1Cl)[C@H](O)c1c(F)cccc1Cl ZINC000815128261 1048341319 /nfs/dbraw/zinc/34/13/19/1048341319.db2.gz UIMTXNVCWIRFGH-ABKXIKBNSA-N -1 3 344.213 4.050 20 0 EIADHM O=C([N-]C1(c2ccccc2Cl)CCC1)C(F)(F)c1nccs1 ZINC000844648029 1048454527 /nfs/dbraw/zinc/45/45/27/1048454527.db2.gz PBBIBYQYFVCRHS-UHFFFAOYSA-N -1 3 342.798 4.084 20 0 EIADHM CCCC(=O)Nc1cccc(NC(=O)c2cc(CC)ccc2[O-])c1C ZINC000132926388 1048535689 /nfs/dbraw/zinc/53/56/89/1048535689.db2.gz DORZTKYVVRMRIQ-UHFFFAOYSA-N -1 3 340.423 4.254 20 0 EIADHM O=C(Nc1cccc(Nc2ccccc2)c1)c1cc(=O)[n-]c(C2CC2)n1 ZINC001144268234 1048550027 /nfs/dbraw/zinc/55/00/27/1048550027.db2.gz QDLKMMFBIOCPDE-UHFFFAOYSA-N -1 3 346.390 4.056 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)c1sccc1-c1ccccc1 ZINC000133089037 1048596428 /nfs/dbraw/zinc/59/64/28/1048596428.db2.gz SSSQKTDWZQMFQB-UHFFFAOYSA-N -1 3 327.380 4.190 20 0 EIADHM Cc1cccc(C(=O)Nc2cccc(NC(=O)OCC(C)C)c2)c1[O-] ZINC000920224675 1048597972 /nfs/dbraw/zinc/59/79/72/1048597972.db2.gz LXUGFYJKVLMGKE-UHFFFAOYSA-N -1 3 342.395 4.157 20 0 EIADHM Cc1ccc([C@@H](C)C(=O)Nc2cc(Br)ccc2[O-])cc1 ZINC001144454520 1048689128 /nfs/dbraw/zinc/68/91/28/1048689128.db2.gz YEVUXNKTZWBLRV-LLVKDONJSA-N -1 3 334.213 4.205 20 0 EIADHM Cc1ccoc1C(=O)[N-]c1nc(Sc2ccc(C)cc2)ns1 ZINC000075178597 1048694771 /nfs/dbraw/zinc/69/47/71/1048694771.db2.gz NGZBADIXSKBCTD-UHFFFAOYSA-N -1 3 331.422 4.151 20 0 EIADHM Cc1cc(Cl)cc(Cl)c1CNC(=O)Cc1ccc([O-])c(F)c1 ZINC001144632287 1048766695 /nfs/dbraw/zinc/76/66/95/1048766695.db2.gz HRAZALFAPULSJR-UHFFFAOYSA-N -1 3 342.197 4.005 20 0 EIADHM CN(Cc1c(F)ccc([O-])c1F)C[C@H]1CCCO[C@H]1c1ccccc1 ZINC000816499315 1048819665 /nfs/dbraw/zinc/81/96/65/1048819665.db2.gz LHIREFRZRGKKQA-QRWLVFNGSA-N -1 3 347.405 4.270 20 0 EIADHM [O-]c1ccc(F)c(CNc2ccc(OCC(F)(F)F)cc2)c1F ZINC000816522710 1048829308 /nfs/dbraw/zinc/82/93/08/1048829308.db2.gz KTUXNBKDDMTAOK-UHFFFAOYSA-N -1 3 333.256 4.224 20 0 EIADHM O=C(OCc1ccc2c(c1)COC2)c1cc2cc(Cl)sc2[n-]1 ZINC000810630116 1048835816 /nfs/dbraw/zinc/83/58/16/1048835816.db2.gz DIMMULJNHJKWIG-UHFFFAOYSA-N -1 3 333.796 4.270 20 0 EIADHM Nc1c(Cl)cc(C(=O)Nc2c([O-])cccc2Cl)cc1Cl ZINC000816769010 1048857117 /nfs/dbraw/zinc/85/71/17/1048857117.db2.gz QMESVFFGBQXGJL-UHFFFAOYSA-N -1 3 331.586 4.187 20 0 EIADHM O=C([N-]c1nc2ccccc2s1)c1snc(Cl)c1Cl ZINC000816832190 1048864849 /nfs/dbraw/zinc/86/48/49/1048864849.db2.gz SDAAHZBUFXPBCW-UHFFFAOYSA-N -1 3 330.221 4.312 20 0 EIADHM Cc1ccc(C(=O)Nc2cccc(Oc3ccncc3)c2)c([O-])c1C ZINC001144985929 1048948001 /nfs/dbraw/zinc/94/80/01/1048948001.db2.gz PWHQWWHZHQTZKW-UHFFFAOYSA-N -1 3 334.375 4.449 20 0 EIADHM CC(C)CCn1nccc1NC(=O)c1cc2sccc2c([O-])c1 ZINC001136002283 1049039320 /nfs/dbraw/zinc/03/93/20/1049039320.db2.gz XRUXONQSWPVEFZ-UHFFFAOYSA-N -1 3 329.425 4.102 20 0 EIADHM CC[C@@H](C)Sc1ccc(NC(=O)c2ccc(N)cc2[O-])c(C)c1 ZINC000817929287 1049053098 /nfs/dbraw/zinc/05/30/98/1049053098.db2.gz MJCFSMOZBOVGJR-GFCCVEGCSA-N -1 3 330.453 4.426 20 0 EIADHM CCCN(C(=O)c1ccc(N)cc1[O-])[C@@H](C)c1cc2ccccc2o1 ZINC000817926575 1049061854 /nfs/dbraw/zinc/06/18/54/1049061854.db2.gz NIQSOTGJYXSGMN-ZDUSSCGKSA-N -1 3 338.407 4.334 20 0 EIADHM O=C(Cc1cccc2ccccc21)[N-]OCC[C@H]1CC1(Cl)Cl ZINC000818078397 1049087201 /nfs/dbraw/zinc/08/72/01/1049087201.db2.gz KINDNVBKWVALOF-AWEZNQCLSA-N -1 3 338.234 4.014 20 0 EIADHM O=C(Cc1ccc(OCc2ccccc2)cc1)[N-]OCc1ccccc1 ZINC001136106618 1049092667 /nfs/dbraw/zinc/09/26/67/1049092667.db2.gz PMCHVNYZNSOFSL-UHFFFAOYSA-N -1 3 347.414 4.056 20 0 EIADHM Cc1cccc([C@H](C)CNC(=O)c2cc3sccc3c([O-])c2)c1 ZINC001147573278 1049184475 /nfs/dbraw/zinc/18/44/75/1049184475.db2.gz VSKNSLKAOTWAMA-CYBMUJFWSA-N -1 3 325.433 4.449 20 0 EIADHM O=C(Nc1ccc([C@H]2CCOC2)cc1)c1cc2sccc2c([O-])c1 ZINC000818747129 1049201506 /nfs/dbraw/zinc/20/15/06/1049201506.db2.gz ZOGLAEVGPCHBSQ-ZDUSSCGKSA-N -1 3 339.416 4.363 20 0 EIADHM CCCCN(C(=O)c1nnc2ccccc2c1[O-])[C@@H]1CCC[C@H](C)C1 ZINC000818801929 1049206741 /nfs/dbraw/zinc/20/67/41/1049206741.db2.gz HTNHMYVTZMREEK-LSDHHAIUSA-N -1 3 341.455 4.156 20 0 EIADHM CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)c1ccc(C)cc1[O-] ZINC001136176939 1049229756 /nfs/dbraw/zinc/22/97/56/1049229756.db2.gz RMVCMGDRPBLCQZ-UHFFFAOYSA-N -1 3 337.341 4.382 20 0 EIADHM Cc1ccc(C(=O)Nc2cc3[nH]ccc3cc2Br)c([O-])c1 ZINC001148500799 1049328371 /nfs/dbraw/zinc/32/83/71/1049328371.db2.gz WDOJJYMRABGHPC-UHFFFAOYSA-N -1 3 345.196 4.197 20 0 EIADHM CCc1ccc(C(C)(C)CNC(=O)c2cc(SC)ccc2[O-])cc1 ZINC001148792906 1049380416 /nfs/dbraw/zinc/38/04/16/1049380416.db2.gz IGNQXRJSUKQQKV-UHFFFAOYSA-N -1 3 343.492 4.384 20 0 EIADHM Cc1cccc([O-])c1C(=O)Nc1ncc(Cc2ccc(F)cc2)s1 ZINC001136303041 1049430601 /nfs/dbraw/zinc/43/06/01/1049430601.db2.gz HEDBWFQXWLGEAD-UHFFFAOYSA-N -1 3 342.395 4.139 20 0 EIADHM CC(C)(C)c1ccccc1S(=O)(=O)[N-]c1c(O)cccc1Cl ZINC000821111302 1049599720 /nfs/dbraw/zinc/59/97/20/1049599720.db2.gz HDZYARZZFKWMDZ-UHFFFAOYSA-N -1 3 339.844 4.144 20 0 EIADHM CCc1ccc([O-])c(C(=O)N(Cc2ccccc2F)CC(C)C)c1 ZINC001136449437 1049635563 /nfs/dbraw/zinc/63/55/63/1049635563.db2.gz IABQPAAASUCKNR-UHFFFAOYSA-N -1 3 329.415 4.392 20 0 EIADHM CCC[C@@H]1CCCC[C@@H]1NC(=O)c1c[n-]c2c(Cl)cccc2c1=O ZINC001136622269 1049790637 /nfs/dbraw/zinc/79/06/37/1049790637.db2.gz CZRCAHFKBOIZHY-WBMJQRKESA-N -1 3 346.858 4.270 20 0 EIADHM O=C(c1cc(CCc2ccccc2)ccc1[O-])N1Cc2ccccc2C1 ZINC001136633874 1049801133 /nfs/dbraw/zinc/80/11/33/1049801133.db2.gz FQDYWVBMGUDZAB-UHFFFAOYSA-N -1 3 343.426 4.333 20 0 EIADHM CSc1cc(C)c(C(=O)[N-]c2nnc(C3CCCCC3)s2)o1 ZINC000823120238 1049825599 /nfs/dbraw/zinc/82/55/99/1049825599.db2.gz JBKVGPKIHOWHMG-UHFFFAOYSA-N -1 3 337.470 4.461 20 0 EIADHM COc1ccc([O-])c(C(=O)Nc2ccc(N3CCCCCC3)cc2)c1 ZINC000823390097 1049843439 /nfs/dbraw/zinc/84/34/39/1049843439.db2.gz DMIUFVZSBOXNQY-UHFFFAOYSA-N -1 3 340.423 4.034 20 0 EIADHM CC(C)(CNC(=O)c1cc([O-])c2ccccc2c1)c1cccc(F)c1 ZINC001136750892 1049863567 /nfs/dbraw/zinc/86/35/67/1049863567.db2.gz MMOZJFHGRNCMPN-UHFFFAOYSA-N -1 3 337.394 4.392 20 0 EIADHM CCc1nc([N-]C(=O)c2ncoc2C(F)(F)F)sc1C(C)(C)C ZINC000616243491 1049867368 /nfs/dbraw/zinc/86/73/68/1049867368.db2.gz VFIIKTPAMUMEQN-UHFFFAOYSA-N -1 3 347.362 4.262 20 0 EIADHM CCCc1ncc(C(=O)[N-]c2c3nsnc3ccc2Cl)s1 ZINC000181257754 1050071617 /nfs/dbraw/zinc/07/16/17/1050071617.db2.gz MQHYEHBSQXXBJB-UHFFFAOYSA-N -1 3 338.845 4.006 20 0 EIADHM C[C@H](NC(=O)Nc1cc(Br)ccc1[O-])C1CCCCC1 ZINC001186389114 1050307736 /nfs/dbraw/zinc/30/77/36/1050307736.db2.gz KLHVOVCMLRUWQQ-JTQLQIEISA-N -1 3 341.249 4.245 20 0 EIADHM CSc1ccccc1NC(=O)[N-]c1cc(-c2ccccn2)no1 ZINC001186716448 1050395038 /nfs/dbraw/zinc/39/50/38/1050395038.db2.gz BVFMGJXCTJIMTQ-UHFFFAOYSA-N -1 3 326.381 4.103 20 0 EIADHM CCc1ccc(-c2ccc(-c3noc(-c4cnc[n-]c4=O)n3)cc2)cc1 ZINC001212754916 1050554384 /nfs/dbraw/zinc/55/43/84/1050554384.db2.gz VHZAOHIVCYAOPV-UHFFFAOYSA-N -1 3 344.374 4.129 20 0 EIADHM COc1cc(C(=O)Nc2cc([O-])cc(Cl)c2)ccc1OC(C)C ZINC001187570459 1050575957 /nfs/dbraw/zinc/57/59/57/1050575957.db2.gz XXAGRWFFCDDXAU-UHFFFAOYSA-N -1 3 335.787 4.094 20 0 EIADHM COc1ccc(Nc2cc(Br)cc(F)c2[O-])c(OC)c1 ZINC001173891547 1050607088 /nfs/dbraw/zinc/60/70/88/1050607088.db2.gz ANZVLWRCEKVUJG-UHFFFAOYSA-N -1 3 342.164 4.055 20 0 EIADHM CC(C)n1cc(C(=O)Nc2ccc(F)c([O-])c2)c(C(F)(F)F)c1 ZINC001187781937 1050630743 /nfs/dbraw/zinc/63/07/43/1050630743.db2.gz CYAZOJVMAPVWRE-UHFFFAOYSA-N -1 3 330.281 4.185 20 0 EIADHM O=C(c1cc2sccc2c([O-])c1)N1COCC[C@H]1c1ccccc1 ZINC001179188821 1050654057 /nfs/dbraw/zinc/65/40/57/1050654057.db2.gz YKZNRASXXAUPQL-INIZCTEOSA-N -1 3 339.416 4.168 20 0 EIADHM CC(C)NC(=O)c1ccc(Nc2cccc([O-])c2Br)cc1 ZINC001174149727 1050789011 /nfs/dbraw/zinc/78/90/11/1050789011.db2.gz CVKPJCXQCSSTCA-UHFFFAOYSA-N -1 3 349.228 4.037 20 0 EIADHM CC(C)(C)c1nc([N-]c2ccc(C(=O)Nc3ccccc3)cc2)no1 ZINC001174160677 1050801304 /nfs/dbraw/zinc/80/13/04/1050801304.db2.gz ZGZVDEKZGLWLAP-UHFFFAOYSA-N -1 3 336.395 4.363 20 0 EIADHM CC(C)P(CCNC(=O)c1ccc([O-])c(C(F)(F)F)c1)C(C)C ZINC001188598387 1050801340 /nfs/dbraw/zinc/80/13/40/1050801340.db2.gz BXDBPOQQCPCOBB-UHFFFAOYSA-N -1 3 349.333 4.440 20 0 EIADHM Cc1ccc(Nc2cccc(C(=O)N3CCCC3)c2)c(Cl)c1[O-] ZINC001174171010 1050813801 /nfs/dbraw/zinc/81/38/01/1050813801.db2.gz HUTHVTGTAZOARM-UHFFFAOYSA-N -1 3 330.815 4.334 20 0 EIADHM O=C(NC1CCCC1)c1cccc(Nc2ccc([O-])c(Cl)c2)c1 ZINC001174198928 1050834918 /nfs/dbraw/zinc/83/49/18/1050834918.db2.gz NNPLBBGSNXJIQV-UHFFFAOYSA-N -1 3 330.815 4.462 20 0 EIADHM Cc1ccc(Nc2ccc(OCC(F)(F)F)nc2)c(Cl)c1[O-] ZINC001203689073 1050838055 /nfs/dbraw/zinc/83/80/55/1050838055.db2.gz LWTNAMSZJUGUJL-UHFFFAOYSA-N -1 3 332.709 4.434 20 0 EIADHM O=C(c1ccccc1)c1ccc(Nc2cc(=O)[n-]c(C3CC3)n2)cc1 ZINC001174222213 1050851204 /nfs/dbraw/zinc/85/12/04/1050851204.db2.gz JSOMDVUNOZNRRJ-UHFFFAOYSA-N -1 3 331.375 4.034 20 0 EIADHM O=C(Nc1cc(Cl)ccc1Cl)Nc1ncc([O-])cc1Cl ZINC001188972464 1050876404 /nfs/dbraw/zinc/87/64/04/1050876404.db2.gz HMFWFUPWXFPDIN-UHFFFAOYSA-N -1 3 332.574 4.391 20 0 EIADHM C[C@H]1c2cc(F)cc(F)c2CCN1Cc1c(F)ccc([O-])c1F ZINC001180111445 1050889302 /nfs/dbraw/zinc/88/93/02/1050889302.db2.gz BGXSUQHVIAVYQA-VIFPVBQESA-N -1 3 325.305 4.068 20 0 EIADHM Cc1c(F)cccc1NC(=O)Nc1ccc(Br)cc1[O-] ZINC001189052026 1050894131 /nfs/dbraw/zinc/89/41/31/1050894131.db2.gz URFMKUVDODXOGR-UHFFFAOYSA-N -1 3 339.164 4.246 20 0 EIADHM C[C@@H]1CC[C@@H]([N-]S(=O)(=O)c2cc(Cl)ccc2Cl)C[C@H]1C ZINC001189050157 1050894953 /nfs/dbraw/zinc/89/49/53/1050894953.db2.gz ZTBHBUVRZHTHAX-CKYFFXLPSA-N -1 3 336.284 4.096 20 0 EIADHM CC(C)(C)Cc1cc([N-]C(=O)c2cc(-c3cccs3)on2)on1 ZINC001189182816 1050920034 /nfs/dbraw/zinc/92/00/34/1050920034.db2.gz COOKQWGWKJFSPI-UHFFFAOYSA-N -1 3 331.397 4.232 20 0 EIADHM O=C(c1ccc([O-])cc1)C1CCN(C/C=C\c2cccc(F)c2)CC1 ZINC001180249758 1050934952 /nfs/dbraw/zinc/93/49/52/1050934952.db2.gz ZHCJQIYARGHAIU-RQOWECAXSA-N -1 3 339.410 4.139 20 0 EIADHM CC(C)(C)[C@H]1CCC[C@H]([N-]S(=O)(=O)c2cccnc2Cl)CC1 ZINC001189288359 1050945652 /nfs/dbraw/zinc/94/56/52/1050945652.db2.gz IODGUOONOFGXHP-STQMWFEESA-N -1 3 344.908 4.008 20 0 EIADHM COc1ccc(Cn2cc(Nc3ccc(C)c([O-])c3Cl)cn2)cc1 ZINC001174437343 1050965847 /nfs/dbraw/zinc/96/58/47/1050965847.db2.gz KCWOBLLUFLPDII-UHFFFAOYSA-N -1 3 343.814 4.351 20 0 EIADHM CCOC(=O)c1nc(C)oc1[N-]C(=O)Nc1ccccc1C(C)(C)C ZINC001189563882 1051011885 /nfs/dbraw/zinc/01/18/85/1051011885.db2.gz UQJWOLZBFXZEPU-UHFFFAOYSA-N -1 3 345.399 4.101 20 0 EIADHM Cn1ncc2c1nc(SCC1CCC(C(C)(C)C)CC1)[n-]c2=O ZINC001189737769 1051055643 /nfs/dbraw/zinc/05/56/43/1051055643.db2.gz LWHTWRSDLZKZBH-UHFFFAOYSA-N -1 3 334.489 4.014 20 0 EIADHM O=C(Nc1ccc2c(c1)N=NC2)c1cccc(OC(F)(F)F)c1[O-] ZINC001189766844 1051056683 /nfs/dbraw/zinc/05/66/83/1051056683.db2.gz UTMBDLFNYCMPJJ-UHFFFAOYSA-N -1 3 337.257 4.140 20 0 EIADHM Cc1cccnc1[C@H](C)NC(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC001180703221 1051068813 /nfs/dbraw/zinc/06/88/13/1051068813.db2.gz UDNDFQIWRHICPB-INIZCTEOSA-N -1 3 346.430 4.177 20 0 EIADHM O=C([N-]CCCSc1ccc2c3c(cccc31)CC2)C(F)(F)F ZINC001189977052 1051084229 /nfs/dbraw/zinc/08/42/29/1051084229.db2.gz FVCAXIVKCJYIOS-UHFFFAOYSA-N -1 3 339.382 4.099 20 0 EIADHM Cc1ccc(CSc2nc(NC(=O)C3CCCCCC3)n[n-]2)cc1 ZINC001180832160 1051085956 /nfs/dbraw/zinc/08/59/56/1051085956.db2.gz CHJRBKUPCCSJIB-UHFFFAOYSA-N -1 3 344.484 4.314 20 0 EIADHM O=C(Nc1cc(F)c(F)c(F)c1F)c1cc2c(cc1[O-])CCCC2 ZINC001174631538 1051093997 /nfs/dbraw/zinc/09/39/97/1051093997.db2.gz JDSYQXGAJGIWTP-UHFFFAOYSA-N -1 3 339.288 4.080 20 0 EIADHM O=C(NCc1ccc(Cl)cc1Cl)Nc1ncc([O-])cc1Cl ZINC001190074496 1051117324 /nfs/dbraw/zinc/11/73/24/1051117324.db2.gz MRVOGSPPATVQLV-UHFFFAOYSA-N -1 3 346.601 4.069 20 0 EIADHM Cc1noc(-c2ccccc2)c1NC(=O)Nc1ccc([O-])c(F)c1 ZINC001190364024 1051153203 /nfs/dbraw/zinc/15/32/03/1051153203.db2.gz FAYAGGZJUVPTBE-UHFFFAOYSA-N -1 3 327.315 4.139 20 0 EIADHM Cc1cccc(C(=O)Nc2ccc(C)c(C(=O)c3ccccc3)c2)c1[O-] ZINC001174772296 1051166259 /nfs/dbraw/zinc/16/62/59/1051166259.db2.gz KUPDVDYZMKKSJA-UHFFFAOYSA-N -1 3 345.398 4.492 20 0 EIADHM CC(C)Oc1ccc([N-]S(=O)(=O)c2ccc(C3CC3)cc2)cc1 ZINC001190464811 1051191460 /nfs/dbraw/zinc/19/14/60/1051191460.db2.gz WAIVSMRRGHQMRV-UHFFFAOYSA-N -1 3 331.437 4.152 20 0 EIADHM CN(C[C@H]1CCc2ccccc21)C(=O)CCCc1ccc([O-])c(F)c1 ZINC000620688093 1051213555 /nfs/dbraw/zinc/21/35/55/1051213555.db2.gz WIKFQTXBHHXLIC-QGZVFWFLSA-N -1 3 341.426 4.042 20 0 EIADHM CC(=O)[C@@H](C)CCCCC(=O)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000153705360 1051217784 /nfs/dbraw/zinc/21/77/84/1051217784.db2.gz CDVPXTNFHDEQNQ-JTQLQIEISA-N -1 3 331.334 4.135 20 0 EIADHM O=C(Nc1ccc(Cl)cc1[O-])c1c[nH]cc1-c1ccc(F)cc1 ZINC000153711790 1051218808 /nfs/dbraw/zinc/21/88/08/1051218808.db2.gz KFCJAVAMLLCNBV-UHFFFAOYSA-N -1 3 330.746 4.432 20 0 EIADHM O=c1ccoc2ccc(Nc3ccc([O-])c(Br)c3)cc12 ZINC001174944857 1051264427 /nfs/dbraw/zinc/26/44/27/1051264427.db2.gz AHOSZOSTMFJURD-UHFFFAOYSA-N -1 3 332.153 4.005 20 0 EIADHM CCOc1cc(CN2CCOc3ccc(C)cc3C2)cc(Cl)c1[O-] ZINC001181673531 1051276910 /nfs/dbraw/zinc/27/69/10/1051276910.db2.gz LMUDEYBXUGKGHI-UHFFFAOYSA-N -1 3 347.842 4.147 20 0 EIADHM COc1ccc(Br)cc1Nc1c(F)cc([O-])cc1F ZINC001175099903 1051347221 /nfs/dbraw/zinc/34/72/21/1051347221.db2.gz GEGPTKCUKFOEBH-UHFFFAOYSA-N -1 3 330.128 4.185 20 0 EIADHM CCSCCc1cccc([N-]S(=O)(=O)c2ccc(C)cc2)c1 ZINC001250021599 1051324271 /nfs/dbraw/zinc/32/42/71/1051324271.db2.gz HDEJELKSXZUKES-UHFFFAOYSA-N -1 3 335.494 4.091 20 0 EIADHM CC(=O)c1cccc([O-])c1NC(=O)CCCc1ccc(Cl)cc1 ZINC001181875636 1051336345 /nfs/dbraw/zinc/33/63/45/1051336345.db2.gz JLUQJTADRVQZGS-UHFFFAOYSA-N -1 3 331.799 4.210 20 0 EIADHM [O-]c1cc(F)c(Nc2c(F)cc(F)cc2Br)c(F)c1 ZINC001175099635 1051345956 /nfs/dbraw/zinc/34/59/56/1051345956.db2.gz ASZKNQAHKFUFRX-UHFFFAOYSA-N -1 3 336.082 4.455 20 0 EIADHM COc1cc(Nc2c(F)cc([O-])cc2F)c(Br)cc1C ZINC001175099958 1051347481 /nfs/dbraw/zinc/34/74/81/1051347481.db2.gz JFUSBWZVUDIJEB-UHFFFAOYSA-N -1 3 344.155 4.494 20 0 EIADHM [O-]c1cc(F)c(Nc2cccc([C@@H]3CN4C=CSC4=N3)c2)c(F)c1 ZINC001175100167 1051347856 /nfs/dbraw/zinc/34/78/56/1051347856.db2.gz XNANMEZAPFXBLS-HNNXBMFYSA-N -1 3 345.374 4.345 20 0 EIADHM CCOC(=O)Cc1ccc(Cl)c(Nc2c(F)cc([O-])cc2F)c1 ZINC001175102334 1051350218 /nfs/dbraw/zinc/35/02/18/1051350218.db2.gz JCBUKSHIDBJUKF-UHFFFAOYSA-N -1 3 341.741 4.173 20 0 EIADHM O=c1cc(Nc2ccc(F)c(C(F)(F)F)c2)[n-]n1-c1ccccc1 ZINC001175075117 1051364042 /nfs/dbraw/zinc/36/40/42/1051364042.db2.gz OAYDLSPUMWWAPM-UHFFFAOYSA-N -1 3 337.276 4.479 20 0 EIADHM CCOc1ccc(F)cc1Nc1cccc([O-])c1Br ZINC001175082936 1051371317 /nfs/dbraw/zinc/37/13/17/1051371317.db2.gz BUMFVACJINVFNF-UHFFFAOYSA-N -1 3 326.165 4.436 20 0 EIADHM [O-]c1c(F)cc(Br)cc1Nc1cc(F)c(F)cc1F ZINC001175092199 1051376162 /nfs/dbraw/zinc/37/61/62/1051376162.db2.gz XCHCDZCLUGSIKX-UHFFFAOYSA-N -1 3 336.082 4.455 20 0 EIADHM Cc1cc(N)c(Nc2c(F)cc([O-])cc2F)cc1Br ZINC001175097058 1051380382 /nfs/dbraw/zinc/38/03/82/1051380382.db2.gz MRLXIDUVFNCMRH-UHFFFAOYSA-N -1 3 329.144 4.067 20 0 EIADHM O=C([N-]c1cc(-c2ccc(C(F)(F)F)cc2)no1)Nc1ccccn1 ZINC001191303220 1051420792 /nfs/dbraw/zinc/42/07/92/1051420792.db2.gz UBEUBIYKKWBRQU-UHFFFAOYSA-N -1 3 348.284 4.399 20 0 EIADHM O=c1nc(-c2cnc(C3CCC3)s2)[n-]c2sc3c(c21)CCCC3 ZINC000155583206 1051433970 /nfs/dbraw/zinc/43/39/70/1051433970.db2.gz LBJBDMGQLZVWLA-UHFFFAOYSA-N -1 3 343.477 4.254 20 0 EIADHM O=C(Nc1cc([O-])cc(Cl)c1)c1ccc(OCC(F)(F)F)cc1 ZINC001191404695 1051440487 /nfs/dbraw/zinc/44/04/87/1051440487.db2.gz DVZODFCJOBLVKQ-UHFFFAOYSA-N -1 3 345.704 4.239 20 0 EIADHM O=C(Nc1ccc([O-])c(F)c1)Nc1cc(F)cc(C(F)(F)F)c1 ZINC001191589100 1051484640 /nfs/dbraw/zinc/48/46/40/1051484640.db2.gz KUVMJUVHWPKVOA-UHFFFAOYSA-N -1 3 332.228 4.333 20 0 EIADHM Cc1nc(NC(=O)Nc2c(C(C)C)cccc2C(C)C)cc(=O)[n-]1 ZINC001191616558 1051492019 /nfs/dbraw/zinc/49/20/19/1051492019.db2.gz VELWNUNTMKRIDB-UHFFFAOYSA-N -1 3 328.416 4.381 20 0 EIADHM O=C(Nc1cccnc1)c1cccc(Nc2c(F)ccc([O-])c2F)c1 ZINC001175268492 1051503878 /nfs/dbraw/zinc/50/38/78/1051503878.db2.gz QOSKGRAAZZPXRE-UHFFFAOYSA-N -1 3 341.317 4.061 20 0 EIADHM [O-]c1ccc(F)c(Nc2ccc(N3CCSCC3)c(F)c2)c1F ZINC001175270006 1051506735 /nfs/dbraw/zinc/50/67/35/1051506735.db2.gz RDGQGGGEZYUDBE-UHFFFAOYSA-N -1 3 340.370 4.106 20 0 EIADHM [O-]c1ccc(F)c(Nc2ccccc2-c2nc(CO)cs2)c1F ZINC001175271567 1051510378 /nfs/dbraw/zinc/51/03/78/1051510378.db2.gz VPEUCRLTDPJPNC-UHFFFAOYSA-N -1 3 334.347 4.030 20 0 EIADHM CC(=O)c1c(C)[nH]c(C(=O)Nc2cc(Cl)ccc2[O-])c1C(C)C ZINC000156339846 1051521306 /nfs/dbraw/zinc/52/13/06/1051521306.db2.gz ZSDSMPYSYFKNJK-UHFFFAOYSA-N -1 3 334.803 4.260 20 0 EIADHM O=C(Nc1ccc(F)c([O-])c1)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F ZINC001182363100 1051524950 /nfs/dbraw/zinc/52/49/50/1051524950.db2.gz LKQPRKZMBFBFJY-NWDGAFQWSA-N -1 3 339.288 4.292 20 0 EIADHM Clc1ccc(-c2ccccc2Nc2ccc(-c3nn[n-]n3)cc2)nc1 ZINC001175432261 1051588625 /nfs/dbraw/zinc/58/86/25/1051588625.db2.gz XNYRYJLGDNFMSV-UHFFFAOYSA-N -1 3 348.797 4.326 20 0 EIADHM Cc1c2ccccc2oc1[C@@H](C)NC(=O)NCc1ccc([O-])c(F)c1 ZINC000157106107 1051598272 /nfs/dbraw/zinc/59/82/72/1051598272.db2.gz GDJFTKAHZVHNCS-GFCCVEGCSA-N -1 3 342.370 4.146 20 0 EIADHM C[C@H]1CN(CCSc2cc(Cl)ccc2Cl)CC[C@H]1C(=O)[O-] ZINC000385874440 1051608522 /nfs/dbraw/zinc/60/85/22/1051608522.db2.gz OBXASROZKKMASS-CMPLNLGQSA-N -1 3 348.295 4.128 20 0 EIADHM COc1cccc(-c2noc([N-]Cc3cc(-c4ccccc4)no3)n2)c1 ZINC000774516591 1051641248 /nfs/dbraw/zinc/64/12/48/1051641248.db2.gz UKXQDCDRBKKGEL-UHFFFAOYSA-N -1 3 348.362 4.012 20 0 EIADHM Cc1cccnc1[C@@H](NC(=O)c1ccc(C(C)(C)C)cc1[O-])C1CC1 ZINC001192336096 1051694599 /nfs/dbraw/zinc/69/45/99/1051694599.db2.gz RNLGNKDNKLOFAW-IBGZPJMESA-N -1 3 338.451 4.274 20 0 EIADHM CC(C)CC1(NC(=O)c2ccc(C(C)(C)C)cc2[O-])CCOCC1 ZINC001192339596 1051695133 /nfs/dbraw/zinc/69/51/33/1051695133.db2.gz HCLZLOVYXFTJEL-UHFFFAOYSA-N -1 3 333.472 4.015 20 0 EIADHM Cc1ccc2nc([N-]C(=O)c3nc(C(F)(F)F)cs3)sc2c1 ZINC001192447100 1051735925 /nfs/dbraw/zinc/73/59/25/1051735925.db2.gz KWTRSGRCSGGDPM-UHFFFAOYSA-N -1 3 343.355 4.332 20 0 EIADHM O=C([N-]c1ccnc(Cl)c1Cl)c1nc(C(F)(F)F)cs1 ZINC001192446836 1051736278 /nfs/dbraw/zinc/73/62/78/1051736278.db2.gz JBHPZMAAOFIRCW-UHFFFAOYSA-N -1 3 342.129 4.116 20 0 EIADHM COC(=O)c1ccc(NC(=O)Nc2ccc3sccc3c2)c([O-])c1 ZINC001192448960 1051737224 /nfs/dbraw/zinc/73/72/24/1051737224.db2.gz RNWCKCOYOUYDNU-UHFFFAOYSA-N -1 3 342.376 4.038 20 0 EIADHM COc1cc(F)c(C(C)C)cc1Nc1cccc(C(=O)N(C)C)c1[O-] ZINC001175833715 1051796417 /nfs/dbraw/zinc/79/64/17/1051796417.db2.gz VVUHXTBYRHWRJP-UHFFFAOYSA-N -1 3 346.402 4.109 20 0 EIADHM C/C=C\C[C@H]1CCCN(C(=O)c2ccc(OCCCC)cc2[O-])C1 ZINC001184099590 1051948370 /nfs/dbraw/zinc/94/83/70/1051948370.db2.gz YIUJJIBYHWMGIJ-IMMZDGJCSA-N -1 3 331.456 4.390 20 0 EIADHM O=C(Nc1ccc(C2CCC2)nc1)c1ccc([O-])cc1C(F)(F)F ZINC001193736198 1051978216 /nfs/dbraw/zinc/97/82/16/1051978216.db2.gz XXJXADQSBQJKKO-UHFFFAOYSA-N -1 3 336.313 4.326 20 0 EIADHM Cc1ccc(CN(C)C(=O)c2cc([O-])cc(C(F)(F)F)c2)s1 ZINC000621853723 1051980718 /nfs/dbraw/zinc/98/07/18/1051980718.db2.gz UPZMFKYXIVBNDV-UHFFFAOYSA-N -1 3 329.343 4.053 20 0 EIADHM Cc1ccc(CN(C)C(=O)c2ccc([O-])cc2C(F)(F)F)cc1C ZINC001193745653 1051991914 /nfs/dbraw/zinc/99/19/14/1051991914.db2.gz LADSZISTOISQPT-UHFFFAOYSA-N -1 3 337.341 4.300 20 0 EIADHM Cc1ccc([N-]S(=O)(=O)c2ccc(C)c3ccccc32)c(Cl)n1 ZINC001193834280 1052009759 /nfs/dbraw/zinc/00/97/59/1052009759.db2.gz XRGZXXFPVCMSPI-UHFFFAOYSA-N -1 3 346.839 4.306 20 0 EIADHM Cc1ccc([C@@H]2CCCCN2C(=O)c2c(C)cc(O)cc2[O-])cc1C ZINC001193929779 1052021166 /nfs/dbraw/zinc/02/11/66/1052021166.db2.gz LEGUSGRWRHZHMH-SFHVURJKSA-N -1 3 339.435 4.390 20 0 EIADHM Cc1c(NC(=O)c2c(C)cc(O)cc2[O-])snc1-c1ccccc1 ZINC001193923202 1052029527 /nfs/dbraw/zinc/02/95/27/1052029527.db2.gz ZRYYBZJDSRBQBH-UHFFFAOYSA-N -1 3 340.404 4.090 20 0 EIADHM CCc1nc(C)cc(Sc2nnc([N-]c3ccccc3F)s2)n1 ZINC001184571643 1052045652 /nfs/dbraw/zinc/04/56/52/1052045652.db2.gz CMMUBSNJTQKTFP-UHFFFAOYSA-N -1 3 347.444 4.233 20 0 EIADHM O=C([O-])C[C@H](NCc1ccccc1OC1CCCC1)c1cccs1 ZINC000671162140 1052075045 /nfs/dbraw/zinc/07/50/45/1052075045.db2.gz MLGIIBLTIIYBQK-INIZCTEOSA-N -1 3 345.464 4.375 20 0 EIADHM CC[C@@H](CNC(=O)c1cc([O-])cc(C(F)(F)F)c1)CC(F)(F)F ZINC000622103878 1052111056 /nfs/dbraw/zinc/11/10/56/1052111056.db2.gz HGSYYIZHOLANCH-MRVPVSSYSA-N -1 3 343.267 4.119 20 0 EIADHM [O-]c1c(F)cc(F)c(Nc2ccncc2Oc2ccccc2)c1F ZINC001176663050 1052173054 /nfs/dbraw/zinc/17/30/54/1052173054.db2.gz ANIHTZIMXARJEP-UHFFFAOYSA-N -1 3 332.281 4.162 20 0 EIADHM CCOc1ccc([N-]S(=O)(=O)c2c(C)cccc2C)cc1Cl ZINC001194637605 1052182217 /nfs/dbraw/zinc/18/22/17/1052182217.db2.gz CGDLTLULAVNHRL-UHFFFAOYSA-N -1 3 339.844 4.156 20 0 EIADHM CCc1ccc(C(=O)N(C)Cc2ccccc2C(F)(F)F)c([O-])c1 ZINC000622292624 1052186361 /nfs/dbraw/zinc/18/63/61/1052186361.db2.gz CSVONDDDSLFSKV-UHFFFAOYSA-N -1 3 337.341 4.246 20 0 EIADHM CC(C)c1ccc(C(=O)N2CCc3cc(F)ccc3[C@H]2C)c([O-])c1 ZINC001176981735 1052213790 /nfs/dbraw/zinc/21/37/90/1052213790.db2.gz VYIPXWGOHLJLNB-CYBMUJFWSA-N -1 3 327.399 4.414 20 0 EIADHM O=C(CCC(=O)c1cc(Cl)sc1Cl)[N-]OC1CCCC1 ZINC000774867960 1052230571 /nfs/dbraw/zinc/23/05/71/1052230571.db2.gz SERGWKSYTLKVAN-UHFFFAOYSA-N -1 3 336.240 4.008 20 0 EIADHM CCCN(CCc1cccc(F)c1)C(=O)c1ccc(CC)cc1[O-] ZINC000622371159 1052234315 /nfs/dbraw/zinc/23/43/15/1052234315.db2.gz CWBNVNFQUPJLJQ-UHFFFAOYSA-N -1 3 329.415 4.189 20 0 EIADHM C[C@@H](N[C@H](C)c1cc(Br)cc(F)c1[O-])c1ccccn1 ZINC000184845788 1052254744 /nfs/dbraw/zinc/25/47/44/1052254744.db2.gz DKBZYETYGAZOHL-NXEZZACHSA-N -1 3 339.208 4.101 20 0 EIADHM O=C(c1cc([O-])cc(C(F)(F)F)c1)N(CC1CC1)c1ccccc1 ZINC000622421185 1052257659 /nfs/dbraw/zinc/25/76/59/1052257659.db2.gz OVWXGPBBGGLBQQ-UHFFFAOYSA-N -1 3 335.325 4.468 20 0 EIADHM CSc1ccc([N-]S(=O)(=O)c2ccc(Cl)c(C)c2)c(F)c1 ZINC001185531533 1052257749 /nfs/dbraw/zinc/25/77/49/1052257749.db2.gz CSUNMSWQQQPLIW-UHFFFAOYSA-N -1 3 345.848 4.310 20 0 EIADHM O=C(c1cc([O-])cc(C(F)(F)F)c1)N1CCc2c1cccc2Cl ZINC000622428086 1052264715 /nfs/dbraw/zinc/26/47/15/1052264715.db2.gz RPFMAWGAWWWGFN-UHFFFAOYSA-N -1 3 341.716 4.267 20 0 EIADHM O=C(c1cc([O-])cc(C(F)(F)F)c1)N1CCCC12CCCCC2 ZINC000622468643 1052293337 /nfs/dbraw/zinc/29/33/37/1052293337.db2.gz LJIXDUQQCORKLO-UHFFFAOYSA-N -1 3 327.346 4.350 20 0 EIADHM O=C(c1cc(Cc2ccccc2)ccc1[O-])N1CCc2cc(F)ccc21 ZINC000622586128 1052337817 /nfs/dbraw/zinc/33/78/17/1052337817.db2.gz YURYAXLEVNPXLK-UHFFFAOYSA-N -1 3 347.389 4.325 20 0 EIADHM O=C(c1cc(Cc2ccccc2)ccc1[O-])N1Cc2ccccc2CO1 ZINC000622601490 1052344580 /nfs/dbraw/zinc/34/45/80/1052344580.db2.gz GCKIKQXUEHHDOH-UHFFFAOYSA-N -1 3 345.398 4.071 20 0 EIADHM COc1ccc2c(c1)C[C@@H](C(C)C)CN2C(=O)c1cccc(C)c1[O-] ZINC000622728675 1052396829 /nfs/dbraw/zinc/39/68/29/1052396829.db2.gz IAMDAZVNQGBPPB-MRXNPFEDSA-N -1 3 339.435 4.184 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)N1CCC[C@@H]1c1ccc(Cl)cc1 ZINC000172626050 1052509520 /nfs/dbraw/zinc/50/95/20/1052509520.db2.gz APCYLFLOBXZHEQ-MRXNPFEDSA-N -1 3 348.805 4.231 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)N1CCC[C@H]1c1ccc(Cl)cc1 ZINC000172626047 1052509875 /nfs/dbraw/zinc/50/98/75/1052509875.db2.gz APCYLFLOBXZHEQ-INIZCTEOSA-N -1 3 348.805 4.231 20 0 EIADHM CCc1ccc([O-])c(C(=O)N(C)Cc2ccc(C(F)(F)F)cc2)c1 ZINC000623467220 1052661042 /nfs/dbraw/zinc/66/10/42/1052661042.db2.gz OJYNGNWFBGADCI-UHFFFAOYSA-N -1 3 337.341 4.246 20 0 EIADHM CC(C)Oc1ccc(S(=O)(=O)[N-]c2cccc(C(F)F)c2)cc1 ZINC000179735939 1052752451 /nfs/dbraw/zinc/75/24/51/1052752451.db2.gz ZNWFSSPOMNTHQU-UHFFFAOYSA-N -1 3 341.379 4.212 20 0 EIADHM CC(C)c1csc(C[N-]C(=O)C(F)(F)c2cccc(Cl)c2)n1 ZINC000764183435 1053039359 /nfs/dbraw/zinc/03/93/59/1053039359.db2.gz TUWBFYATXNAZFL-UHFFFAOYSA-N -1 3 344.814 4.328 20 0 EIADHM [O-]c1ccc(F)c(CNc2cccc(-c3noc(C4CC4)n3)c2)c1F ZINC000509508507 1053087669 /nfs/dbraw/zinc/08/76/69/1053087669.db2.gz NLWVBZSAIGBIHJ-UHFFFAOYSA-N -1 3 343.333 4.210 20 0 EIADHM Nc1nc(-c2cccc(C(=O)Nc3cc([O-])cc(Cl)c3)c2)cs1 ZINC001194721301 1053088342 /nfs/dbraw/zinc/08/83/42/1053088342.db2.gz LYYXNENUZVNGAK-UHFFFAOYSA-N -1 3 345.811 4.004 20 0 EIADHM O=C(Nc1ccc(-c2cccc(O)c2)cc1)c1cnc(C(F)(F)F)[n-]1 ZINC001194783494 1053091134 /nfs/dbraw/zinc/09/11/34/1053091134.db2.gz OPOGZLJAJDWNAE-UHFFFAOYSA-N -1 3 347.296 4.053 20 0 EIADHM CCCOc1c(Cl)cc(C=Cc2nccc(=O)[n-]2)cc1OCC ZINC000764434705 1053100917 /nfs/dbraw/zinc/10/09/17/1053100917.db2.gz MCEUXUUKXBEAGD-WAYWQWQTSA-N -1 3 334.803 4.194 20 0 EIADHM O=C([N-]c1nsc2ncccc12)c1cc(Cl)c(Cl)s1 ZINC001195170329 1053316562 /nfs/dbraw/zinc/31/65/62/1053316562.db2.gz ZNXYIQCACDENLT-UHFFFAOYSA-N -1 3 330.221 4.312 20 0 EIADHM Cc1cccc(Cl)c1[N-]S(=O)(=O)c1c(C)cccc1Cl ZINC001195267564 1053352353 /nfs/dbraw/zinc/35/23/53/1053352353.db2.gz GAXCJWOVZMATGL-UHFFFAOYSA-N -1 3 330.236 4.411 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N1CCc2c(F)cc(F)cc2C1 ZINC000355220683 1053430807 /nfs/dbraw/zinc/43/08/07/1053430807.db2.gz DGZWYHIZYLECJA-UHFFFAOYSA-N -1 3 339.341 4.022 20 0 EIADHM O=C([N-]c1nnc(-c2ccco2)o1)c1sccc1-c1ccccc1 ZINC001195709576 1053467026 /nfs/dbraw/zinc/46/70/26/1053467026.db2.gz NINAMAXEVKFUQN-UHFFFAOYSA-N -1 3 337.360 4.310 20 0 EIADHM Cc1ccc(C(C)(C)C)cc1SCc1nc2c(c(=O)[n-]1)COCC2 ZINC000865346901 1053477725 /nfs/dbraw/zinc/47/77/25/1053477725.db2.gz WEXKHCWWNXJCSG-UHFFFAOYSA-N -1 3 344.480 4.153 20 0 EIADHM [O-]c1cnc(NC(=S)Nc2ccc(C(F)(F)F)cc2)c(Cl)c1 ZINC001196165808 1053604817 /nfs/dbraw/zinc/60/48/17/1053604817.db2.gz FRKHTMHEIILWCT-UHFFFAOYSA-N -1 3 347.749 4.268 20 0 EIADHM CC(=O)Nc1ccc(C)c(NC(=O)c2cc([O-])c3ccccc3c2)c1 ZINC000471743449 1053700330 /nfs/dbraw/zinc/70/03/30/1053700330.db2.gz FDWGZTNZGVTHDE-UHFFFAOYSA-N -1 3 334.375 4.065 20 0 EIADHM CCc1ccc(CN(C)Cc2nc3c4ccccc4oc3c(=O)[n-]2)cc1 ZINC000024795589 1053817275 /nfs/dbraw/zinc/81/72/75/1053817275.db2.gz FQNVWDYPKLKMJR-UHFFFAOYSA-N -1 3 347.418 4.276 20 0 EIADHM [O-]c1cc(NC(=S)Nc2cccc(Br)c2)ccc1F ZINC001197002508 1053819919 /nfs/dbraw/zinc/81/99/19/1053819919.db2.gz PXZRNVSDBCJKHE-UHFFFAOYSA-N -1 3 341.205 4.103 20 0 EIADHM CCOc1ccc(SCc2cc(=O)oc3c(C)c([O-])ccc23)cc1 ZINC000016168658 1053821232 /nfs/dbraw/zinc/82/12/32/1053821232.db2.gz LSUXJNHUOAOBQX-UHFFFAOYSA-N -1 3 342.416 4.498 20 0 EIADHM [O-]c1cncc(NC(=S)Nc2ccc(Oc3ccccc3)cc2)c1 ZINC001197036025 1053829414 /nfs/dbraw/zinc/82/94/14/1053829414.db2.gz ZPDXZLBTQMLRHY-UHFFFAOYSA-N -1 3 337.404 4.388 20 0 EIADHM CC(C)c1ccc([C@@H](C)N2CC[C@](C)([N-]C(=O)C(F)(F)F)C2)cc1 ZINC001197168148 1053848491 /nfs/dbraw/zinc/84/84/91/1053848491.db2.gz QFAKUHHXLRQCMP-DYVFJYSZSA-N -1 3 342.405 4.014 20 0 EIADHM Cn1c(C(=O)Nc2ccc(F)c([O-])c2)ccc1-c1ccc(Cl)cc1 ZINC001197343780 1053878282 /nfs/dbraw/zinc/87/82/82/1053878282.db2.gz VPFSMUIIFTXSFG-UHFFFAOYSA-N -1 3 344.773 4.443 20 0 EIADHM O=C(Nc1c([O-])cccc1Cl)[C@H](Cc1cccnc1)C1CCCC1 ZINC000868566946 1053917058 /nfs/dbraw/zinc/91/70/58/1053917058.db2.gz LIYSRVXTQAYDKV-OAHLLOKOSA-N -1 3 344.842 4.428 20 0 EIADHM O=S(=O)([N-]c1ccc(F)c(Cl)c1F)c1ccc(Cl)cc1 ZINC001251735700 1054077561 /nfs/dbraw/zinc/07/75/61/1054077561.db2.gz VHHZKPMKPIQLMD-UHFFFAOYSA-N -1 3 338.162 4.072 20 0 EIADHM CC(C)(C)c1ncc(C(=O)[N-]c2cc(F)c(F)c(F)c2F)s1 ZINC000871268782 1054180279 /nfs/dbraw/zinc/18/02/79/1054180279.db2.gz PWCIVCBYAMFUPN-UHFFFAOYSA-N -1 3 332.322 4.249 20 0 EIADHM CCOc1cccc([C@H](C)NC(=O)c2cc([O-])c3ccccc3c2)c1 ZINC000471913405 1054197979 /nfs/dbraw/zinc/19/79/79/1054197979.db2.gz VOHHFGZMHSKNKY-AWEZNQCLSA-N -1 3 335.403 4.435 20 0 EIADHM C[C@H]1CN(C(=O)c2cc([O-])c3ccccc3c2)c2ccc(F)cc2O1 ZINC000472205437 1054248079 /nfs/dbraw/zinc/24/80/79/1054248079.db2.gz KCDSBSHXWJUMIZ-LBPRGKRZSA-N -1 3 337.350 4.112 20 0 EIADHM C[C@@H](CC(=O)[N-]OCc1ccc(C(F)(F)F)cc1)c1ccccc1 ZINC000857473087 1054264351 /nfs/dbraw/zinc/26/43/51/1054264351.db2.gz JCWYGUHBUPVEKA-ZDUSSCGKSA-N -1 3 337.341 4.447 20 0 EIADHM O=S(=O)([N-]c1ccc(Cl)c(F)c1F)c1ccc2occc2c1 ZINC001198858972 1054284930 /nfs/dbraw/zinc/28/49/30/1054284930.db2.gz OBPHSISEQXABHW-UHFFFAOYSA-N -1 3 343.738 4.165 20 0 EIADHM O=C(c1cc([O-])cc(C(F)(F)F)c1)N1Cc2cccc(Cl)c2C1 ZINC000857505332 1054285468 /nfs/dbraw/zinc/28/54/68/1054285468.db2.gz FIPQUTRUJZKJEK-UHFFFAOYSA-N -1 3 341.716 4.220 20 0 EIADHM Cc1cc([N-]S(=O)(=O)c2ccc3occc3c2)c(F)cc1Cl ZINC001198869151 1054295775 /nfs/dbraw/zinc/29/57/75/1054295775.db2.gz SOEBZUQBCGPQFU-UHFFFAOYSA-N -1 3 339.775 4.335 20 0 EIADHM COc1ccc(S(=O)(=O)[N-]c2ccc3sccc3c2)c(C)c1 ZINC001198943756 1054318268 /nfs/dbraw/zinc/31/82/68/1054318268.db2.gz PAXOZOJOKNSTPN-UHFFFAOYSA-N -1 3 333.434 4.019 20 0 EIADHM O=C(OCc1ncc(-c2ccccc2)o1)c1cccc(Cl)c1[O-] ZINC000775933284 1054338854 /nfs/dbraw/zinc/33/88/54/1054338854.db2.gz MVADCBVSXYJUJD-UHFFFAOYSA-N -1 3 329.739 4.058 20 0 EIADHM C[C@@H](NCc1ccc(N2CCCCCC2)nc1)c1cccc([O-])c1F ZINC000872025483 1054342198 /nfs/dbraw/zinc/34/21/98/1054342198.db2.gz NOJLDMCWCFSHCN-OAHLLOKOSA-N -1 3 343.446 4.158 20 0 EIADHM COc1cc(F)c([C@H](C)N[C@@H](C)c2cccc([O-])c2F)cc1OC ZINC000872033357 1054350769 /nfs/dbraw/zinc/35/07/69/1054350769.db2.gz CNMMYDDXZFOSEQ-QWRGUYRKSA-N -1 3 337.366 4.099 20 0 EIADHM Cc1ccc(OC(F)F)c(CN[C@H](C)c2cccc([O-])c2F)c1 ZINC000872043457 1054355313 /nfs/dbraw/zinc/35/53/13/1054355313.db2.gz YGBYEORGMHUGNJ-LLVKDONJSA-N -1 3 325.330 4.292 20 0 EIADHM Cc1ccc(OC(F)F)c(CN[C@@H](C)c2cccc([O-])c2F)c1 ZINC000872043459 1054355841 /nfs/dbraw/zinc/35/58/41/1054355841.db2.gz YGBYEORGMHUGNJ-NSHDSACASA-N -1 3 325.330 4.292 20 0 EIADHM CCCC[C@@H](CC)C(=O)Nc1cccc(-c2nc(CC)cc(=O)[n-]2)c1 ZINC000046066184 1054365631 /nfs/dbraw/zinc/36/56/31/1054365631.db2.gz GCRSMIGQELBZKI-CQSZACIVSA-N -1 3 341.455 4.154 20 0 EIADHM O=c1nc(-c2ccc([O-])cc2)[nH]c2scc(-c3ccc(F)cc3)c21 ZINC000046438370 1054380927 /nfs/dbraw/zinc/38/09/27/1054380927.db2.gz XKKDYHTTWRIVEO-UHFFFAOYSA-N -1 3 338.363 4.163 20 0 EIADHM C[C@@H](N[C@@H](C)c1cccc([O-])c1F)c1ccc(C(F)(F)F)nc1 ZINC000872130826 1054406310 /nfs/dbraw/zinc/40/63/10/1054406310.db2.gz SKLPTQDQZCGNLZ-ZJUUUORDSA-N -1 3 328.309 4.357 20 0 EIADHM Cc1nc(C2CCN([C@H](C)c3ccccc3F)CC2)sc1C(=O)[O-] ZINC000872165310 1054418212 /nfs/dbraw/zinc/41/82/12/1054418212.db2.gz SBSXDFYJWRLBKD-GFCCVEGCSA-N -1 3 348.443 4.229 20 0 EIADHM CCc1ccc([O-])c(C(=O)N2C[C@@H](C)C[C@@H]2c2ccccc2F)c1 ZINC001137070520 1054521566 /nfs/dbraw/zinc/52/15/66/1054521566.db2.gz DCQNNRMNLHXRMW-SCLBCKFNSA-N -1 3 327.399 4.317 20 0 EIADHM CCc1cc2c(CSc3ccc(F)cc3)cc(=O)oc2cc1[O-] ZINC000005204670 1054525850 /nfs/dbraw/zinc/52/58/50/1054525850.db2.gz WGVHOGGWFBZUIQ-UHFFFAOYSA-N -1 3 330.380 4.492 20 0 EIADHM O=C([N-]c1nnc(C2CCCCC2)s1)c1nccc2ccsc21 ZINC000858693765 1054548860 /nfs/dbraw/zinc/54/88/60/1054548860.db2.gz XRSIEGNWPMSQCT-UHFFFAOYSA-N -1 3 344.465 4.448 20 0 EIADHM CCCCC1CCC(CNC(=O)c2c[n-]c3ccccc3c2=O)CC1 ZINC000065675814 1054947736 /nfs/dbraw/zinc/94/77/36/1054947736.db2.gz GLMSJKWYEIELCW-UHFFFAOYSA-N -1 3 340.467 4.255 20 0 EIADHM Cc1cccc(C)c1NC(=O)Nc1ccc([O-])c(Br)c1 ZINC001202207731 1055085047 /nfs/dbraw/zinc/08/50/47/1055085047.db2.gz MLLYNLJDRZEWDQ-UHFFFAOYSA-N -1 3 335.201 4.416 20 0 EIADHM COCc1c2ccccc2oc1C(=O)Nc1cc(Cl)ccc1[O-] ZINC000069693450 1055119151 /nfs/dbraw/zinc/11/91/51/1055119151.db2.gz WCQROOCXCALZDJ-UHFFFAOYSA-N -1 3 331.755 4.191 20 0 EIADHM CCC(F)(F)C(C)(C)CNC(=O)c1cc2sccc2c([O-])c1 ZINC000862944632 1055129084 /nfs/dbraw/zinc/12/90/84/1055129084.db2.gz VPGNNFSFKVHEFX-UHFFFAOYSA-N -1 3 327.396 4.408 20 0 EIADHM CC(=O)c1cccc(NC(=O)Nc2ccc(C(F)(F)F)cc2)c1[O-] ZINC001202412625 1055162374 /nfs/dbraw/zinc/16/23/74/1055162374.db2.gz VMIIMIMNQHMWTJ-UHFFFAOYSA-N -1 3 338.285 4.258 20 0 EIADHM CC(C)[C@@H](NCc1nnc(-c2ccccc2[O-])o1)c1ccc(F)cc1 ZINC000878205827 1055205137 /nfs/dbraw/zinc/20/51/37/1055205137.db2.gz ROBAVBXTSGMJPB-GOSISDBHSA-N -1 3 341.386 4.068 20 0 EIADHM [O-]c1ccccc1-c1nnc(CN[C@@H](c2ccccc2)C2CCCC2)o1 ZINC000878243389 1055221497 /nfs/dbraw/zinc/22/14/97/1055221497.db2.gz BYASBJPGBWKGBL-FQEVSTJZSA-N -1 3 349.434 4.463 20 0 EIADHM CC(C)C[C@@H](NCc1nnc(-c2ccccc2[O-])o1)c1ccccc1 ZINC000878345788 1055251651 /nfs/dbraw/zinc/25/16/51/1055251651.db2.gz AXHSLGQRIGPDPV-QGZVFWFLSA-N -1 3 337.423 4.319 20 0 EIADHM [O-]c1ccccc1-c1nnc(CN[C@@H](CC2CC2)c2ccccc2)o1 ZINC000878363536 1055270417 /nfs/dbraw/zinc/27/04/17/1055270417.db2.gz CXEOYYPHGINSHO-KRWDZBQOSA-N -1 3 335.407 4.073 20 0 EIADHM Cc1cc(S(=O)(=O)[N-]c2c(C)cccc2C)ccc1OC(C)C ZINC000055558802 1055803072 /nfs/dbraw/zinc/80/30/72/1055803072.db2.gz IIHMANLOXCALBH-UHFFFAOYSA-N -1 3 333.453 4.200 20 0 EIADHM O=C(c1ccc(O)cc1[O-])N(Cc1ccccc1F)C1CCCCC1 ZINC000542816863 1056097310 /nfs/dbraw/zinc/09/73/10/1056097310.db2.gz XXHUUDSTEUZYQA-UHFFFAOYSA-N -1 3 343.398 4.212 20 0 EIADHM CC(C)[C@H]1CCCCN1Cc1cc(C(=O)[O-])ccc1Br ZINC000903891200 1056579382 /nfs/dbraw/zinc/57/93/82/1056579382.db2.gz LJAGHFYFCWWLAA-OAHLLOKOSA-N -1 3 340.261 4.158 20 0 EIADHM Cc1cc(Br)ccc1C(=O)Nc1cc(Cl)ccc1[O-] ZINC000111211317 1056774621 /nfs/dbraw/zinc/77/46/21/1056774621.db2.gz CWEDQDMWPPNUKG-UHFFFAOYSA-N -1 3 340.604 4.369 20 0 EIADHM O=S(=O)([N-]c1cccc(Cl)c1F)c1ccc2ccccc2c1 ZINC000007387646 1056792637 /nfs/dbraw/zinc/79/26/37/1056792637.db2.gz OAUFUGXGLGYYGL-UHFFFAOYSA-N -1 3 335.787 4.433 20 0 EIADHM COc1cccc(-c2noc([N-]Cc3ccc([C@H]4C[C@H]4C)o3)n2)c1 ZINC000742394827 1058592495 /nfs/dbraw/zinc/59/24/95/1058592495.db2.gz YGPLVASYWKKJRR-ABAIWWIYSA-N -1 3 325.368 4.074 20 0 EIADHM Cc1cc(F)c(C(=O)[N-]c2nc(-c3cccs3)ns2)cc1F ZINC000182132983 1059764275 /nfs/dbraw/zinc/76/42/75/1059764275.db2.gz WGQZQFJYKJRSPP-UHFFFAOYSA-N -1 3 337.376 4.106 20 0 EIADHM COc1ccc(-n2nc(C)cc2Nc2ccc(Cl)c([O-])c2)cc1 ZINC001212587997 1060736239 /nfs/dbraw/zinc/73/62/39/1060736239.db2.gz DMVKYHQWQNSJIJ-UHFFFAOYSA-N -1 3 329.787 4.292 20 0 EIADHM [O-]c1cc(Nc2cc(Br)cn3ccnc23)ccc1Cl ZINC001212588538 1060758241 /nfs/dbraw/zinc/75/82/41/1060758241.db2.gz SSWRBBIUFOTPFX-UHFFFAOYSA-N -1 3 338.592 4.199 20 0 EIADHM [O-]c1cc(Nc2nccnc2OCc2ccccc2)ccc1Cl ZINC001212588016 1060765103 /nfs/dbraw/zinc/76/51/03/1060765103.db2.gz FRIOETYGXFPYEN-UHFFFAOYSA-N -1 3 327.771 4.158 20 0 EIADHM CCNc1ccc(C(=O)OCC)cc1Nc1ccc(Cl)c([O-])c1 ZINC001212592360 1060889216 /nfs/dbraw/zinc/88/92/16/1060889216.db2.gz MFRJGOHYBDYNAI-UHFFFAOYSA-N -1 3 334.803 4.398 20 0 EIADHM CN(c1ccc(Cl)c([O-])c1)c1c(N)cccc1Br ZINC001212593989 1060913648 /nfs/dbraw/zinc/91/36/48/1060913648.db2.gz OSGRMWMJOSWQIL-UHFFFAOYSA-N -1 3 327.609 4.158 20 0 EIADHM CCOC(=O)c1c(F)cc(F)cc1Nc1ccc(Cl)c([O-])c1 ZINC001212595545 1060991018 /nfs/dbraw/zinc/99/10/18/1060991018.db2.gz YTHVANOTKWUFMY-UHFFFAOYSA-N -1 3 327.714 4.244 20 0 EIADHM Nc1cc(Br)cc2c1N(c1ccc(Cl)c([O-])c1)CC2 ZINC001212595496 1060992462 /nfs/dbraw/zinc/99/24/62/1060992462.db2.gz WSAUXVWHXSAYKI-UHFFFAOYSA-N -1 3 339.620 4.085 20 0 EIADHM Cc1nc(-c2cccc(NC(=O)c3cc(-c4ccco4)[n-]n3)c2)oc1C ZINC000065089622 201152581 /nfs/dbraw/zinc/15/25/81/201152581.db2.gz CPCGRPSMSRGAHB-UHFFFAOYSA-N -1 3 348.362 4.194 20 0 EIADHM Cc1nc(-c2cccc(NC(=O)c3cc(-c4ccco4)n[n-]3)c2)oc1C ZINC000065089622 201152585 /nfs/dbraw/zinc/15/25/85/201152585.db2.gz CPCGRPSMSRGAHB-UHFFFAOYSA-N -1 3 348.362 4.194 20 0 EIADHM O=C(Nc1ccc(Br)cc1[O-])c1cccc(Cl)c1 ZINC000514820280 1040256424 /nfs/dbraw/zinc/25/64/24/1040256424.db2.gz GNFZSDGXGADGBU-UHFFFAOYSA-N -1 3 326.577 4.060 20 0 EIADHM O=C(CCCOc1ccc(F)cc1F)Nc1ccc(Cl)cc1[O-] ZINC000532836509 1032341449 /nfs/dbraw/zinc/34/14/49/1032341449.db2.gz BJOOUAJOUZVFPN-UHFFFAOYSA-N -1 3 341.741 4.122 20 0 EIADHM C[C@H](Oc1ccccc1Cl)C(=O)Nc1ccc(Cl)cc1[O-] ZINC000532840725 1032344443 /nfs/dbraw/zinc/34/44/43/1032344443.db2.gz WELJYGAPPORJGS-VIFPVBQESA-N -1 3 326.179 4.105 20 0 EIADHM COc1ccc(CCCC(=O)Nc2ccc(Cl)cc2[O-])c(OC)c1 ZINC000533159585 1032514336 /nfs/dbraw/zinc/51/43/36/1032514336.db2.gz KFVAJGSTJQRCRK-UHFFFAOYSA-N -1 3 349.814 4.024 20 0 EIADHM Cc1nc(-c2ccc(NC[C@@H]3CCCCC3(F)F)nc2)[n-]c(=O)c1C ZINC000450584032 1032565040 /nfs/dbraw/zinc/56/50/40/1032565040.db2.gz NLZFFAGJVZVTSW-AWEZNQCLSA-N -1 3 348.397 4.098 20 0 EIADHM C[C@H]1C[C@H](c2ccccc2)CCN1C(=O)c1cc([O-])ccc1Cl ZINC000512422222 1032729337 /nfs/dbraw/zinc/72/93/37/1032729337.db2.gz YHKYLNRHONOJLO-DZGCQCFKSA-N -1 3 329.827 4.454 20 0 EIADHM Cc1nccn1-c1ccc([C@H](C)NCc2cccc([O-])c2Cl)cc1 ZINC000339295345 1018759823 /nfs/dbraw/zinc/75/98/23/1018759823.db2.gz NSQDPJIGYROPOD-ZDUSSCGKSA-N -1 3 341.842 4.391 20 0 EIADHM C[C@H]1CN(C(=O)c2cc([O-])cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 ZINC000646878387 1018860746 /nfs/dbraw/zinc/86/07/46/1018860746.db2.gz OEIXJNRTCWCDIT-ZBEGNZNMSA-N -1 3 335.325 4.244 20 0 EIADHM Cc1noc(C2CC2)c1[N-]C(=O)c1cc(F)c(C(F)(F)F)c(F)c1 ZINC000683214712 1019425162 /nfs/dbraw/zinc/42/51/62/1019425162.db2.gz HDQQIUQULPGYCR-UHFFFAOYSA-N -1 3 346.255 4.410 20 0 EIADHM O=C(NCc1ncccc1[O-])Nc1ccccc1SC1CCCC1 ZINC000471173307 1019627672 /nfs/dbraw/zinc/62/76/72/1019627672.db2.gz NPSDLHLUYHYIGS-UHFFFAOYSA-N -1 3 343.452 4.144 20 0 EIADHM COc1cc(NC(=O)Cc2ccc([O-])c(F)c2)c(C2CC2)cc1Cl ZINC000655384754 1019796153 /nfs/dbraw/zinc/79/61/53/1019796153.db2.gz CENAPOCSCGGHCN-UHFFFAOYSA-N -1 3 349.789 4.252 20 0 EIADHM CC[C@H](C)c1ccc(S(=O)(=O)[N-]c2cc3c(cc2C)OCO3)cc1 ZINC000510134351 1019838395 /nfs/dbraw/zinc/83/83/95/1019838395.db2.gz LJXUUSAURSBRIQ-LBPRGKRZSA-N -1 3 347.436 4.038 20 0 EIADHM C[C@H](CCC1CC1)NC(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC001625836322 1020220367 /nfs/dbraw/zinc/22/03/67/1020220367.db2.gz RMYUJNCTXXFGTB-CQSZACIVSA-N -1 3 325.408 4.493 20 0 EIADHM CCCCCOc1ccc(CNCc2ccc(C(=O)[O-])cc2)cc1 ZINC000076274979 1020391597 /nfs/dbraw/zinc/39/15/97/1020391597.db2.gz ULCOMVFESYHADA-UHFFFAOYSA-N -1 3 327.424 4.244 20 0 EIADHM CC(=O)c1ccc(NC(=O)CCCc2ccc([O-])c(F)c2)cc1Cl ZINC000471288828 1020642407 /nfs/dbraw/zinc/64/24/07/1020642407.db2.gz PRGQEAASJJEKRM-UHFFFAOYSA-N -1 3 349.789 4.349 20 0 EIADHM CC(C)(C)c1nnc([N-]C(=O)c2ncsc2-c2ccccc2)s1 ZINC000275535287 1020785199 /nfs/dbraw/zinc/78/51/99/1020785199.db2.gz ZCMWVSFTPRKQQB-UHFFFAOYSA-N -1 3 344.465 4.211 20 0 EIADHM CC(C)c1ccc(-c2nc([C@H]3COc4ccccc4O3)no2)c([O-])c1 ZINC000683592447 1020949908 /nfs/dbraw/zinc/94/99/08/1020949908.db2.gz BRUJRXBOMSGHFO-QGZVFWFLSA-N -1 3 338.363 4.078 20 0 EIADHM CCSc1cccc(F)c1[N-]C(=O)c1cnc(C(C)C)nc1C ZINC000891044209 1021060799 /nfs/dbraw/zinc/06/07/99/1021060799.db2.gz RCXXEVBASGYGQJ-UHFFFAOYSA-N -1 3 333.432 4.412 20 0 EIADHM CN(C)c1ccc(Cl)cc1NC(=O)c1cc([O-])ccc1Cl ZINC000432842594 1032952601 /nfs/dbraw/zinc/95/26/01/1032952601.db2.gz VIJCOSZRTQGWJT-UHFFFAOYSA-N -1 3 325.195 4.017 20 0 EIADHM Cc1noc(-c2ccccc2)c1[N-]C(=O)c1cc(C)c(F)cc1F ZINC000122758409 1021121418 /nfs/dbraw/zinc/12/14/18/1021121418.db2.gz QIEMJBATVQKNIM-UHFFFAOYSA-N -1 3 328.318 4.489 20 0 EIADHM O=C(Nc1ccc(Oc2ccccc2)nc1)c1cc([O-])ccc1Cl ZINC000580017854 1021142163 /nfs/dbraw/zinc/14/21/63/1021142163.db2.gz GCRRLKDSJRPKGQ-UHFFFAOYSA-N -1 3 340.766 4.485 20 0 EIADHM Cc1c([O-])ccc2c(CN(C)[C@@H](C)c3ccccc3F)cc(=O)oc12 ZINC000053124922 1021413756 /nfs/dbraw/zinc/41/37/56/1021413756.db2.gz TZNNLQOJZPHUKZ-ZDUSSCGKSA-N -1 3 341.382 4.139 20 0 EIADHM CC[C@@H](c1cccc(OC)c1)N(C)C(=O)c1cc([O-])ccc1Cl ZINC000685855436 1021781097 /nfs/dbraw/zinc/78/10/97/1021781097.db2.gz VEFCMAMLYBQVPN-KRWDZBQOSA-N -1 3 333.815 4.278 20 0 EIADHM CC(C)(C)c1cnc(COC(=O)c2cccc3[n-]c(C(F)F)nc32)o1 ZINC000924080126 1021792341 /nfs/dbraw/zinc/79/23/41/1021792341.db2.gz INMKNSQYUKLDIU-UHFFFAOYSA-N -1 3 349.337 4.143 20 0 EIADHM O=C(Nc1cccc(COCC2CC2)c1)c1cc([O-])ccc1Cl ZINC000431761203 1021795385 /nfs/dbraw/zinc/79/53/85/1021795385.db2.gz ZEKXDXSKBBXATJ-UHFFFAOYSA-N -1 3 331.799 4.225 20 0 EIADHM O=C([O-])C[C@@H](NCc1ccc(F)cc1)c1cccc(C(F)(F)F)c1 ZINC000340673838 1021893209 /nfs/dbraw/zinc/89/32/09/1021893209.db2.gz DTMGXWYWGWUKIR-OAHLLOKOSA-N -1 3 341.304 4.150 20 0 EIADHM Cc1ccc(CC(=O)[N-]O[C@H](C)c2ncc(-c3ccccc3)o2)cc1 ZINC000178160175 1022061331 /nfs/dbraw/zinc/06/13/31/1022061331.db2.gz BKHCNOOJYMXEOW-OAHLLOKOSA-N -1 3 336.391 4.002 20 0 EIADHM Cc1ccc(OC[C@H](C)NC(=O)c2ccc(C(C)C)cc2[O-])cc1 ZINC001625865968 1022162730 /nfs/dbraw/zinc/16/27/30/1022162730.db2.gz LFNRYYJDQLFYMO-HNNXBMFYSA-N -1 3 327.424 4.021 20 0 EIADHM O=C(NCc1cccc(-c2ccccn2)c1)c1cc([O-])ccc1Cl ZINC000377994276 1022200845 /nfs/dbraw/zinc/20/08/45/1022200845.db2.gz WXVJKCDKLMBELK-UHFFFAOYSA-N -1 3 338.794 4.038 20 0 EIADHM O=C(N[C@H]1C[C@H](c2ccc(F)cc2)C1)c1cc([O-])c2ccccc2c1 ZINC000481513098 1022203437 /nfs/dbraw/zinc/20/34/37/1022203437.db2.gz DMLBINLQBNVAOY-RZDIXWSQSA-N -1 3 335.378 4.361 20 0 EIADHM CCCC(CCC)[S@](=O)Cc1cc(=O)[n-]c(-c2ccccc2)n1 ZINC000414236359 1022251596 /nfs/dbraw/zinc/25/15/96/1022251596.db2.gz IDVBSFQXCIZXTM-HSZRJFAPSA-N -1 3 332.469 4.067 20 0 EIADHM CC(C)(C)c1ccccc1S(=O)(=O)[N-]c1cc(F)c(F)cc1F ZINC000460835193 1022287260 /nfs/dbraw/zinc/28/72/60/1022287260.db2.gz YBEHHZHXWTWHQY-UHFFFAOYSA-N -1 3 343.370 4.202 20 0 EIADHM CCc1ccc(C(=O)Nc2ccc(C(F)(F)F)c(F)c2)c([O-])c1 ZINC001167427541 1022329801 /nfs/dbraw/zinc/32/98/01/1022329801.db2.gz QBRVDKFEZBGGGS-UHFFFAOYSA-N -1 3 327.277 4.365 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N1CC[C@@](F)(c2ccccc2)C1 ZINC000580761907 1022477893 /nfs/dbraw/zinc/47/78/93/1022477893.db2.gz YXGCGDFQRWHJMU-NRFANRHFSA-N -1 3 335.378 4.256 20 0 EIADHM Cc1ccc([O-])c(CN[C@@H](C)c2nc(-c3ccccc3)cs2)n1 ZINC000107321569 1022600521 /nfs/dbraw/zinc/60/05/21/1022600521.db2.gz ZKDZRAKYUMVFDO-ZDUSSCGKSA-N -1 3 325.437 4.070 20 0 EIADHM CCN(C(=O)CCCc1ccc([O-])c(F)c1)c1ccc2[nH]ccc2c1 ZINC000472979375 1022802532 /nfs/dbraw/zinc/80/25/32/1022802532.db2.gz QGMWSQUWDHNSJP-UHFFFAOYSA-N -1 3 340.398 4.388 20 0 EIADHM C[C@H](C(=O)NCc1ccc([O-])c(F)c1)c1ccc(Cl)c(Cl)c1 ZINC000472609671 1022851332 /nfs/dbraw/zinc/85/13/32/1022851332.db2.gz QUTDCEDVJMPGFF-VIFPVBQESA-N -1 3 342.197 4.258 20 0 EIADHM Cc1cc(C)c([N-]S(=O)(=O)c2ccccc2Cl)c(Cl)c1 ZINC000096659534 1022882453 /nfs/dbraw/zinc/88/24/53/1022882453.db2.gz QYWMTMZKAZHFQS-UHFFFAOYSA-N -1 3 330.236 4.411 20 0 EIADHM O=C(CCCSc1ccc(Cl)cc1)[N-]OCc1ccccc1 ZINC000255950507 1022886242 /nfs/dbraw/zinc/88/62/42/1022886242.db2.gz CNMOIRRYEAXYDO-UHFFFAOYSA-N -1 3 335.856 4.460 20 0 EIADHM O=C(c1cc2c(cc1[O-])CCCC2)N1CCc2ccc(Cl)cc21 ZINC000060473282 1023124825 /nfs/dbraw/zinc/12/48/25/1023124825.db2.gz KCVBJDUKHQPVMV-UHFFFAOYSA-N -1 3 327.811 4.127 20 0 EIADHM CC[C@@H](C)Oc1cc(C)ccc1CNCc1c(F)ccc([O-])c1F ZINC000511602515 1023142419 /nfs/dbraw/zinc/14/24/19/1023142419.db2.gz BIBKYIKBUPIXSY-CYBMUJFWSA-N -1 3 335.394 4.446 20 0 EIADHM O=C([O-])c1ccc(CN2CC[C@H](CSc3ccccc3)C2)c(F)c1 ZINC000581434908 1023215634 /nfs/dbraw/zinc/21/56/34/1023215634.db2.gz RPYCDMQSRLKOJR-AWEZNQCLSA-N -1 3 345.439 4.138 20 0 EIADHM CCc1cccc2cc(CN[C@@H](CC(=O)[O-])c3cccs3)oc21 ZINC000656574398 1023247406 /nfs/dbraw/zinc/24/74/06/1023247406.db2.gz UPSZJUHJNRSCIF-HNNXBMFYSA-N -1 3 329.421 4.362 20 0 EIADHM CN(C[C@@H]1CCc2ccccc21)[C@H](C(=O)[O-])c1c(F)cccc1Cl ZINC000659803516 1023285567 /nfs/dbraw/zinc/28/55/67/1023285567.db2.gz JQDJNYYMWDFUAE-UGSOOPFHSA-N -1 3 347.817 4.267 20 0 EIADHM O=C([O-])c1ccc(-c2nc(CN(CCC3CC3)CC3CC3)co2)cc1 ZINC000659804298 1023286417 /nfs/dbraw/zinc/28/64/17/1023286417.db2.gz WHAHSFLWTYARJP-UHFFFAOYSA-N -1 3 340.423 4.052 20 0 EIADHM O=C([O-])c1cccc2c1CCN(CCSc1ccc(Cl)cc1)C2 ZINC000581500602 1023307820 /nfs/dbraw/zinc/30/78/20/1023307820.db2.gz YFAUTCZWNLVXSB-UHFFFAOYSA-N -1 3 347.867 4.189 20 0 EIADHM CSc1ccc(CN[C@H](CC(=O)[O-])c2cccc(Cl)c2)s1 ZINC000417586016 1023363951 /nfs/dbraw/zinc/36/39/51/1023363951.db2.gz QPBWSKUQTIPYMV-CYBMUJFWSA-N -1 3 341.885 4.429 20 0 EIADHM CC(C)c1nn(C)c2sc(C(=O)Nc3c([O-])cccc3Cl)cc12 ZINC000581636272 1023466585 /nfs/dbraw/zinc/46/65/85/1023466585.db2.gz QFLSBOITVHPZJG-UHFFFAOYSA-N -1 3 349.843 4.370 20 0 EIADHM C[C@@H]1c2c(F)cccc2CCN1Cc1cc(=O)[n-]c(-c2ccccc2)n1 ZINC001167475276 1023466698 /nfs/dbraw/zinc/46/66/98/1023466698.db2.gz YXVAMWHPKKEVJS-CQSZACIVSA-N -1 3 349.409 4.108 20 0 EIADHM C[C@H](NCc1c(F)ccc([O-])c1F)c1cccc(OC(F)(F)F)c1 ZINC000511648798 1023473924 /nfs/dbraw/zinc/47/39/24/1023473924.db2.gz NRWGNCGTFCQIDR-VIFPVBQESA-N -1 3 347.283 4.420 20 0 EIADHM CC[C@@H](c1ccc(Cl)cc1)N1C[C@H](C(=O)[O-])C[C@H](C(F)(F)F)C1 ZINC000656757420 1023500712 /nfs/dbraw/zinc/50/07/12/1023500712.db2.gz QGJVFUMJOOUKBG-DYEKYZERSA-N -1 3 349.780 4.376 20 0 EIADHM O=C([O-])[C@@H]1CCN(Cc2cc(Cl)ccc2Cl)[C@H]2CCCC[C@H]12 ZINC000656762470 1023503514 /nfs/dbraw/zinc/50/35/14/1023503514.db2.gz BBLREQZJQNPLKR-FMKPAKJESA-N -1 3 342.266 4.459 20 0 EIADHM O=C([O-])[C@@H](c1ccc(Cl)cc1Cl)N1CCC[C@H](CCF)C1 ZINC000656763043 1023505251 /nfs/dbraw/zinc/50/52/51/1023505251.db2.gz KPRIARQMEXZQBT-QMTHXVAHSA-N -1 3 334.218 4.191 20 0 EIADHM Cc1cc(CN2CC[C@H](C(=O)[O-])[C@H]3CCCC[C@H]32)c2ccccc2n1 ZINC000656766103 1023508965 /nfs/dbraw/zinc/50/89/65/1023508965.db2.gz QCLKCVNRZJFVMK-WSTZPKSXSA-N -1 3 338.451 4.009 20 0 EIADHM O=C([O-])c1ccccc1OCCN1CCCC[C@@H]1c1ccc(F)cc1 ZINC000364246127 1023522455 /nfs/dbraw/zinc/52/24/55/1023522455.db2.gz RVHCIFLKZXGIHN-GOSISDBHSA-N -1 3 343.398 4.130 20 0 EIADHM CC[C@H]([N-]C(=O)C(F)(F)c1ncccc1C)c1cc(F)ccc1F ZINC000192592014 1023632750 /nfs/dbraw/zinc/63/27/50/1023632750.db2.gz KIFVQGDBEHEUNH-AWEZNQCLSA-N -1 3 340.320 4.028 20 0 EIADHM Cc1cc(=NC(=O)c2cc([O-])c3ccccc3c2)[nH]n1C1CCCCC1 ZINC000461090969 1023741022 /nfs/dbraw/zinc/74/10/22/1023741022.db2.gz UQNNGDHMNUDCJN-UHFFFAOYSA-N -1 3 349.434 4.230 20 0 EIADHM CC[C@H](C)Oc1ccc([N-]S(=O)(=O)c2ccc(Cl)cc2)cc1 ZINC000511696841 1023829633 /nfs/dbraw/zinc/82/96/33/1023829633.db2.gz ZLEZUGDMITVOKD-LBPRGKRZSA-N -1 3 339.844 4.318 20 0 EIADHM O=C(Nc1cccc(NC2CCCC2)c1)c1c[n-]c2ccccc2c1=O ZINC000109897124 1023848720 /nfs/dbraw/zinc/84/87/20/1023848720.db2.gz PPTQIRHUBWJONG-UHFFFAOYSA-N -1 3 347.418 4.135 20 0 EIADHM CSc1ccc([O-])c(C(=O)N(C)[C@@H](C)Cc2ccc(C)cc2)c1 ZINC000668983339 1024060404 /nfs/dbraw/zinc/06/04/04/1024060404.db2.gz WFBRZCDCMBJTBB-AWEZNQCLSA-N -1 3 329.465 4.126 20 0 EIADHM CC(C)[C@@H](NCc1nc(=O)c2sccc2[n-]1)c1ccccc1F ZINC000661486539 1024173562 /nfs/dbraw/zinc/17/35/62/1024173562.db2.gz XRIUYKZOBSPRBD-OAHLLOKOSA-N -1 3 331.416 4.023 20 0 EIADHM CC(C)CN(C(=O)c1cnc(C2CC2)[n-]c1=O)c1cccc(Cl)c1 ZINC000909378115 1024519071 /nfs/dbraw/zinc/51/90/71/1024519071.db2.gz VUXUQVHJGMWJQG-UHFFFAOYSA-N -1 3 345.830 4.016 20 0 EIADHM Cc1cccc(CCC(=O)Nc2ccc(Br)cc2[O-])c1 ZINC000048576543 1024657995 /nfs/dbraw/zinc/65/79/95/1024657995.db2.gz IBNBSKKZNSOUFM-UHFFFAOYSA-N -1 3 334.213 4.034 20 0 EIADHM Cc1cc(N2CCCC[C@@H]2C)ccc1NC(=O)c1c([O-])cccc1O ZINC000092124728 1024737994 /nfs/dbraw/zinc/73/79/94/1024737994.db2.gz OHQRLLYJZRHBKV-AWEZNQCLSA-N -1 3 340.423 4.037 20 0 EIADHM CC(C)CCOc1ccc(CN[C@H](C(=O)[O-])c2ccc(F)cc2)cc1 ZINC000426777228 1024825456 /nfs/dbraw/zinc/82/54/56/1024825456.db2.gz LPNZWQSIRBOWNK-IBGZPJMESA-N -1 3 345.414 4.166 20 0 EIADHM C[C@H](c1ccc(C(=O)[O-])o1)N1CCC(c2cccc(F)c2F)CC1 ZINC000652449634 1024838990 /nfs/dbraw/zinc/83/89/90/1024838990.db2.gz HYENGHRFQJSHEB-LLVKDONJSA-N -1 3 335.350 4.197 20 0 EIADHM Cc1cc(C(F)(F)C(=O)[N-]C(C)(C)c2cccs2)cnc1Cl ZINC001126236027 1025129406 /nfs/dbraw/zinc/12/94/06/1025129406.db2.gz PEDMSDNNRDSPFE-UHFFFAOYSA-N -1 3 344.814 4.248 20 0 EIADHM C[C@@H](/N=C/c1cc(Cl)ccc1[O-])c1ccc(N2CCOC2=O)cc1 ZINC000065829905 1025214455 /nfs/dbraw/zinc/21/44/55/1025214455.db2.gz XODYPXAXURZYPU-ZICWZVMQSA-N -1 3 344.798 4.182 20 0 EIADHM O=C(NCc1ncccc1[O-])c1ccc(-c2ccc(Cl)cc2)s1 ZINC000473630205 1025931811 /nfs/dbraw/zinc/93/18/11/1025931811.db2.gz QUCMUFLPRLJNCJ-UHFFFAOYSA-N -1 3 344.823 4.099 20 0 EIADHM [O-]c1cccc(CN2CCC3(CC(F)(F)C3)CC2)c1Br ZINC001140547752 1026078646 /nfs/dbraw/zinc/07/86/46/1026078646.db2.gz MWYOUBTUOLBPGD-UHFFFAOYSA-N -1 3 346.215 4.166 20 0 EIADHM CCc1ccc(C(=O)CCC(=O)Nc2cc(Cl)ccc2[O-])cc1 ZINC000111210905 1026098521 /nfs/dbraw/zinc/09/85/21/1026098521.db2.gz SFGAGVMNPBZDMO-UHFFFAOYSA-N -1 3 331.799 4.210 20 0 EIADHM O=C([O-])CC1(CN2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)CC1 ZINC000563278019 1026306175 /nfs/dbraw/zinc/30/61/75/1026306175.db2.gz MWMZCJGUVBVYPH-CQSZACIVSA-N -1 3 328.239 4.385 20 0 EIADHM Cc1cc(=O)[n-]c([C@@H](C)Sc2nnc(CCC3CCCCC3)o2)n1 ZINC000158176708 1026326522 /nfs/dbraw/zinc/32/65/22/1026326522.db2.gz MUAGXQMUQCPPLW-GFCCVEGCSA-N -1 3 348.472 4.240 20 0 EIADHM O=C(Nc1ccc(Br)cc1[O-])c1c[nH]c2cc(F)ccc21 ZINC000582338564 1026467570 /nfs/dbraw/zinc/46/75/70/1026467570.db2.gz WNUBRGHKLHUOPV-UHFFFAOYSA-N -1 3 349.159 4.027 20 0 EIADHM CC(C)CCOc1ccc(CNCc2ccccc2CC(=O)[O-])cc1 ZINC000426705471 1026488244 /nfs/dbraw/zinc/48/82/44/1026488244.db2.gz WQXNJJLACILJCZ-UHFFFAOYSA-N -1 3 341.451 4.028 20 0 EIADHM C[C@H](C(=O)[O-])[C@H](NCc1cc2cc(F)ccc2o1)c1ccccc1 ZINC000426714689 1026496784 /nfs/dbraw/zinc/49/67/84/1026496784.db2.gz DTWIMWTYOSRAAS-SGTLLEGYSA-N -1 3 327.355 4.124 20 0 EIADHM C[C@H](C(=O)[O-])[C@@H](NCc1cc2cc(F)ccc2o1)c1ccccc1 ZINC000426714652 1026497080 /nfs/dbraw/zinc/49/70/80/1026497080.db2.gz DTWIMWTYOSRAAS-KPZWWZAWSA-N -1 3 327.355 4.124 20 0 EIADHM O=C([O-])[C@H](CC1CCCC1)NCc1csc(-c2ccc(F)cc2)n1 ZINC000426723219 1026502848 /nfs/dbraw/zinc/50/28/48/1026502848.db2.gz KYKXLYKIQYDHFB-INIZCTEOSA-N -1 3 348.443 4.072 20 0 EIADHM O=C([O-])[C@H](NCc1ccc(OCC2CC2)cc1)c1cccc(Cl)c1 ZINC000426743129 1026525106 /nfs/dbraw/zinc/52/51/06/1026525106.db2.gz MWCVPEKZTNQDTB-GOSISDBHSA-N -1 3 345.826 4.044 20 0 EIADHM CC(C)(CC(=O)Nc1cccc([O-])c1F)CC(=O)c1ccccc1 ZINC000582399188 1026578994 /nfs/dbraw/zinc/57/89/94/1026578994.db2.gz KZDFZRUSAULGRL-UHFFFAOYSA-N -1 3 329.371 4.159 20 0 EIADHM COc1ccc([C@@H]2CCCN2Cc2cccc([O-])c2Cl)cc1OC ZINC000507081490 1026633613 /nfs/dbraw/zinc/63/36/13/1026633613.db2.gz JXYCYJJMDZDIFY-HNNXBMFYSA-N -1 3 347.842 4.400 20 0 EIADHM CCOC(=O)c1c(C(C)C)csc1[N-]C(=O)c1cc(C2CC2)no1 ZINC000440486488 1026654833 /nfs/dbraw/zinc/65/48/33/1026654833.db2.gz YMZAUAVXAYKZNY-UHFFFAOYSA-N -1 3 348.424 4.166 20 0 EIADHM Cc1ccccc1-c1cc(=NC(=O)C[C@H](C)c2ccc(F)cc2)[nH][n-]1 ZINC000512316872 1026679164 /nfs/dbraw/zinc/67/91/64/1026679164.db2.gz PWLCIIBSZSTOBM-AWEZNQCLSA-N -1 3 337.398 4.078 20 0 EIADHM O=C([N-]c1nc(C2CCC2)cs1)c1c(F)c(F)cc(F)c1F ZINC000277676469 1026767733 /nfs/dbraw/zinc/76/77/33/1026767733.db2.gz KZVULWWBDMFZGB-UHFFFAOYSA-N -1 3 330.306 4.219 20 0 EIADHM Cc1ccc(C(=O)C2CCN(Cc3c(F)ccc([O-])c3F)CC2)cc1 ZINC000507647606 1026860449 /nfs/dbraw/zinc/86/04/49/1026860449.db2.gz BUUMLUPLDIWPFI-UHFFFAOYSA-N -1 3 345.389 4.074 20 0 EIADHM [O-]c1cccc(CN2CCC(OCCc3ccccc3)CC2)c1Cl ZINC000507653078 1026862934 /nfs/dbraw/zinc/86/29/34/1026862934.db2.gz KFCOSWVHDZZFJK-UHFFFAOYSA-N -1 3 345.870 4.269 20 0 EIADHM Cc1cccc(NC2CCN(C(=O)c3cc([O-])ccc3Cl)CC2)c1 ZINC000277777952 1026918768 /nfs/dbraw/zinc/91/87/68/1026918768.db2.gz UBLTTZZRBNTLEN-UHFFFAOYSA-N -1 3 344.842 4.071 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N3CCC(CC)(CC)CC3)nc2)n1 ZINC000302461167 1027313310 /nfs/dbraw/zinc/31/33/10/1027313310.db2.gz OXCUQAPEZDJFSE-UHFFFAOYSA-N -1 3 340.471 4.213 20 0 EIADHM Fc1ccccc1[N-]c1nnc(Sc2ncncc2Cl)s1 ZINC000302713421 1027368362 /nfs/dbraw/zinc/36/83/62/1027368362.db2.gz MCUMCMIOPIMKCJ-UHFFFAOYSA-N -1 3 339.808 4.015 20 0 EIADHM O=C(CCCc1ccccc1)[N-]OCc1cccc(C(F)(F)F)c1 ZINC000303297312 1027533453 /nfs/dbraw/zinc/53/34/53/1027533453.db2.gz YDMFHCZCSXOGOF-UHFFFAOYSA-N -1 3 337.341 4.276 20 0 EIADHM C[C@H]1CCN(Cc2nc3c4ccccc4oc3c(=O)[n-]2)CC12CCC2 ZINC000329154774 1027612700 /nfs/dbraw/zinc/61/27/00/1027612700.db2.gz UTZAXUQVUKEMQF-ZDUSSCGKSA-N -1 3 337.423 4.094 20 0 EIADHM CCN(C(=O)c1ccccc1[O-])[C@H](c1ccc(C)cc1)c1cccnc1 ZINC000112822276 1027655952 /nfs/dbraw/zinc/65/59/52/1027655952.db2.gz TWRKQDITGIAITE-OAQYLSRUSA-N -1 3 346.430 4.347 20 0 EIADHM COc1ccc2cc(CNC(=O)c3cc([O-])ccc3Cl)ccc2c1 ZINC000431508407 1027747119 /nfs/dbraw/zinc/74/71/19/1027747119.db2.gz RCIUHYQZVSAZNR-UHFFFAOYSA-N -1 3 341.794 4.137 20 0 EIADHM CC(=O)c1ccc(C(=O)N2CC[C@@H](C)Sc3ccccc32)cc1[O-] ZINC000665859425 1027789757 /nfs/dbraw/zinc/78/97/57/1027789757.db2.gz UMARQGCBODOQHZ-GFCCVEGCSA-N -1 3 341.432 4.126 20 0 EIADHM CC(C)c1ccc([C@H](C)CC(=O)Nc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000523152196 1027846004 /nfs/dbraw/zinc/84/60/04/1027846004.db2.gz TYNFWCLLMPLNHE-CQSZACIVSA-N -1 3 349.438 4.122 20 0 EIADHM CC(C)c1ccc([C@H](C)CC(=O)Nc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000523152196 1027846020 /nfs/dbraw/zinc/84/60/20/1027846020.db2.gz TYNFWCLLMPLNHE-CQSZACIVSA-N -1 3 349.438 4.122 20 0 EIADHM O=C(Nc1ccc(Cl)cc1[O-])c1cccc(Br)c1F ZINC000192192579 1027897658 /nfs/dbraw/zinc/89/76/58/1027897658.db2.gz LBAZJZMVNFZIER-UHFFFAOYSA-N -1 3 344.567 4.200 20 0 EIADHM COc1ccc(NCc2cc(=O)oc3c(C)c([O-])ccc23)cc1Cl ZINC000007389810 1027922039 /nfs/dbraw/zinc/92/20/39/1027922039.db2.gz PQMWUJSSKMZYQN-UHFFFAOYSA-N -1 3 345.782 4.081 20 0 EIADHM CC(C)c1ccc([C@H](C)CC(=O)N=c2cc(-c3ccncc3)[n-][nH]2)cc1 ZINC000523409190 1028065937 /nfs/dbraw/zinc/06/59/37/1028065937.db2.gz MGRYWGSEWYNFET-OAHLLOKOSA-N -1 3 348.450 4.149 20 0 EIADHM O=C1c2ccccc2N[C@@H](c2ccc([O-])cc2F)N1Cc1ccccc1 ZINC000639400667 1028184929 /nfs/dbraw/zinc/18/49/29/1028184929.db2.gz DBXWWXDMMICPCM-HXUWFJFHSA-N -1 3 348.377 4.298 20 0 EIADHM CN(C(=O)NCc1ccc([O-])c(F)c1)[C@@H]1CCC[C@@H]1c1ccccc1 ZINC000458426860 1028236564 /nfs/dbraw/zinc/23/65/64/1028236564.db2.gz UBGUFYSVYVDMLU-SJLPKXTDSA-N -1 3 342.414 4.009 20 0 EIADHM O=C([O-])CC[C@H]1CCCCN1Cc1ncc(-c2cccc(Cl)c2)o1 ZINC000324282672 1028237331 /nfs/dbraw/zinc/23/73/31/1028237331.db2.gz PGIQQUKMRFZNFD-OAHLLOKOSA-N -1 3 348.830 4.214 20 0 EIADHM Cc1ccc(-c2nc(-c3ccc(Br)cc3F)no2)c([O-])c1 ZINC000445457788 1028612711 /nfs/dbraw/zinc/61/27/11/1028612711.db2.gz RPFGEOKJOWHFCC-UHFFFAOYSA-N -1 3 349.159 4.319 20 0 EIADHM O=C(CCSc1cccc(Cl)c1)Nc1cccc([O-])c1F ZINC000583416828 1028704555 /nfs/dbraw/zinc/70/45/55/1028704555.db2.gz HOPNJTMFYMQHIG-UHFFFAOYSA-N -1 3 325.792 4.306 20 0 EIADHM COc1cc(-c2nc3cnc(C(F)(F)F)cc3[nH]2)cc(Cl)c1[O-] ZINC000583673085 1029022075 /nfs/dbraw/zinc/02/20/75/1029022075.db2.gz CRGZIZJJLJHLAJ-UHFFFAOYSA-N -1 3 343.692 4.011 20 0 EIADHM CCC1(CC)[C@H](OC)C[C@H]1N(C)Cc1cccc(C(=O)[O-])c1Cl ZINC000583877689 1029312383 /nfs/dbraw/zinc/31/23/83/1029312383.db2.gz VHBVXGZHTDHYCV-HUUCEWRRSA-N -1 3 339.863 4.064 20 0 EIADHM Cc1noc(C(C)C)c1[N-]C(=O)c1cc(C(F)(F)F)cnc1Cl ZINC000928786510 1029436478 /nfs/dbraw/zinc/43/64/78/1029436478.db2.gz DFRZRJKACDAOLM-UHFFFAOYSA-N -1 3 347.724 4.426 20 0 EIADHM CC(C)[C@H]1CCCN1Cc1csc(-c2cccc(C(=O)[O-])c2)n1 ZINC000583999697 1029487306 /nfs/dbraw/zinc/48/73/06/1029487306.db2.gz VAEIXVDZCVDKOQ-MRXNPFEDSA-N -1 3 330.453 4.129 20 0 EIADHM Cc1ccc(C)c(NC(=O)NCc2ccc([O-])c(Br)c2)c1 ZINC000151384260 1029501423 /nfs/dbraw/zinc/50/14/23/1029501423.db2.gz BYPAOUIIYCJOTI-UHFFFAOYSA-N -1 3 349.228 4.093 20 0 EIADHM Cc1ccc(NC(=O)NCc2ccc([O-])c(Br)c2)c(C)c1 ZINC000151466149 1029529915 /nfs/dbraw/zinc/52/99/15/1029529915.db2.gz OBTSNMGCRZZIEP-UHFFFAOYSA-N -1 3 349.228 4.093 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(NC[C@@H](C)c3cccc(C)c3)nc2)n1 ZINC000301364622 1029716638 /nfs/dbraw/zinc/71/66/38/1029716638.db2.gz QFIJFLPNGXLDOY-OAHLLOKOSA-N -1 3 348.450 4.331 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@@H]3CCC[C@@H](C)[C@H]3C)nc2)n1 ZINC000301490394 1029742516 /nfs/dbraw/zinc/74/25/16/1029742516.db2.gz ARIORJDUXZHVSS-XJKCOSOUSA-N -1 3 326.444 4.043 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-][C@H](CC(F)(F)F)c2ccccc2)s1 ZINC000056127954 1029748914 /nfs/dbraw/zinc/74/89/14/1029748914.db2.gz DRMINLFPDKLEJA-GFCCVEGCSA-N -1 3 349.399 4.029 20 0 EIADHM COc1ccc(Cl)cc1S(=O)(=O)[N-]c1ccc(C)cc1Cl ZINC000447257536 1029945273 /nfs/dbraw/zinc/94/52/73/1029945273.db2.gz BGUPVDQFHPPSGY-UHFFFAOYSA-N -1 3 346.235 4.111 20 0 EIADHM Cc1cc(C)cc(CSCc2noc(-c3ccccc3[O-])n2)c1 ZINC000447360369 1030035762 /nfs/dbraw/zinc/03/57/62/1030035762.db2.gz UUWALPVOJLZSGN-UHFFFAOYSA-N -1 3 326.421 4.492 20 0 EIADHM O=C([O-])c1ccccc1OCCN1CCC[C@H]1c1ccc(Cl)cc1 ZINC000183914374 1030041674 /nfs/dbraw/zinc/04/16/74/1030041674.db2.gz XLRWPQTXMUURTE-KRWDZBQOSA-N -1 3 345.826 4.254 20 0 EIADHM Cc1ccc(-c2csc(CN3[C@H](C)C[C@@H](C(=O)[O-])C[C@@H]3C)n2)cc1 ZINC000530173738 1030190808 /nfs/dbraw/zinc/19/08/08/1030190808.db2.gz GZWDOAVMBUTSSZ-MIFYACCESA-N -1 3 344.480 4.192 20 0 EIADHM O=S(=O)([N-]c1cc(Cl)ccc1Cl)c1ccccc1Cl ZINC000006315861 1030282928 /nfs/dbraw/zinc/28/29/28/1030282928.db2.gz OGIDEJRXRKCZJJ-UHFFFAOYSA-N -1 3 336.627 4.448 20 0 EIADHM CC(C)[C@@H]1CN(C(=O)NCc2ccc([O-])c(F)c2)c2ccccc21 ZINC000447766258 1030324484 /nfs/dbraw/zinc/32/44/84/1030324484.db2.gz GJWBIRCPAKTWIJ-HNNXBMFYSA-N -1 3 328.387 4.001 20 0 EIADHM O=[S@](Cc1nc(-c2ccccc2Cl)cs1)c1ccc([O-])cc1 ZINC000187067409 1030327495 /nfs/dbraw/zinc/32/74/95/1030327495.db2.gz OXMRILZYAPPOSC-JOCHJYFZSA-N -1 3 349.864 4.477 20 0 EIADHM C[C@H](CCC[C@@H](C)C(=O)[O-])NCc1csc(-c2ccccc2)n1 ZINC000321391222 1030335727 /nfs/dbraw/zinc/33/57/27/1030335727.db2.gz WSGVRSMBBFXEKW-ZIAGYGMSSA-N -1 3 332.469 4.179 20 0 EIADHM CN(Cc1cccc([O-])c1Cl)[C@H]1CCCN(c2ccccc2)C1 ZINC000508645792 1030512014 /nfs/dbraw/zinc/51/20/14/1030512014.db2.gz PEJNVNZVPSJLDS-KRWDZBQOSA-N -1 3 330.859 4.146 20 0 EIADHM O=C(NCCc1ccc(C(F)(F)F)cc1)c1cc([O-])ccc1Cl ZINC000685562660 1030515343 /nfs/dbraw/zinc/51/53/43/1030515343.db2.gz KSZBFCGWCJWHSK-UHFFFAOYSA-N -1 3 343.732 4.037 20 0 EIADHM CC(C)c1ccc(CCNC(=O)CCCc2ccc([O-])c(F)c2)cc1 ZINC000527286921 1030612286 /nfs/dbraw/zinc/61/22/86/1030612286.db2.gz DIACMEPJYDLYRZ-UHFFFAOYSA-N -1 3 343.442 4.336 20 0 EIADHM O=C(Nc1cc(Br)ccc1[O-])c1ccc(Cl)cc1 ZINC000530678753 1030648182 /nfs/dbraw/zinc/64/81/82/1030648182.db2.gz YJMCANGHQPNBQN-UHFFFAOYSA-N -1 3 326.577 4.060 20 0 EIADHM CCc1cccc(C(=O)N2CC[C@@H](c3ccc(Cl)cc3)C2)c1[O-] ZINC000530715785 1030667503 /nfs/dbraw/zinc/66/75/03/1030667503.db2.gz ASTBICMTCZHXSA-OAHLLOKOSA-N -1 3 329.827 4.238 20 0 EIADHM O=C(Nc1cc(F)ccc1[O-])c1cccc(OCc2cccs2)c1 ZINC000530897275 1030786363 /nfs/dbraw/zinc/78/63/63/1030786363.db2.gz UREWGLWFVCXUGD-UHFFFAOYSA-N -1 3 343.379 4.424 20 0 EIADHM C[C@H](NCc1cccc(C(=O)[O-])c1)c1ccc(OCC2CC2)c(F)c1 ZINC000263403077 1030851966 /nfs/dbraw/zinc/85/19/66/1030851966.db2.gz IVGBDZFWRWPZRT-ZDUSSCGKSA-N -1 3 343.398 4.164 20 0 EIADHM CN(C(=O)c1cc(F)cc2n[n-]nc21)c1ccc(-c2ccccc2)cc1 ZINC000548864475 1030912664 /nfs/dbraw/zinc/91/26/64/1030912664.db2.gz MRTFTTXRBUNKHA-UHFFFAOYSA-N -1 3 346.365 4.041 20 0 EIADHM CCC1([N-]S(=O)(=O)c2cc(Cl)ccc2Cl)CCCCC1 ZINC001211915811 1030947914 /nfs/dbraw/zinc/94/79/14/1030947914.db2.gz JILGMOUOOIPROY-UHFFFAOYSA-N -1 3 336.284 4.385 20 0 EIADHM Cc1cc([C@@H](C)NC(=O)CCCc2ccc([O-])c(F)c2)ccc1F ZINC000452320647 1030972088 /nfs/dbraw/zinc/97/20/88/1030972088.db2.gz WBYSTLJVXFJVFB-CYBMUJFWSA-N -1 3 333.378 4.179 20 0 EIADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)[C@@]3(C)CCC[C@H]3C)c2)n1 ZINC000448724384 1030989634 /nfs/dbraw/zinc/98/96/34/1030989634.db2.gz KZTBWRVIZDBOLZ-XCLFUZPHSA-N -1 3 339.439 4.176 20 0 EIADHM Cc1ccc(CN2CCC(c3ccccc3C(=O)[O-])CC2)cc1F ZINC000666586427 1031041972 /nfs/dbraw/zinc/04/19/72/1031041972.db2.gz QKRNVPUTYGDFIR-UHFFFAOYSA-N -1 3 327.399 4.212 20 0 EIADHM CC[C@H](C)c1ccc(S(=O)(=O)[N-]c2ccc(C)c(O)c2C)cc1 ZINC000614822486 1031078645 /nfs/dbraw/zinc/07/86/45/1031078645.db2.gz XMBXKXWIUHSKEJ-LBPRGKRZSA-N -1 3 333.453 4.323 20 0 EIADHM CC[C@@H](C)c1ccc(S(=O)(=O)[N-]c2ccc(C)c(O)c2C)cc1 ZINC000614822481 1031079044 /nfs/dbraw/zinc/07/90/44/1031079044.db2.gz XMBXKXWIUHSKEJ-GFCCVEGCSA-N -1 3 333.453 4.323 20 0 EIADHM CN(Cc1ccc(C(=O)[O-])cc1Br)C1CCCCCC1 ZINC000226720393 1031104224 /nfs/dbraw/zinc/10/42/24/1031104224.db2.gz OPHKLXZPOWZVSH-UHFFFAOYSA-N -1 3 340.261 4.302 20 0 EIADHM C[C@H](Nc1ccc(CCO)cc1)c1cc(Cl)c(Cl)cc1[O-] ZINC000193101648 1031153575 /nfs/dbraw/zinc/15/35/75/1031153575.db2.gz LZXKKZRGPNSNLJ-JTQLQIEISA-N -1 3 326.223 4.407 20 0 EIADHM Cc1c(Cl)cccc1S(=O)(=O)[N-]c1ccc(OC(C)C)cc1 ZINC000614826486 1031191021 /nfs/dbraw/zinc/19/10/21/1031191021.db2.gz RFHVWJNSNDORLL-UHFFFAOYSA-N -1 3 339.844 4.236 20 0 EIADHM CCc1ccc([O-])c(C(=O)N2[C@H](C)[C@@H](CC(F)(F)F)C[C@@H]2C)c1 ZINC000452648722 1031213475 /nfs/dbraw/zinc/21/34/75/1031213475.db2.gz ADXZCKMSPQHWQF-DMDPSCGWSA-N -1 3 329.362 4.146 20 0 EIADHM CCc1cccc(S(=O)(=O)[N-]c2ccc(OC(C)C)cc2C)c1 ZINC000531432882 1031228779 /nfs/dbraw/zinc/22/87/79/1031228779.db2.gz HYKBOKMSFPPGMU-UHFFFAOYSA-N -1 3 333.453 4.145 20 0 EIADHM CC(C)Sc1ccc([C@@H](C)NC(=O)Cc2ccc([O-])c(F)c2)cc1 ZINC000448910471 1031264260 /nfs/dbraw/zinc/26/42/60/1031264260.db2.gz JZPWRFLRRNILAT-CYBMUJFWSA-N -1 3 347.455 4.452 20 0 EIADHM CCCOC1(c2noc(Cc3ccc([O-])c(F)c3)n2)CCCCC1 ZINC000453179288 1031654388 /nfs/dbraw/zinc/65/43/88/1031654388.db2.gz JDXZQNRPFOBWSB-UHFFFAOYSA-N -1 3 334.391 4.091 20 0 EIADHM O=c1cc(CNc2ccc(OC3CCCC3)c(F)c2)nc(C2CC2)[n-]1 ZINC000841696387 1031729333 /nfs/dbraw/zinc/72/93/33/1031729333.db2.gz YGYKNNFEFAJFOW-UHFFFAOYSA-N -1 3 343.402 4.132 20 0 EIADHM CO[C@@H](Cc1ccccc1)c1noc(-c2ccc(C(C)C)cc2[O-])n1 ZINC000453224531 1031742549 /nfs/dbraw/zinc/74/25/49/1031742549.db2.gz LVFSGWYUFSDEFW-SFHVURJKSA-N -1 3 338.407 4.496 20 0 EIADHM C[C@@H](c1cccs1)N(C)Cc1cccc([O-])c1Br ZINC000459304193 1031751495 /nfs/dbraw/zinc/75/14/95/1031751495.db2.gz NMMKZJOGQRJIGO-JTQLQIEISA-N -1 3 326.259 4.409 20 0 EIADHM CC(C)c1ncc(C(=O)[N-]c2nnc(-c3ccsc3)s2)s1 ZINC000130192529 1031827267 /nfs/dbraw/zinc/82/72/67/1031827267.db2.gz KBLZGZMSOGPUBN-UHFFFAOYSA-N -1 3 336.467 4.099 20 0 EIADHM O=C(Nc1ccc2ccc(Cl)cc2n1)c1cc([O-])ccc1Cl ZINC000512771483 1033901962 /nfs/dbraw/zinc/90/19/62/1033901962.db2.gz XBAZFNKTDJTACZ-UHFFFAOYSA-N -1 3 333.174 4.500 20 0 EIADHM C[C@H]1C[C@@]1(NC(=O)c1cc([O-])ccc1Cl)c1ccc(Cl)cc1 ZINC000512787833 1033947926 /nfs/dbraw/zinc/94/79/26/1033947926.db2.gz LEHLEGABNLWLCO-BTDLBPIBSA-N -1 3 336.218 4.364 20 0 EIADHM CCCCOc1ccccc1NC(=O)c1ccc(C(C)=O)c([O-])c1 ZINC000411560826 1033981033 /nfs/dbraw/zinc/98/10/33/1033981033.db2.gz KOVZLTQTWXYWKB-UHFFFAOYSA-N -1 3 327.380 4.026 20 0 EIADHM C[C@@H](S[C@H]1CCOC1)c1nc(=O)c2c(-c3ccco3)csc2[n-]1 ZINC000419352079 1034401582 /nfs/dbraw/zinc/40/15/82/1034401582.db2.gz AGNIUDXLUVAUHP-ZJUUUORDSA-N -1 3 348.449 4.240 20 0 EIADHM [O-]c1cccc(CN2CCC(c3ncccc3Cl)CC2)c1Cl ZINC000513240774 1034855831 /nfs/dbraw/zinc/85/58/31/1034855831.db2.gz CYMZMPSTAAUBBC-UHFFFAOYSA-N -1 3 337.250 4.474 20 0 EIADHM CC(C)Sc1cccc(Cl)c1CN1CCC[C@H](C(=O)[O-])C1 ZINC000263380839 1034879827 /nfs/dbraw/zinc/87/98/27/1034879827.db2.gz BOVDBADOCFOYKD-LBPRGKRZSA-N -1 3 327.877 4.137 20 0 EIADHM Cc1ccc2oc([N-][C@@H](c3nccn3C)c3ccccc3F)nc2c1 ZINC000513650440 1035078951 /nfs/dbraw/zinc/07/89/51/1035078951.db2.gz NGZCQFAJLRVJBY-QGZVFWFLSA-N -1 3 336.370 4.210 20 0 EIADHM Cc1ccc([O-])c(NC(=O)c2cc(-c3ccccn3)ccc2Cl)n1 ZINC000345926281 1035332596 /nfs/dbraw/zinc/33/25/96/1035332596.db2.gz BDENJNMHKSUORA-UHFFFAOYSA-N -1 3 339.782 4.063 20 0 EIADHM O=C(Nc1cc(Br)ccc1[O-])c1nc2ccccc2s1 ZINC000501752203 1035568159 /nfs/dbraw/zinc/56/81/59/1035568159.db2.gz VIFYTUGOOFDZJK-UHFFFAOYSA-N -1 3 349.209 4.017 20 0 EIADHM O=C(Cc1c[nH]c2cccc(Cl)c12)Nc1ccc(Cl)cc1[O-] ZINC000490645131 1035568149 /nfs/dbraw/zinc/56/81/49/1035568149.db2.gz AKZCMWUHSNBABH-UHFFFAOYSA-N -1 3 335.190 4.362 20 0 EIADHM CC(C)c1ccc(-c2nc3cc(Cl)c(Cl)cc3c(=O)[n-]2)cn1 ZINC000485357449 1035840293 /nfs/dbraw/zinc/84/02/93/1035840293.db2.gz LVKIDOLKYIKZRI-UHFFFAOYSA-N -1 3 334.206 4.415 20 0 EIADHM COc1cc(-c2nc3cc(Cl)c(Cl)cc3c(=O)[n-]2)ccc1C ZINC000485371954 1035851500 /nfs/dbraw/zinc/85/15/00/1035851500.db2.gz RWGUWWNOXUCMHX-UHFFFAOYSA-N -1 3 335.190 4.214 20 0 EIADHM CCN(C(=O)c1c[n-]c(=NC(=O)OC(C)(C)C)s1)c1ccccc1 ZINC000906057983 1036047590 /nfs/dbraw/zinc/04/75/90/1036047590.db2.gz OVUQRFWAIKHNSD-UHFFFAOYSA-N -1 3 347.440 4.157 20 0 EIADHM O=C(Nc1c([O-])cccc1Cl)c1cc(-c2ccccc2Cl)[nH]n1 ZINC000571666088 1036104875 /nfs/dbraw/zinc/10/48/75/1036104875.db2.gz QSWGQPUCEQLEAU-UHFFFAOYSA-N -1 3 348.189 4.341 20 0 EIADHM CC(C)[C@@]1(C(=O)[O-])CCN(Cc2csc(C3CCCCC3)n2)C1 ZINC000572048833 1036403018 /nfs/dbraw/zinc/40/30/18/1036403018.db2.gz ISCQLOWSLSPMCY-GOSISDBHSA-N -1 3 336.501 4.124 20 0 EIADHM O=c1cc(C=Cc2csc(-c3ccsc3)n2)nc(C2CC2)[n-]1 ZINC000485977059 1036405620 /nfs/dbraw/zinc/40/56/20/1036405620.db2.gz MMSQHNJQBSVVTL-ARJAWSKDSA-N -1 3 327.434 4.415 20 0 EIADHM O=C([O-])[C@@H](c1c(F)cccc1Cl)N1CCC[C@@]2(CC=CCC2)C1 ZINC000572127905 1036439111 /nfs/dbraw/zinc/43/91/11/1036439111.db2.gz ZBVJPSISMDXFEN-AEFFLSMTSA-N -1 3 337.822 4.427 20 0 EIADHM CCS[C@@H]1CC[C@@H](N(C)C(=O)c2cc([O-])cc(C(F)(F)F)c2)C1 ZINC000598691308 1036751896 /nfs/dbraw/zinc/75/18/96/1036751896.db2.gz UHVVCASSOQZPRO-TZMCWYRMSA-N -1 3 347.402 4.157 20 0 EIADHM CC1(C)CCC(C)(C[N-]S(=O)(=O)c2ccc(Cl)s2)CC1 ZINC001212180264 1036811491 /nfs/dbraw/zinc/81/14/91/1036811491.db2.gz UMHVTKMLIYPHBO-UHFFFAOYSA-N -1 3 335.922 4.286 20 0 EIADHM O=C(c1cc(CCc2ccccc2)ccc1[O-])N1CCC2(CC2)CC1 ZINC000599114613 1036884826 /nfs/dbraw/zinc/88/48/26/1036884826.db2.gz YATZYWYNUXXSMF-UHFFFAOYSA-N -1 3 335.447 4.194 20 0 EIADHM CC[C@@H]1CCCN1Cc1nc(=O)c2c(-c3ccco3)csc2[n-]1 ZINC000590062052 1036967854 /nfs/dbraw/zinc/96/78/54/1036967854.db2.gz PWVHVSVWTIJGRS-LLVKDONJSA-N -1 3 329.425 4.031 20 0 EIADHM Cc1sc([N-]C(=O)c2cc(F)c(Cl)nc2Cl)c(C#N)c1C ZINC000057776810 1037211186 /nfs/dbraw/zinc/21/11/86/1037211186.db2.gz LEJRNQAJAHOFII-UHFFFAOYSA-N -1 3 344.198 4.330 20 0 EIADHM CSc1ccc([O-])c(C(=O)N2C[C@H](c3ccccc3)C[C@H]2C)c1 ZINC000668808115 1037288801 /nfs/dbraw/zinc/28/88/01/1037288801.db2.gz NICUXXHMXMURGJ-UKRRQHHQSA-N -1 3 327.449 4.132 20 0 EIADHM CSc1ccc([O-])c(C(=O)N2C[C@@H](c3ccccc3)C[C@H]2C)c1 ZINC000668808114 1037289591 /nfs/dbraw/zinc/28/95/91/1037289591.db2.gz NICUXXHMXMURGJ-HIFRSBDPSA-N -1 3 327.449 4.132 20 0 EIADHM O=C(CCc1cc(Cl)cc(Cl)c1)NCc1ccc([O-])c(F)c1 ZINC000488215151 1037418978 /nfs/dbraw/zinc/41/89/78/1037418978.db2.gz GMBBSWDBPJZBBX-UHFFFAOYSA-N -1 3 342.197 4.087 20 0 EIADHM CCc1csc([C@H](C)NC(=O)c2cc3sccc3c([O-])c2)n1 ZINC000910735455 1037481022 /nfs/dbraw/zinc/48/10/22/1037481022.db2.gz SHNRZSGEXJTSEP-VIFPVBQESA-N -1 3 332.450 4.117 20 0 EIADHM Cc1ccc(C[N-]C(=O)C(F)(F)C(F)F)c(O[C@@H](C)CC(C)C)c1 ZINC001127141099 1037682790 /nfs/dbraw/zinc/68/27/90/1037682790.db2.gz NVIPCEHHCKZZLW-LBPRGKRZSA-N -1 3 349.368 4.325 20 0 EIADHM CCc1ccc([O-])c(C(=O)N2C[C@@H](c3ccc(F)cc3)C[C@@H]2C)c1 ZINC000605896432 1037870074 /nfs/dbraw/zinc/87/00/74/1037870074.db2.gz DCHCONOZPLIJSU-BBRMVZONSA-N -1 3 327.399 4.112 20 0 EIADHM CCc1ccc([O-])c(C(=O)N2C[C@@H](c3ccc(F)cc3)C[C@H]2C)c1 ZINC000605896433 1037871210 /nfs/dbraw/zinc/87/12/10/1037871210.db2.gz DCHCONOZPLIJSU-CJNGLKHVSA-N -1 3 327.399 4.112 20 0 EIADHM CSc1ccc([O-])c(C(=O)N2C[C@@H](c3ccc(F)cc3)C[C@H]2C)c1 ZINC000668944200 1037941727 /nfs/dbraw/zinc/94/17/27/1037941727.db2.gz FLPHTBUGEOYDSB-OCCSQVGLSA-N -1 3 345.439 4.271 20 0 EIADHM O=c1[n-]c(SCCC2CCCC2)nc2c1cnn2-c1ccccc1 ZINC000607435898 1038127770 /nfs/dbraw/zinc/12/77/70/1038127770.db2.gz BRQIQPZDBWTOCX-UHFFFAOYSA-N -1 3 340.452 4.194 20 0 EIADHM CC(C)c1ccc([C@H](C)CC(=O)NCc2ccc([O-])c(F)c2)cc1 ZINC000606536749 1038153073 /nfs/dbraw/zinc/15/30/73/1038153073.db2.gz ZYDVEIIQRMAYHJ-CQSZACIVSA-N -1 3 329.415 4.465 20 0 EIADHM COc1cc(C)c([N-]S(=O)(=O)c2ccc(C3CC3)cc2)c(C)c1C ZINC000574520466 1038285439 /nfs/dbraw/zinc/28/54/39/1038285439.db2.gz WIJBEFDJLWEHQN-UHFFFAOYSA-N -1 3 345.464 4.299 20 0 EIADHM O=C(Nc1ccc(Br)cc1[O-])c1cnc2ccsc2c1 ZINC000607888587 1038386354 /nfs/dbraw/zinc/38/63/54/1038386354.db2.gz JTLBSNQXZWPJLK-UHFFFAOYSA-N -1 3 349.209 4.017 20 0 EIADHM CC[C@H](c1ccccc1)S(=O)(=O)c1nc(C)c(-c2ccccc2)[n-]1 ZINC000490439012 1038641909 /nfs/dbraw/zinc/64/19/09/1038641909.db2.gz AHZUMXXPWHDAEO-QGZVFWFLSA-N -1 3 340.448 4.310 20 0 EIADHM CC[C@H](c1ccccc1)S(=O)(=O)c1nc(-c2ccccc2)c(C)[n-]1 ZINC000490439012 1038641915 /nfs/dbraw/zinc/64/19/15/1038641915.db2.gz AHZUMXXPWHDAEO-QGZVFWFLSA-N -1 3 340.448 4.310 20 0 EIADHM CC(C)Oc1ccc(CN2CCCC[C@@H]2CCC(=O)[O-])cc1Cl ZINC000424254327 1038756158 /nfs/dbraw/zinc/75/61/58/1038756158.db2.gz GNJMLBAZRGXNCM-OAHLLOKOSA-N -1 3 339.863 4.347 20 0 EIADHM Cc1ccc(Br)cc1C(=O)Nc1cc(Cl)ccc1[O-] ZINC000608354708 1038800947 /nfs/dbraw/zinc/80/09/47/1038800947.db2.gz RKVRJKYECQLQMM-UHFFFAOYSA-N -1 3 340.604 4.369 20 0 EIADHM O=C([N-]c1nc2ccsc2s1)c1c(F)c(F)cc(F)c1F ZINC000480849415 1038843684 /nfs/dbraw/zinc/84/36/84/1038843684.db2.gz USBORQLUPYHLCI-UHFFFAOYSA-N -1 3 332.303 4.167 20 0 EIADHM CCCc1ccc(S(=O)(=O)[N-]c2ccc(CSC)cc2)cc1 ZINC000608955578 1038989501 /nfs/dbraw/zinc/98/95/01/1038989501.db2.gz AIWVSOWXJQEFPN-UHFFFAOYSA-N -1 3 335.494 4.303 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1ccccc1OC(F)(F)F ZINC000539327244 1038990341 /nfs/dbraw/zinc/99/03/41/1038990341.db2.gz XPFJILQAKGLULB-UHFFFAOYSA-N -1 3 331.677 4.197 20 0 EIADHM CCCc1ccc(S(=O)(=O)[N-]c2ccc(CCSC)cc2)cc1 ZINC000609015587 1038992900 /nfs/dbraw/zinc/99/29/00/1038992900.db2.gz BANGNRUXKGFOPJ-UHFFFAOYSA-N -1 3 349.521 4.345 20 0 EIADHM CC(=O)c1cccc(NC(=O)CCc2ccc(-c3ccccc3)o2)c1[O-] ZINC000552287593 1039344006 /nfs/dbraw/zinc/34/40/06/1039344006.db2.gz WTGFFMGLVXJLHZ-UHFFFAOYSA-N -1 3 349.386 4.426 20 0 EIADHM Cc1cc(S(=O)(=O)[N-]c2cccc(Cl)c2Cl)c(C)s1 ZINC000216471493 1039424484 /nfs/dbraw/zinc/42/44/84/1039424484.db2.gz UZHAMEANZMUGMR-UHFFFAOYSA-N -1 3 336.265 4.473 20 0 EIADHM Cc1ccc(Cl)c(O[C@@H](C)C(=O)Nc2c([O-])cccc2Cl)c1 ZINC000552433567 1039510792 /nfs/dbraw/zinc/51/07/92/1039510792.db2.gz PVPHLHXEMSIEEG-JTQLQIEISA-N -1 3 340.206 4.413 20 0 EIADHM O=C(Nc1ccc(Cl)cc1[O-])c1cc(C(F)(F)F)ccc1F ZINC000534703785 1039714217 /nfs/dbraw/zinc/71/42/17/1039714217.db2.gz DDNNFKLBVRNCTJ-UHFFFAOYSA-N -1 3 333.668 4.456 20 0 EIADHM O=C(Cc1ccc([O-])c(F)c1)N[C@@H]1CC[C@H](c2cccc(Cl)c2)C1 ZINC000457076752 1039830515 /nfs/dbraw/zinc/83/05/15/1039830515.db2.gz KZPBDYXSQROYAD-GOEBONIOSA-N -1 3 347.817 4.180 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)N1CC[C@@H]1c1ccc(Cl)cc1 ZINC000552982999 1039895274 /nfs/dbraw/zinc/89/52/74/1039895274.db2.gz QIAACIQHTJIKJE-QGZVFWFLSA-N -1 3 347.817 4.481 20 0 EIADHM CCc1ccc([O-])c(C(=O)N(C)Cc2cccc(OC(C)C)c2)c1 ZINC000535242616 1040089393 /nfs/dbraw/zinc/08/93/93/1040089393.db2.gz LALTYAQBLPQEQH-UHFFFAOYSA-N -1 3 327.424 4.014 20 0 EIADHM CCOC(=O)c1ccc(NC(=O)c2sccc2C(C)C)c([O-])c1 ZINC000089543885 1040111537 /nfs/dbraw/zinc/11/15/37/1040111537.db2.gz FXDXZWGRKUDCBO-UHFFFAOYSA-N -1 3 333.409 4.006 20 0 EIADHM C[C@H](C(=O)Nc1cc(Cl)ccc1[O-])c1cn(C)c2ccccc12 ZINC000477121837 1040244297 /nfs/dbraw/zinc/24/42/97/1040244297.db2.gz NUIOGDOXVFDRHZ-NSHDSACASA-N -1 3 328.799 4.280 20 0 EIADHM COc1ccccc1[C@@H]1CCCN1C(=O)c1cc(SC)ccc1[O-] ZINC000668101840 1040420732 /nfs/dbraw/zinc/42/07/32/1040420732.db2.gz ADRQKCXRSJJMSF-INIZCTEOSA-N -1 3 343.448 4.100 20 0 EIADHM COc1cc(C)c([N-]S(=O)(=O)c2ccc(C(C)C)cc2)cc1F ZINC000479583850 1040493494 /nfs/dbraw/zinc/49/34/94/1040493494.db2.gz XHUYTJGMGSXEGH-UHFFFAOYSA-N -1 3 337.416 4.067 20 0 EIADHM COc1cc(C)c([N-]S(=O)(=O)c2ccc3ccccc3c2)cc1C ZINC000435717338 1040576870 /nfs/dbraw/zinc/57/68/70/1040576870.db2.gz LZRJXXFOZGXHCZ-UHFFFAOYSA-N -1 3 341.432 4.266 20 0 EIADHM C[C@@H]1CCCN(Cc2csc(-c3ccc(C(=O)[O-])cc3)n2)CC1 ZINC000515305856 1040634291 /nfs/dbraw/zinc/63/42/91/1040634291.db2.gz JNYAOZMVVIUGKL-CYBMUJFWSA-N -1 3 330.453 4.130 20 0 EIADHM Cc1nc(C(=O)Nc2cccc([O-])c2F)c(-c2ccccc2)s1 ZINC000539808559 1040802806 /nfs/dbraw/zinc/80/28/06/1040802806.db2.gz BWQDNKWHDPCDRD-UHFFFAOYSA-N -1 3 328.368 4.216 20 0 EIADHM C[C@@H](c1ccco1)N(CCOc1ccc(C(=O)[O-])cc1Cl)C1CC1 ZINC000567173103 1040848866 /nfs/dbraw/zinc/84/88/66/1040848866.db2.gz MSFFNHLCPRDLKN-LBPRGKRZSA-N -1 3 349.814 4.236 20 0 EIADHM COC(=O)c1ccc(C(=O)Nc2ccc(SC3CCCC3)cc2)[n-]1 ZINC000483941884 1041075120 /nfs/dbraw/zinc/07/51/20/1041075120.db2.gz NIXLCFXNOYHELF-UHFFFAOYSA-N -1 3 344.436 4.088 20 0 EIADHM CCc1cc(=O)[n-]c(CN[C@H](CCc2ccccc2)c2ccccc2)n1 ZINC000538181083 1041137093 /nfs/dbraw/zinc/13/70/93/1041137093.db2.gz ZULHWGOEQDCGGK-HXUWFJFHSA-N -1 3 347.462 4.208 20 0 EIADHM CC(C)CCC[C@@H](NCc1c(Cl)cccc1OC(F)F)C(=O)[O-] ZINC000904035320 1041283001 /nfs/dbraw/zinc/28/30/01/1041283001.db2.gz CRTDDKSKAXKRHK-CYBMUJFWSA-N -1 3 349.805 4.311 20 0 EIADHM CCC(C)(C)CCSc1nc2c(cnn2-c2ccccc2)c(=O)[n-]1 ZINC000463045221 1041290918 /nfs/dbraw/zinc/29/09/18/1041290918.db2.gz RRNDLIROAFECRO-UHFFFAOYSA-N -1 3 342.468 4.440 20 0 EIADHM Cc1cccc([C@H](CC(=O)[O-])NCc2csc(C(F)(F)F)c2)c1 ZINC000904044470 1041298439 /nfs/dbraw/zinc/29/84/39/1041298439.db2.gz APYJHLNHTWIUSK-ZDUSSCGKSA-N -1 3 343.370 4.381 20 0 EIADHM Cc1ccc(C(=O)N2CCC[C@H](Oc3ccccc3Cl)C2)c([O-])c1 ZINC000436513314 1041299109 /nfs/dbraw/zinc/29/91/09/1041299109.db2.gz MMNSPLDYBMTMLM-AWEZNQCLSA-N -1 3 345.826 4.038 20 0 EIADHM CC(C)c1ccc(C(=O)N2CCc3c4ccccc4[nH]c3C2)c([O-])c1 ZINC000436525839 1041307742 /nfs/dbraw/zinc/30/77/42/1041307742.db2.gz PBCCTGGMOKJAFY-UHFFFAOYSA-N -1 3 334.419 4.195 20 0 EIADHM CC(C)Oc1cc(Cl)c(CNC2CC(CC(=O)[O-])C2)cc1Cl ZINC000904063020 1041313137 /nfs/dbraw/zinc/31/31/37/1041313137.db2.gz ZZJBHLKXUOFKTD-UHFFFAOYSA-N -1 3 346.254 4.124 20 0 EIADHM COc1cc(-c2nc3c(cccc3C)[nH]2)cc(Br)c1[O-] ZINC000436534521 1041317485 /nfs/dbraw/zinc/31/74/85/1041317485.db2.gz KFIRHTDMKAGXPE-UHFFFAOYSA-N -1 3 333.185 4.015 20 0 EIADHM COc1ccc(C(=O)N(C)[C@H](C)[C@H](C)c2ccc(Cl)cc2)c([O-])c1 ZINC000436575496 1041337483 /nfs/dbraw/zinc/33/74/83/1041337483.db2.gz NPAMOHRJMPMTJU-QWHCGFSZSA-N -1 3 347.842 4.318 20 0 EIADHM CC(C)c1ccc(C(=O)N2CCC[C@@H](C(F)(F)F)[C@H]2C)c([O-])c1 ZINC000436544791 1041338790 /nfs/dbraw/zinc/33/87/90/1041338790.db2.gz KSGMVTBCVDLJGT-BXUZGUMPSA-N -1 3 329.362 4.319 20 0 EIADHM Cc1ccc(C(=O)Nc2cnn(CC(C)C)c2C(F)F)c([O-])c1C ZINC000436561793 1041343726 /nfs/dbraw/zinc/34/37/26/1041343726.db2.gz KJODSPWLHJJMIU-UHFFFAOYSA-N -1 3 337.370 4.051 20 0 EIADHM Cc1ccc(C(=O)Nc2ccc(OC(F)F)c(F)c2)c([O-])c1C ZINC000436565214 1041345779 /nfs/dbraw/zinc/34/57/79/1041345779.db2.gz SSJKRTXPXZKMRU-UHFFFAOYSA-N -1 3 325.286 4.002 20 0 EIADHM CN(Cc1ccco1)C(=O)c1cc(CCc2ccccc2)ccc1[O-] ZINC000436594807 1041355067 /nfs/dbraw/zinc/35/50/67/1041355067.db2.gz IZHMOWHAERJSEB-UHFFFAOYSA-N -1 3 335.403 4.043 20 0 EIADHM CC(C)c1ccc(C(=O)NC[C@H]2CCO[C@@H]2c2ccccc2)c([O-])c1 ZINC000436586196 1041363445 /nfs/dbraw/zinc/36/34/45/1041363445.db2.gz ATZJDGVCCLGLSS-YLJYHZDGSA-N -1 3 339.435 4.023 20 0 EIADHM CC[C@@H]1CCCC[C@H]1c1noc(-c2cc(OC)c([O-])c(OC)c2)n1 ZINC000436588678 1041363535 /nfs/dbraw/zinc/36/35/35/1041363535.db2.gz ITKGXFRULQNRJW-DGCLKSJQSA-N -1 3 332.400 4.143 20 0 EIADHM CC(C)c1ccc(C(=O)N2C[C@@H](C)O[C@@H](c3ccsc3)C2)c([O-])c1 ZINC000436589132 1041365408 /nfs/dbraw/zinc/36/54/08/1041365408.db2.gz VNHIYUVQVBAHEP-FZKQIMNGSA-N -1 3 345.464 4.179 20 0 EIADHM CCc1ccc([O-])c(C(=O)Nc2cnn([C@@H](C)CC)c2C2CC2)c1 ZINC000436601758 1041368883 /nfs/dbraw/zinc/36/88/83/1041368883.db2.gz KFNVMJOHSHVPLB-LBPRGKRZSA-N -1 3 327.428 4.252 20 0 EIADHM COc1ccc(C(=O)N2CCC[C@H]2CCCc2ccccc2)c([O-])c1 ZINC000436608352 1041370848 /nfs/dbraw/zinc/37/08/48/1041370848.db2.gz UJEMTMLBIWYCED-QGZVFWFLSA-N -1 3 339.435 4.028 20 0 EIADHM Cc1cccc(C(=O)Nc2cc(-c3cncc(F)c3)ccc2C)c1[O-] ZINC000436622291 1041391010 /nfs/dbraw/zinc/39/10/10/1041391010.db2.gz CBKNGSLOIYHKNN-UHFFFAOYSA-N -1 3 336.366 4.462 20 0 EIADHM [O-]c1ccc(Cc2nc(-c3cccc(C(F)(F)F)c3)no2)cc1F ZINC000904314629 1041430946 /nfs/dbraw/zinc/43/09/46/1041430946.db2.gz LVOXHLMMXHFXEG-UHFFFAOYSA-N -1 3 338.260 4.191 20 0 EIADHM CCCCN(C(=O)c1cc(NC(C)=O)ccc1[O-])[C@@H]1CCC[C@@H](C)C1 ZINC000436701619 1041432140 /nfs/dbraw/zinc/43/21/40/1041432140.db2.gz AFEIKJHFDZBYIG-RHSMWYFYSA-N -1 3 346.471 4.172 20 0 EIADHM C[C@@H](C1CCC1)N(C)C(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436712090 1041438369 /nfs/dbraw/zinc/43/83/69/1041438369.db2.gz DUCUBESREKUZEQ-AWEZNQCLSA-N -1 3 325.408 4.445 20 0 EIADHM Cc1csc(C(=O)N=c2cc(-c3ccccc3C)[n-][nH]2)c1Cl ZINC000480625054 1041438731 /nfs/dbraw/zinc/43/87/31/1041438731.db2.gz LWTNNVPHNAHYBH-UHFFFAOYSA-N -1 3 331.828 4.083 20 0 EIADHM Cc1ccc(C(=O)N2CCC[C@H]2Cc2ccccc2Cl)c([O-])c1 ZINC000436710357 1041439343 /nfs/dbraw/zinc/43/93/43/1041439343.db2.gz SMJVHRRSIOFSHO-HNNXBMFYSA-N -1 3 329.827 4.201 20 0 EIADHM C[C@H](C1CCC1)N(C)C(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436712092 1041439652 /nfs/dbraw/zinc/43/96/52/1041439652.db2.gz DUCUBESREKUZEQ-CQSZACIVSA-N -1 3 325.408 4.445 20 0 EIADHM CC[C@H](C)Oc1ccc(-c2nc3cc(F)c(F)cc3c(=O)[n-]2)cc1 ZINC000463216192 1041439871 /nfs/dbraw/zinc/43/98/71/1041439871.db2.gz WXXVXLXSWQEINR-JTQLQIEISA-N -1 3 330.334 4.458 20 0 EIADHM Cc1ccc(C(=O)Nc2ccccc2OCC(F)(F)F)c([O-])c1C ZINC000436757388 1041455679 /nfs/dbraw/zinc/45/56/79/1041455679.db2.gz TXKVNYAENQIQKN-UHFFFAOYSA-N -1 3 339.313 4.202 20 0 EIADHM CCc1ccc(C(=O)N(C)[C@@H](CC)c2cccc(OC)c2)c([O-])c1 ZINC000436750317 1041463595 /nfs/dbraw/zinc/46/35/95/1041463595.db2.gz MYSQSKYZJSKGQL-SFHVURJKSA-N -1 3 327.424 4.187 20 0 EIADHM CCc1ccc(C(=O)N(C)Cc2cccc(OC(C)C)c2)c([O-])c1 ZINC000436829363 1041496115 /nfs/dbraw/zinc/49/61/15/1041496115.db2.gz LRMQLUDKWBMWPY-UHFFFAOYSA-N -1 3 327.424 4.014 20 0 EIADHM CCc1ccc(C(=O)N2C[C@H](c3ccc(F)cc3)C[C@H]2C)c([O-])c1 ZINC000436834707 1041498249 /nfs/dbraw/zinc/49/82/49/1041498249.db2.gz QVTLHQGRHVFVJN-CZUORRHYSA-N -1 3 327.399 4.112 20 0 EIADHM CCc1ccc(C(=O)N2C[C@@H](c3ccc(F)cc3)C[C@H]2C)c([O-])c1 ZINC000436834706 1041499394 /nfs/dbraw/zinc/49/93/94/1041499394.db2.gz QVTLHQGRHVFVJN-CJNGLKHVSA-N -1 3 327.399 4.112 20 0 EIADHM O=C(c1cc(CCc2ccccc2)ccc1[O-])N1CC[C@@H]2CCC[C@H]21 ZINC000436838574 1041506837 /nfs/dbraw/zinc/50/68/37/1041506837.db2.gz ROROKRMZUFQPSM-AZUAARDMSA-N -1 3 335.447 4.192 20 0 EIADHM O=S(=O)([N-]c1cccc(F)c1Cl)c1csc2ccccc21 ZINC000516340419 1041532628 /nfs/dbraw/zinc/53/26/28/1041532628.db2.gz QDLWYIDCCCSUPC-UHFFFAOYSA-N -1 3 341.816 4.495 20 0 EIADHM CCSc1cccc(F)c1[N-]C(=O)c1cc(-n2cccc2)ccn1 ZINC000484941057 1041532532 /nfs/dbraw/zinc/53/25/32/1041532532.db2.gz WMBSDJUFDOAZGD-UHFFFAOYSA-N -1 3 341.411 4.376 20 0 EIADHM CCc1ccc(-c2nc(Cc3c[nH]c4c3cccc4C)no2)c([O-])c1 ZINC000436858633 1041534841 /nfs/dbraw/zinc/53/48/41/1041534841.db2.gz PPFDYUQMJZBJTP-UHFFFAOYSA-N -1 3 333.391 4.385 20 0 EIADHM CCc1ccc(-c2nc(C3(c4cccc(OC)c4)CC3)no2)c([O-])c1 ZINC000436891127 1041543232 /nfs/dbraw/zinc/54/32/32/1041543232.db2.gz FNKCREJPYSQPHY-UHFFFAOYSA-N -1 3 336.391 4.093 20 0 EIADHM CCOc1ncccc1-c1noc(-c2cc3ccccc3cc2[O-])n1 ZINC000436918586 1041557963 /nfs/dbraw/zinc/55/79/63/1041557963.db2.gz JBXHRHQHGYTGBK-UHFFFAOYSA-N -1 3 333.347 4.056 20 0 EIADHM CCOc1ccc(-c2noc(-c3cc4ccccc4cc3[O-])n2)cn1 ZINC000436921823 1041559490 /nfs/dbraw/zinc/55/94/90/1041559490.db2.gz XGGCEUAQEVGVFQ-UHFFFAOYSA-N -1 3 333.347 4.056 20 0 EIADHM Cn1ncc2ccc(-c3noc(-c4cc5ccccc5cc4[O-])n3)cc21 ZINC000436935179 1041565630 /nfs/dbraw/zinc/56/56/30/1041565630.db2.gz NWLBVLFNTQGZEP-UHFFFAOYSA-N -1 3 342.358 4.149 20 0 EIADHM COc1cccc(C(=O)N2CC3(CCCC3)c3cccc(F)c32)c1[O-] ZINC000436952215 1041572764 /nfs/dbraw/zinc/57/27/64/1041572764.db2.gz IJQCJBDXTTWZLO-UHFFFAOYSA-N -1 3 341.382 4.012 20 0 EIADHM [O-]c1ccc(OCc2ccccc2)cc1-c1nc(CCC2CC2)no1 ZINC000436955548 1041574696 /nfs/dbraw/zinc/57/46/96/1041574696.db2.gz LAOTXQPZMHBKTM-UHFFFAOYSA-N -1 3 336.391 4.364 20 0 EIADHM CCCN(C(=O)c1cc(CC)ccc1[O-])[C@@H]1CCCc2cccnc21 ZINC000436954634 1041575241 /nfs/dbraw/zinc/57/52/41/1041575241.db2.gz HXYORFPIXNGKQM-GOSISDBHSA-N -1 3 338.451 4.279 20 0 EIADHM Cc1cc(C)cc(C2=CCN(Cc3ccc(F)cc3C(=O)[O-])CC2)c1 ZINC000516481649 1041596552 /nfs/dbraw/zinc/59/65/52/1041596552.db2.gz IUWVPNTYWBDIKW-UHFFFAOYSA-N -1 3 339.410 4.430 20 0 EIADHM CSc1ccc(S(=O)(=O)[N-]c2cccc(F)c2F)cc1Cl ZINC000463520985 1041614162 /nfs/dbraw/zinc/61/41/62/1041614162.db2.gz FDEOYABUEJBJCT-UHFFFAOYSA-N -1 3 349.811 4.141 20 0 EIADHM CSc1ccc(S(=O)(=O)[N-]c2cc(F)ccc2F)cc1Cl ZINC000463522415 1041614964 /nfs/dbraw/zinc/61/49/64/1041614964.db2.gz IOQHXZTZBTWEAW-UHFFFAOYSA-N -1 3 349.811 4.141 20 0 EIADHM COc1ccc(NC(=O)c2cc([O-])cc(C(F)(F)F)c2)cc1Cl ZINC000646569532 1041710637 /nfs/dbraw/zinc/71/06/37/1041710637.db2.gz NHNKJIRJOLJROR-UHFFFAOYSA-N -1 3 345.704 4.325 20 0 EIADHM Cc1nc(-c2ccco2)ccc1C(=O)Nc1c([O-])cccc1Cl ZINC000517264818 1041934232 /nfs/dbraw/zinc/93/42/32/1041934232.db2.gz XBEXIEYENFPRPT-UHFFFAOYSA-N -1 3 328.755 4.261 20 0 EIADHM COc1ccc([O-])c(C(=O)N2CCc3c2cccc3-c2ccccc2)c1 ZINC000464342419 1041957056 /nfs/dbraw/zinc/95/70/56/1041957056.db2.gz ZPNKHXXVBNQKDK-UHFFFAOYSA-N -1 3 345.398 4.271 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@@H]3CC[C@H](C)[C@@H](C)C3)nc2)n1 ZINC000541593778 1042026710 /nfs/dbraw/zinc/02/67/10/1042026710.db2.gz ACLDDRIOAVJBRF-HEHGZKQESA-N -1 3 326.444 4.043 20 0 EIADHM Cc1csc(Nc2ccc(C(=O)Nc3cccc([O-])c3F)cc2)n1 ZINC000517652126 1042118640 /nfs/dbraw/zinc/11/86/40/1042118640.db2.gz SCMHZKHBTOMOMQ-UHFFFAOYSA-N -1 3 343.383 4.292 20 0 EIADHM CC(C)(C)c1ccc(NC(=O)C(=O)c2ccc(Cl)s2)c([O-])c1 ZINC000506244156 1042194950 /nfs/dbraw/zinc/19/49/50/1042194950.db2.gz ULBAQLZMKKJYNG-UHFFFAOYSA-N -1 3 337.828 4.226 20 0 EIADHM COc1cccc(C(=O)Nc2ccc(-c3nc(C)cs3)cc2)c1[O-] ZINC000303166201 1042339077 /nfs/dbraw/zinc/33/90/77/1042339077.db2.gz UVCGDTXAZXYZMJ-UHFFFAOYSA-N -1 3 340.404 4.085 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2cccc(CC(F)(F)F)c2)cc1C ZINC000438770160 1042341412 /nfs/dbraw/zinc/34/14/12/1042341412.db2.gz DRISOMRCYQDIMM-UHFFFAOYSA-N -1 3 343.370 4.209 20 0 EIADHM CC1(C)CCCC[C@H]1NCc1coc(-c2ccc(C(=O)[O-])cc2)n1 ZINC000518200644 1042407216 /nfs/dbraw/zinc/40/72/16/1042407216.db2.gz LLPOKSIVHMHEIF-MRXNPFEDSA-N -1 3 328.412 4.098 20 0 EIADHM COc1cccc(C(=O)Nc2ccc(COC3CCCC3)cc2)c1[O-] ZINC000303825495 1042516019 /nfs/dbraw/zinc/51/60/19/1042516019.db2.gz PZLYXHVEOCRINC-UHFFFAOYSA-N -1 3 341.407 4.112 20 0 EIADHM Cc1cc(=O)[n-]c(-c2ccc(NC(=O)CCCC3CCCC3)cc2)n1 ZINC000173827092 1042615191 /nfs/dbraw/zinc/61/51/91/1042615191.db2.gz HHQKYWLLOPZORH-UHFFFAOYSA-N -1 3 339.439 4.044 20 0 EIADHM COc1cccc(C(=O)Nc2ccc(CCC(F)(F)F)cc2)c1[O-] ZINC000439654019 1042719878 /nfs/dbraw/zinc/71/98/78/1042719878.db2.gz WGOMKOXXAKRMFW-UHFFFAOYSA-N -1 3 339.313 4.148 20 0 EIADHM O=c1nc(CN2CC[C@H]3CCC[C@H]32)[n-]c2scc(-c3ccco3)c21 ZINC000426461855 1042728220 /nfs/dbraw/zinc/72/82/20/1042728220.db2.gz PSZHHFTXWZSTAI-DGCLKSJQSA-N -1 3 341.436 4.031 20 0 EIADHM CCc1c(NC(=O)c2cc([O-])ccc2Cl)cnn1C(CC)CC ZINC000506650499 1042734046 /nfs/dbraw/zinc/73/40/46/1042734046.db2.gz YLTXLYUEKGPXBS-UHFFFAOYSA-N -1 3 335.835 4.418 20 0 EIADHM CCCC(=O)Nc1cccc(NC(=O)c2ccc(CC)cc2[O-])c1C ZINC000190357905 1042830787 /nfs/dbraw/zinc/83/07/87/1042830787.db2.gz DVQQAWFIFDEZOE-UHFFFAOYSA-N -1 3 340.423 4.254 20 0 EIADHM CCCOc1ccc(F)cc1Nc1cc(=O)n(-c2ccccc2)[n-]1 ZINC001212198232 1042843405 /nfs/dbraw/zinc/84/34/05/1042843405.db2.gz ZTQVKYFWFHICLC-UHFFFAOYSA-N -1 3 327.359 4.249 20 0 EIADHM CCO[C@@H](C)c1ncc(C(=O)[N-]c2cc(Cl)cc(F)c2F)s1 ZINC000441567474 1042886387 /nfs/dbraw/zinc/88/63/87/1042886387.db2.gz OKETYLFXCVATGI-ZETCQYMHSA-N -1 3 346.786 4.425 20 0 EIADHM Cc1cccc2c1OCC[C@H]2NC(=O)c1cc([O-])c2ccccc2c1 ZINC000355978249 1043128017 /nfs/dbraw/zinc/12/80/17/1043128017.db2.gz CKQJIBLXQJSWAY-GOSISDBHSA-N -1 3 333.387 4.107 20 0 EIADHM O=C(Nc1cccc(NCc2cc([O-])cc(F)c2)c1)c1cccs1 ZINC000185479003 1043189935 /nfs/dbraw/zinc/18/99/35/1043189935.db2.gz MPPCCMRIMBLGKW-UHFFFAOYSA-N -1 3 342.395 4.457 20 0 EIADHM O=S(=O)(/C=C\c1ccccc1Cl)[N-]c1cc(F)cc(F)c1 ZINC000727353233 1043205514 /nfs/dbraw/zinc/20/55/14/1043205514.db2.gz PUJCQGFSHHMHQZ-WAYWQWQTSA-N -1 3 329.755 4.031 20 0 EIADHM CC[C@H]1c2ccsc2CCN1Cc1cc(=O)oc2cc([O-])ccc12 ZINC000727366670 1043209420 /nfs/dbraw/zinc/20/94/20/1043209420.db2.gz PZEJKNIWGXZXNB-INIZCTEOSA-N -1 3 341.432 4.070 20 0 EIADHM Cc1ccc(C)c(OCCCCC(=O)NCc2ccc([O-])c(F)c2)c1 ZINC000132965398 1043218882 /nfs/dbraw/zinc/21/88/82/1043218882.db2.gz LUJWBVFLBYJUQJ-UHFFFAOYSA-N -1 3 345.414 4.014 20 0 EIADHM C[C@H](CNC(=O)c1cc([O-])c2ccccc2c1)c1ccc(F)cc1F ZINC000525934627 1043237175 /nfs/dbraw/zinc/23/71/75/1043237175.db2.gz YGPQIUSRFRGOBI-GFCCVEGCSA-N -1 3 341.357 4.357 20 0 EIADHM C[C@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1cc([O-])c2ccccc2c1 ZINC000526919320 1043245339 /nfs/dbraw/zinc/24/53/39/1043245339.db2.gz MITLKYZLRHXBNO-NHYWBVRUSA-N -1 3 337.341 4.348 20 0 EIADHM COc1cc(C)c(NC(=O)c2cc([O-])c3ccccc3c2)cc1F ZINC000526920300 1043245929 /nfs/dbraw/zinc/24/59/29/1043245929.db2.gz VROFVOXCZGUHMI-UHFFFAOYSA-N -1 3 325.339 4.254 20 0 EIADHM CCCCCn1nc(C)cc1NC(=O)c1cc([O-])c2ccccc2c1 ZINC000526927919 1043246356 /nfs/dbraw/zinc/24/63/56/1043246356.db2.gz QFGWJSJQBZWQPT-UHFFFAOYSA-N -1 3 337.423 4.493 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N1CC[C@@H](c2cccc(F)c2)C1 ZINC000527183713 1043252544 /nfs/dbraw/zinc/25/25/44/1043252544.db2.gz LFYUKNSPYUAKNV-MRXNPFEDSA-N -1 3 335.378 4.314 20 0 EIADHM Cc1csc([C@@H](C)[N-]C(=O)C(F)(F)c2cccc(Cl)c2)n1 ZINC000727670404 1043265039 /nfs/dbraw/zinc/26/50/39/1043265039.db2.gz VSZYGOJUJJPRIO-SECBINFHSA-N -1 3 330.787 4.074 20 0 EIADHM O=C(N[C@@H](c1cc(F)ccc1F)C(F)F)c1cc([O-])ccc1Cl ZINC000509196710 1043280467 /nfs/dbraw/zinc/28/04/67/1043280467.db2.gz PDZXOHOYTPAQCX-ZDUSSCGKSA-N -1 3 347.695 4.060 20 0 EIADHM O=C([N-][C@H]1CCc2ccc(F)cc21)C(F)(F)c1cccc(Cl)c1 ZINC000730188437 1043474961 /nfs/dbraw/zinc/47/49/61/1043474961.db2.gz FXJLOQKGOYKMLM-HNNXBMFYSA-N -1 3 339.744 4.375 20 0 EIADHM CC(C)(C)c1ccc(S(=O)(=O)[N-]C(C)(C)CC(F)(F)F)s1 ZINC000672889631 1043483672 /nfs/dbraw/zinc/48/36/72/1043483672.db2.gz NNXOHUUHCZSMAI-UHFFFAOYSA-N -1 3 343.436 4.055 20 0 EIADHM O=C(Nc1ncccc1[O-])c1ccc(-c2ccc(Cl)cc2)cc1F ZINC000730272916 1043491177 /nfs/dbraw/zinc/49/11/77/1043491177.db2.gz MGFVPVBJEHVOSY-UHFFFAOYSA-N -1 3 342.757 4.499 20 0 EIADHM CSc1ccncc1[N-]C(=O)c1oc(-c2ccccc2)nc1C ZINC000674257821 1043503713 /nfs/dbraw/zinc/50/37/13/1043503713.db2.gz AHEKRZIVAURYRK-UHFFFAOYSA-N -1 3 325.393 4.019 20 0 EIADHM [O-]c1c(F)cc(F)cc1Nc1c(F)cc(Br)cc1F ZINC001212485860 1043509021 /nfs/dbraw/zinc/50/90/21/1043509021.db2.gz ACSQTPHUWYOILJ-UHFFFAOYSA-N -1 3 336.082 4.455 20 0 EIADHM CCc1cccc(C(=O)N2CCC(c3ccc(F)c(F)c3)CC2)c1[O-] ZINC000674361775 1043635805 /nfs/dbraw/zinc/63/58/05/1043635805.db2.gz UAXTZYWRFJVKGE-UHFFFAOYSA-N -1 3 345.389 4.253 20 0 EIADHM C[C@H](NC(=O)c1nnc2ccccc2c1[O-])c1cc2ccccc2s1 ZINC000732289986 1043895629 /nfs/dbraw/zinc/89/56/29/1043895629.db2.gz OAMZWCKWBDBKMR-NSHDSACASA-N -1 3 349.415 4.041 20 0 EIADHM Cc1c(F)c(C(F)(F)F)ccc1C(=O)Nc1cc(F)ccc1[O-] ZINC000443068630 1043989126 /nfs/dbraw/zinc/98/91/26/1043989126.db2.gz WEMGQWPOSKOJDN-UHFFFAOYSA-N -1 3 331.240 4.250 20 0 EIADHM Cc1ccccc1[C@H](CC(C)C)NC(=O)c1nnc2ccccc2c1[O-] ZINC000732833966 1044019935 /nfs/dbraw/zinc/01/99/35/1044019935.db2.gz LLBFOOVMULBBIA-SFHVURJKSA-N -1 3 349.434 4.161 20 0 EIADHM [O-]c1ccccc1-c1nc(-c2ccnc(OCc3ccccc3)c2)no1 ZINC000761691810 1044244901 /nfs/dbraw/zinc/24/49/01/1044244901.db2.gz KJVKFOTYVZKLRS-UHFFFAOYSA-N -1 3 345.358 4.083 20 0 EIADHM CCc1ccc([O-])c(C(=O)N(C)CCCOc2ccc(Cl)cc2)c1 ZINC000499731367 1044394718 /nfs/dbraw/zinc/39/47/18/1044394718.db2.gz KZRUFEPIQVSPFN-UHFFFAOYSA-N -1 3 347.842 4.149 20 0 EIADHM O=C(CCC1CCCCC1)[N-]OCc1ccc(Br)s1 ZINC000733997692 1044447060 /nfs/dbraw/zinc/44/70/60/1044447060.db2.gz BQFZLOJNZFJJOC-UHFFFAOYSA-N -1 3 346.290 4.419 20 0 EIADHM CC(=O)c1cccc(NC(=O)Cc2coc3cc4c(cc23)CCC4)c1[O-] ZINC000673526862 1044585880 /nfs/dbraw/zinc/58/58/80/1044585880.db2.gz DVSLBLGWJCVFRZ-UHFFFAOYSA-N -1 3 349.386 4.011 20 0 EIADHM O=c1[n-]c(N[C@H](c2ccccn2)C(F)(F)F)c(Cl)cc1Cl ZINC001168476383 1044621412 /nfs/dbraw/zinc/62/14/12/1044621412.db2.gz CZOGBZAYCVXVQK-SECBINFHSA-N -1 3 338.116 4.205 20 0 EIADHM CCCCN(Cn1[n-]c(-c2ccccn2)nc1=S)C1CCCCC1 ZINC000735298152 1044787094 /nfs/dbraw/zinc/78/70/94/1044787094.db2.gz RXPHXXZXJCPFAK-UHFFFAOYSA-N -1 3 345.516 4.395 20 0 EIADHM CC[C@@H](NC(=O)c1cc(=O)c2ccccc2[n-]1)c1cccc(Cl)c1 ZINC000053457105 1044811481 /nfs/dbraw/zinc/81/14/81/1044811481.db2.gz PYPLKNARRDJODS-OAHLLOKOSA-N -1 3 340.810 4.063 20 0 EIADHM Cc1ccc(Cl)c([N-]S(=O)(=O)c2ccccc2C(F)(F)F)c1 ZINC000474294298 1044847082 /nfs/dbraw/zinc/84/70/82/1044847082.db2.gz OCIRXIAPDGLJAN-UHFFFAOYSA-N -1 3 349.761 4.468 20 0 EIADHM Cc1c2ccccc2oc1C(=O)COC(=O)c1cc2ccsc2[n-]1 ZINC000914890342 1044852435 /nfs/dbraw/zinc/85/24/35/1044852435.db2.gz RUFJIZJXMXLUSX-UHFFFAOYSA-N -1 3 339.372 4.324 20 0 EIADHM O=C(COC(=O)c1cc2ccsc2[n-]1)c1cccc2ccccc21 ZINC000914891965 1044852902 /nfs/dbraw/zinc/85/29/02/1044852902.db2.gz WHTGDBLAFJDWKG-UHFFFAOYSA-N -1 3 335.384 4.422 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)N[C@@H](c1ccc(Cl)cc1)C1CC1 ZINC000155435728 1044897003 /nfs/dbraw/zinc/89/70/03/1044897003.db2.gz HYBDRQLUDKARLN-QGZVFWFLSA-N -1 3 348.805 4.135 20 0 EIADHM CCCCCN(C(=O)c1cc(=O)c2ccccc2[n-]1)[C@@H](C)CCC ZINC000509324001 1044963730 /nfs/dbraw/zinc/96/37/30/1044963730.db2.gz VFPUJPZWUDJQMC-HNNXBMFYSA-N -1 3 328.456 4.349 20 0 EIADHM Cc1cc(C)n(-c2ccc(NCc3c(F)ccc([O-])c3F)cc2F)n1 ZINC000509341863 1044985802 /nfs/dbraw/zinc/98/58/02/1044985802.db2.gz GLOHIINEXJPKNC-UHFFFAOYSA-N -1 3 347.340 4.224 20 0 EIADHM CC(C)Oc1ccc(CO[N-]C(=O)Cc2cccc3ccccc32)cc1 ZINC000738295460 1045054874 /nfs/dbraw/zinc/05/48/74/1045054874.db2.gz ZDAMHEGMEGFOAV-UHFFFAOYSA-N -1 3 349.430 4.418 20 0 EIADHM O=C(Cc1cccc2ccccc21)[N-]OCc1cccc(Cl)c1 ZINC000738295342 1045056095 /nfs/dbraw/zinc/05/60/95/1045056095.db2.gz VKFGLYSANZECKR-UHFFFAOYSA-N -1 3 325.795 4.284 20 0 EIADHM CC[C@@H](OC(=O)c1cc(Cl)c(Cl)[n-]1)C(=O)c1ccccc1 ZINC000738602940 1045069312 /nfs/dbraw/zinc/06/93/12/1045069312.db2.gz JQPYKNRPWCDMFH-GFCCVEGCSA-N -1 3 326.179 4.140 20 0 EIADHM COc1c(C)cc(C)cc1S(=O)(=O)[N-]c1cc(C)ccc1Cl ZINC000509383008 1045071895 /nfs/dbraw/zinc/07/18/95/1045071895.db2.gz BIQFMJJXEHZLNJ-UHFFFAOYSA-N -1 3 339.844 4.075 20 0 EIADHM Cc1ccc(NC(=O)c2cc([O-])ccc2Cl)cc1Br ZINC000235894397 1045345256 /nfs/dbraw/zinc/34/52/56/1045345256.db2.gz UJUBGCVIYBZDHO-UHFFFAOYSA-N -1 3 340.604 4.369 20 0 EIADHM CC(C)(C)C[C@H](NC(=O)c1c[n-]c2ccccc2c1=O)c1ccccc1 ZINC000053809387 1045399996 /nfs/dbraw/zinc/39/99/96/1045399996.db2.gz CBBFDOWKDNYJNF-IBGZPJMESA-N -1 3 348.446 4.435 20 0 EIADHM O=C([N-]Cc1cccc(C(F)(F)F)c1)C(F)(F)c1ccccc1 ZINC000915657145 1045443938 /nfs/dbraw/zinc/44/39/38/1045443938.db2.gz FXGXZOLLEQISKF-UHFFFAOYSA-N -1 3 329.268 4.114 20 0 EIADHM O=C(C[C@H](Cc1ccccc1)c1ccccc1)[N-]OCc1cccnc1 ZINC000746936644 1045550864 /nfs/dbraw/zinc/55/08/64/1045550864.db2.gz BLAMPFNWVHVOKU-NRFANRHFSA-N -1 3 346.430 4.046 20 0 EIADHM CCOc1ccc([N-]S(=O)(=O)c2ccc(C(C)C)cc2)c(C)c1 ZINC000614867547 1045570788 /nfs/dbraw/zinc/57/07/88/1045570788.db2.gz JPNZNTJGBJVTIQ-UHFFFAOYSA-N -1 3 333.453 4.318 20 0 EIADHM CCCCC[C@@H]1CCCN1Cn1[n-]c(-c2ccccn2)nc1=S ZINC000767764611 1045633338 /nfs/dbraw/zinc/63/33/38/1045633338.db2.gz YYTZYGBYSVDHBA-CQSZACIVSA-N -1 3 331.489 4.005 20 0 EIADHM O=C(Cc1c[nH]c2cc(Cl)ccc12)Nc1ccc(Cl)cc1[O-] ZINC000533618941 1045643155 /nfs/dbraw/zinc/64/31/55/1045643155.db2.gz QTTNZICYADVKOL-UHFFFAOYSA-N -1 3 335.190 4.362 20 0 EIADHM Cc1cccnc1[C@@H](NCc1cc(=O)[n-]c(-c2ccccc2)n1)C(C)C ZINC000459387616 1045748115 /nfs/dbraw/zinc/74/81/15/1045748115.db2.gz ZVWAZBQFPJDKQH-IBGZPJMESA-N -1 3 348.450 4.040 20 0 EIADHM Cc1cc(C)cc([C@@H](C)NCc2nc3c4ccccc4oc3c(=O)[n-]2)c1 ZINC000107071925 1045756882 /nfs/dbraw/zinc/75/68/82/1045756882.db2.gz GNCLBVOXFDGEEX-CQSZACIVSA-N -1 3 347.418 4.137 20 0 EIADHM Cc1cc(=O)[n-]c(CSCc2csc(-c3ccc(F)cc3)n2)n1 ZINC000763219128 1045777444 /nfs/dbraw/zinc/77/74/44/1045777444.db2.gz WTNYELHQJUIIIB-UHFFFAOYSA-N -1 3 347.440 4.187 20 0 EIADHM Cc1c2ccccc2oc1[C@H](C)NC(=O)c1cc(=O)c2ccccc2[n-]1 ZINC000056077714 1045779119 /nfs/dbraw/zinc/77/91/19/1045779119.db2.gz PDRTXEVFOQBKLO-ZDUSSCGKSA-N -1 3 346.386 4.074 20 0 EIADHM Cc1cc(SC(C)(C)C)ccc1NC(=O)NCc1ncccc1[O-] ZINC000791811053 1045820384 /nfs/dbraw/zinc/82/03/84/1045820384.db2.gz IUMZKNONTUKHSB-UHFFFAOYSA-N -1 3 345.468 4.308 20 0 EIADHM COC(=O)c1ccc(-c2cccc(Nc3ccc([O-])c(F)c3F)c2)o1 ZINC001212007461 1045827560 /nfs/dbraw/zinc/82/75/60/1045827560.db2.gz GSYVYFYGKHGVLJ-UHFFFAOYSA-N -1 3 345.301 4.461 20 0 EIADHM [O-]c1ccc(Nc2ccc(OCc3ccncc3)cc2)c(F)c1F ZINC001212010966 1045832148 /nfs/dbraw/zinc/83/21/48/1045832148.db2.gz KHWHGXFCUNACHK-UHFFFAOYSA-N -1 3 328.318 4.388 20 0 EIADHM Cc1sc2[n-]c([C@H](C)OC(=O)C[C@@H]3CCC[C@H]3C)nc(=O)c2c1C ZINC000769186969 1045891422 /nfs/dbraw/zinc/89/14/22/1045891422.db2.gz USZBYXZMYQEABX-CDMKHQONSA-N -1 3 348.468 4.444 20 0 EIADHM CC(C)[C@H](NC(=O)c1cc([O-])c2ccccc2c1)[C@H](O)c1ccccc1 ZINC000792492627 1045898682 /nfs/dbraw/zinc/89/86/82/1045898682.db2.gz ZRRSTHVIQFLYQM-LEWJYISDSA-N -1 3 349.430 4.033 20 0 EIADHM CCC[C@H](NC(=O)c1cc([O-])c2ccccc2c1)[C@H](O)c1ccccc1 ZINC000792560778 1045934180 /nfs/dbraw/zinc/93/41/80/1045934180.db2.gz MVBMTQIWFVWWQK-PZJWPPBQSA-N -1 3 349.430 4.178 20 0 EIADHM CC[C@H](C)c1ccc(S(=O)(=O)[N-]c2cccc(OC)c2F)cc1 ZINC000769890831 1046106437 /nfs/dbraw/zinc/10/64/37/1046106437.db2.gz PTEZHRLWGQIPCO-LBPRGKRZSA-N -1 3 337.416 4.149 20 0 EIADHM O=C(Nc1ccc([O-])c(C(F)(F)F)c1)c1c[nH]nc1-c1ccccc1 ZINC000125332471 1046300728 /nfs/dbraw/zinc/30/07/28/1046300728.db2.gz GWKOGKGNZPHDEG-UHFFFAOYSA-N -1 3 347.296 4.053 20 0 EIADHM CC[C@H](C)c1cc(C(=O)Nc2ccc([O-])c(C(F)(F)F)c2)on1 ZINC000125323389 1046300975 /nfs/dbraw/zinc/30/09/75/1046300975.db2.gz JAZBTDBKJIBWAI-QMMMGPOBSA-N -1 3 328.290 4.165 20 0 EIADHM O=C(C[C@H]1CCCN1Cc1cccc([O-])c1Cl)c1ccccc1 ZINC000508757710 1046530289 /nfs/dbraw/zinc/53/02/89/1046530289.db2.gz DXOFAFDZHCAYLN-MRXNPFEDSA-N -1 3 329.827 4.283 20 0 EIADHM O=C(Cc1ccc(Cl)cc1)[N-]OCc1ccc(C(F)(F)F)cc1 ZINC000746521532 1046550992 /nfs/dbraw/zinc/55/09/92/1046550992.db2.gz BFJYZXALRWXHBR-UHFFFAOYSA-N -1 3 343.732 4.149 20 0 EIADHM CC[C@H](NCc1cccc([O-])c1Br)c1nc(C)cs1 ZINC000459434822 1046667744 /nfs/dbraw/zinc/66/77/44/1046667744.db2.gz VAKWNVBWGJHGJQ-NSHDSACASA-N -1 3 341.274 4.161 20 0 EIADHM O=C(Nc1cccc([O-])c1F)c1cc2ccc(C(F)(F)F)cc2[nH]1 ZINC000536711974 1046707482 /nfs/dbraw/zinc/70/74/82/1046707482.db2.gz WFBYUHWPLARBRC-UHFFFAOYSA-N -1 3 338.260 4.284 20 0 EIADHM Cc1ccc(N(C)Cc2nc3c4ccccc4oc3c(=O)[n-]2)cc1C ZINC000917171754 1046803264 /nfs/dbraw/zinc/80/32/64/1046803264.db2.gz RVLCLFIWMLTWRW-UHFFFAOYSA-N -1 3 333.391 4.335 20 0 EIADHM CC[C@@H](NC(=O)CCCc1ccc([O-])c(F)c1)c1ccccc1OC ZINC000786762649 1046867437 /nfs/dbraw/zinc/86/74/37/1046867437.db2.gz MUFAMFDJHCBSRB-QGZVFWFLSA-N -1 3 345.414 4.130 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N(CC)CC(CC)CC)nc2)n1 ZINC000536994647 1046884223 /nfs/dbraw/zinc/88/42/23/1046884223.db2.gz KDNSKDCAEWCISZ-UHFFFAOYSA-N -1 3 328.460 4.069 20 0 EIADHM CCc1cc(=O)[n-]c(CN[C@H](C)c2ccc(Oc3ccccc3)cc2)n1 ZINC000537060732 1046910669 /nfs/dbraw/zinc/91/06/69/1046910669.db2.gz PFQHKHPWILPJGW-OAHLLOKOSA-N -1 3 349.434 4.388 20 0 EIADHM Cc1ccc(C(=O)c2ccccc2C(=O)Nc2cccc([O-])c2F)cc1 ZINC000128527595 1046912250 /nfs/dbraw/zinc/91/22/50/1046912250.db2.gz XETXYUMFHVPCAS-UHFFFAOYSA-N -1 3 349.361 4.323 20 0 EIADHM CSc1cccc([C@H]([N-]C(=O)C(F)F)c2ccc(F)c(F)c2)c1 ZINC000787397497 1047007384 /nfs/dbraw/zinc/00/73/84/1047007384.db2.gz TWOVKWYEBNDAGE-AWEZNQCLSA-N -1 3 343.345 4.157 20 0 EIADHM O=C(Nc1cccc([O-])c1F)c1cc(Cl)ccc1Br ZINC000128777891 1047071441 /nfs/dbraw/zinc/07/14/41/1047071441.db2.gz UPARUZUQVDQWSZ-UHFFFAOYSA-N -1 3 344.567 4.200 20 0 EIADHM O=C(OCc1ccc(Cl)nc1Cl)c1cc(Cl)c(Cl)[n-]1 ZINC000788064964 1047090419 /nfs/dbraw/zinc/09/04/19/1047090419.db2.gz KFCCUAKFMVBEGO-UHFFFAOYSA-N -1 3 339.993 4.380 20 0 EIADHM CCn1c(NC(=O)c2cc3sccc3c([O-])c2)nc2ccccc21 ZINC000788271581 1047154975 /nfs/dbraw/zinc/15/49/75/1047154975.db2.gz OSCZMURXDUUGBU-UHFFFAOYSA-N -1 3 337.404 4.229 20 0 EIADHM COc1ccc(F)cc1[C@@H](C)NC(=O)c1cc2sccc2c([O-])c1 ZINC000788283386 1047156731 /nfs/dbraw/zinc/15/67/31/1047156731.db2.gz OXNVXPUUTQLLLD-SNVBAGLBSA-N -1 3 345.395 4.246 20 0 EIADHM Cc1cc(O[C@@H](C)C(=O)Nc2cccc([O-])c2F)ccc1C(C)C ZINC000129097747 1047295185 /nfs/dbraw/zinc/29/51/85/1047295185.db2.gz VPSCBIIUPWWHSX-ZDUSSCGKSA-N -1 3 331.387 4.369 20 0 EIADHM Cc1ccc(OCCCC(=O)Nc2cccc([O-])c2F)c(Cl)c1 ZINC000129193671 1047330676 /nfs/dbraw/zinc/33/06/76/1047330676.db2.gz GKPOIQPWKQRHLW-UHFFFAOYSA-N -1 3 337.778 4.291 20 0 EIADHM Cc1noc(C(C)C)c1C(=O)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000476143292 1047373179 /nfs/dbraw/zinc/37/31/79/1047373179.db2.gz HOPYPHCYPGHSRQ-UHFFFAOYSA-N -1 3 328.290 4.083 20 0 EIADHM O=C(Nc1ccc([O-])c(C(F)(F)F)c1)[C@@H]1C[C@@]12CCc1ccccc12 ZINC000476174114 1047402374 /nfs/dbraw/zinc/40/23/74/1047402374.db2.gz UCLLGIWKTWAIKK-MAUKXSAKSA-N -1 3 347.336 4.254 20 0 EIADHM O=C(Nc1ccc([O-])c(C(F)(F)F)c1)[C@H]1C[C@]12CCc1ccccc12 ZINC000476174117 1047402506 /nfs/dbraw/zinc/40/25/06/1047402506.db2.gz UCLLGIWKTWAIKK-QAPCUYQASA-N -1 3 347.336 4.254 20 0 EIADHM O=C(Cc1coc(-c2ccc(Cl)cc2)n1)Nc1cccc([O-])c1F ZINC000129555843 1047430065 /nfs/dbraw/zinc/43/00/65/1047430065.db2.gz IVTLUBPBUKYJBB-UHFFFAOYSA-N -1 3 346.745 4.021 20 0 EIADHM CCc1c(C(=O)Nc2ccc(Cl)cc2[O-])cnn1C1CCCC1 ZINC000476330858 1047464625 /nfs/dbraw/zinc/46/46/25/1047464625.db2.gz LCYWOERKXGLRRS-UHFFFAOYSA-N -1 3 333.819 4.172 20 0 EIADHM O=C(OCCCOCCc1ccccc1)c1cc(Cl)c(Cl)[n-]1 ZINC000918527135 1047476445 /nfs/dbraw/zinc/47/64/45/1047476445.db2.gz KUPMFFMSFBSNED-UHFFFAOYSA-N -1 3 342.222 4.128 20 0 EIADHM O=C([O-])C[C@@H](NCc1ccc(SC(F)F)cc1)c1cccs1 ZINC000789897167 1047488426 /nfs/dbraw/zinc/48/84/26/1047488426.db2.gz GLVBAQSVKCWSFI-GFCCVEGCSA-N -1 3 343.420 4.368 20 0 EIADHM CC(C)[C@@H](OC(=O)c1cc2ccsc2[n-]1)C(=O)c1ccccc1 ZINC000918939624 1047705493 /nfs/dbraw/zinc/70/54/93/1047705493.db2.gz HEMDPXXEKBXJIT-MRXNPFEDSA-N -1 3 327.405 4.294 20 0 EIADHM CCCn1ccc2cc(NC(=O)c3[n-]cnc3C(F)(F)F)ccc21 ZINC000824913444 1047982711 /nfs/dbraw/zinc/98/27/11/1047982711.db2.gz SUJWYMDGRHCXLE-UHFFFAOYSA-N -1 3 336.317 4.046 20 0 EIADHM CCCn1ccc2cc(NC(=O)c3nc[n-]c3C(F)(F)F)ccc21 ZINC000824913444 1047982738 /nfs/dbraw/zinc/98/27/38/1047982738.db2.gz SUJWYMDGRHCXLE-UHFFFAOYSA-N -1 3 336.317 4.046 20 0 EIADHM Cc1ccsc1-c1nsc([N-]C(=O)c2cc(F)ccc2F)n1 ZINC000131480128 1047983914 /nfs/dbraw/zinc/98/39/14/1047983914.db2.gz QGQCOGUXTOBZOF-UHFFFAOYSA-N -1 3 337.376 4.106 20 0 EIADHM CCc1ccc(C(=O)N[C@H](Cc2ccc(F)cc2)C(C)C)c([O-])c1 ZINC001136980656 1048021355 /nfs/dbraw/zinc/02/13/55/1048021355.db2.gz OMNJKQDAGLTUQO-GOSISDBHSA-N -1 3 329.415 4.091 20 0 EIADHM Cc1c([O-])ccc2c(CN3CCC(C)(C)c4ccccc43)cc(=O)oc12 ZINC001170769008 1048212707 /nfs/dbraw/zinc/21/27/07/1048212707.db2.gz JWRQOQAHURETOR-UHFFFAOYSA-N -1 3 349.430 4.495 20 0 EIADHM CCc1noc(C)c1[N-]C(=O)c1csc(-c2ccccc2F)n1 ZINC000132589163 1048365665 /nfs/dbraw/zinc/36/56/65/1048365665.db2.gz RLZQLMWDDNHRPH-UHFFFAOYSA-N -1 3 331.372 4.060 20 0 EIADHM Cc1ccc([C@@H]2C[C@@H](C)CCN2C(=O)NCc2ccc([O-])c(F)c2)o1 ZINC000074375299 1048484796 /nfs/dbraw/zinc/48/47/96/1048484796.db2.gz GFQJSQPZLGAADK-LRDDRELGSA-N -1 3 346.402 4.116 20 0 EIADHM CC(F)(F)C(=O)[N-][C@@H](c1cccc(F)c1)c1cccc(Cl)c1 ZINC000815787792 1048609628 /nfs/dbraw/zinc/60/96/28/1048609628.db2.gz NUTSBEFNLZTXAA-CQSZACIVSA-N -1 3 327.733 4.340 20 0 EIADHM CC1(C2CC2)CCN(Cc2cc(=O)oc3cc([O-])c(Cl)cc23)CC1 ZINC000810064360 1048624291 /nfs/dbraw/zinc/62/42/91/1048624291.db2.gz DBLPDUDIZVMJDY-UHFFFAOYSA-N -1 3 347.842 4.164 20 0 EIADHM CCN(Cc1c(F)cc([O-])cc1F)[C@H](C)Cc1ccc(OC)cc1 ZINC001144541194 1048719702 /nfs/dbraw/zinc/71/97/02/1048719702.db2.gz DDMNSSHNZJWXPS-CYBMUJFWSA-N -1 3 335.394 4.132 20 0 EIADHM CC1(C)CCCc2sc(NC(=O)[N-]OCc3ccc(F)cc3)nc21 ZINC000810313058 1048758690 /nfs/dbraw/zinc/75/86/90/1048758690.db2.gz ASJXECUYCJEKDE-UHFFFAOYSA-N -1 3 349.431 4.149 20 0 EIADHM [O-]c1ccccc1-c1nc(CSc2nc3ccccc3s2)no1 ZINC000920750941 1048770392 /nfs/dbraw/zinc/77/03/92/1048770392.db2.gz LXWVPCCQUIRUCV-UHFFFAOYSA-N -1 3 341.417 4.344 20 0 EIADHM O=C([N-][C@H]1CCc2cc(Cl)ccc21)C(F)(F)c1ccc(F)cc1 ZINC000920844129 1048802045 /nfs/dbraw/zinc/80/20/45/1048802045.db2.gz AZYQUEFRMJDBPX-HNNXBMFYSA-N -1 3 339.744 4.375 20 0 EIADHM O=C(OCc1cccc2c[nH]nc21)c1cc2cc(Cl)sc2[n-]1 ZINC000810596620 1048819889 /nfs/dbraw/zinc/81/98/89/1048819889.db2.gz RGPGKZOQSPPPBW-UHFFFAOYSA-N -1 3 331.784 4.116 20 0 EIADHM CC1(C)[C@H](OC(=O)c2cc3cc(Cl)sc3[n-]2)[C@@H]2CCCO[C@H]21 ZINC000810597244 1048826702 /nfs/dbraw/zinc/82/67/02/1048826702.db2.gz ZYTHVSVKKJDROE-OASPWFOLSA-N -1 3 339.844 4.243 20 0 EIADHM O=C(OCc1ccc2c[nH]nc2c1)c1cc2cc(Cl)sc2[n-]1 ZINC000810597450 1048827394 /nfs/dbraw/zinc/82/73/94/1048827394.db2.gz AGCHCPXMUYIGIJ-UHFFFAOYSA-N -1 3 331.784 4.116 20 0 EIADHM C[C@H](OC(=O)c1cc2cc(Cl)sc2[n-]1)c1nc(C2CC2)no1 ZINC000810675088 1048844405 /nfs/dbraw/zinc/84/44/05/1048844405.db2.gz LQCHHFLBKGYVNI-LURJTMIESA-N -1 3 337.788 4.061 20 0 EIADHM [O-]c1cccc(CN2CC[C@]3(C2)CCc2ccccc2O3)c1Cl ZINC000816615108 1048844801 /nfs/dbraw/zinc/84/48/01/1048844801.db2.gz NDWASNYGCBZOOL-IBGZPJMESA-N -1 3 329.827 4.015 20 0 EIADHM O=C([O-])[C@H](c1ccc(Cl)cc1Cl)N1CCC2(CCCC2)C1 ZINC000846245626 1048848327 /nfs/dbraw/zinc/84/83/27/1048848327.db2.gz ZOVHAVJBWANHCM-AWEZNQCLSA-N -1 3 328.239 4.385 20 0 EIADHM O=C([N-]c1nc(-c2ccc[nH]2)cs1)c1snc(Cl)c1Cl ZINC000816832938 1048864691 /nfs/dbraw/zinc/86/46/91/1048864691.db2.gz RGCWSOISYSCJGZ-UHFFFAOYSA-N -1 3 345.236 4.154 20 0 EIADHM O=C([N-]c1nc(-c2ccco2)cs1)c1nc(Cl)sc1Cl ZINC000816876525 1048876179 /nfs/dbraw/zinc/87/61/79/1048876179.db2.gz YTULYOXECDLNKA-UHFFFAOYSA-N -1 3 346.220 4.419 20 0 EIADHM CC[C@@H](OC1CCCC1)C(=O)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000134080523 1048881421 /nfs/dbraw/zinc/88/14/21/1048881421.db2.gz ZZKMCGKWUQBREU-CQSZACIVSA-N -1 3 331.334 4.087 20 0 EIADHM O=C(NCCOc1ccc(Cl)cc1)c1cc2sccc2c([O-])c1 ZINC001135772659 1048883804 /nfs/dbraw/zinc/88/38/04/1048883804.db2.gz HYKORWORAIVSMW-UHFFFAOYSA-N -1 3 347.823 4.069 20 0 EIADHM C[C@H](C(=O)Nc1ccc([O-])c(C(F)(F)F)c1)c1ccccc1F ZINC000134202609 1048895216 /nfs/dbraw/zinc/89/52/16/1048895216.db2.gz XARLOPBIUIFZQE-VIFPVBQESA-N -1 3 327.277 4.292 20 0 EIADHM Cc1ccccc1C(F)(F)C(=O)[N-][C@H](CF)c1ccc(F)cc1 ZINC001132769353 1049037716 /nfs/dbraw/zinc/03/77/16/1049037716.db2.gz HFNCWBIKKLMLMX-OAHLLOKOSA-N -1 3 325.305 4.053 20 0 EIADHM CCc1ccc([O-])c(C(=O)Nc2ccc(OCC(F)(F)F)cc2)c1 ZINC001136156388 1049191778 /nfs/dbraw/zinc/19/17/78/1049191778.db2.gz WOBWBGOUYULASF-UHFFFAOYSA-N -1 3 339.313 4.148 20 0 EIADHM CC(C)c1cc(NC(=O)c2cc(Cc3ccccc3)ccc2[O-])no1 ZINC001148269828 1049293538 /nfs/dbraw/zinc/29/35/38/1049293538.db2.gz XKSWPDZHIXCIOS-UHFFFAOYSA-N -1 3 336.391 4.347 20 0 EIADHM CC(=O)c1cc(C(=O)Nc2ccc3c4c(cccc42)CC3)ccc1[O-] ZINC001148663637 1049357260 /nfs/dbraw/zinc/35/72/60/1049357260.db2.gz AUOHBSAGZGZJHA-UHFFFAOYSA-N -1 3 331.371 4.099 20 0 EIADHM CC(C)(C)C[C@@H]1CCN(C(=O)c2nnc3ccccc3c2[O-])C1(C)C ZINC000839890913 1049392364 /nfs/dbraw/zinc/39/23/64/1049392364.db2.gz LINDXZMJTZVBDQ-ZDUSSCGKSA-N -1 3 341.455 4.012 20 0 EIADHM CC(C)(C)Sc1ccc(NC(=O)c2cc3c(cc2[O-])OCO3)cc1 ZINC001136522692 1049719476 /nfs/dbraw/zinc/71/94/76/1049719476.db2.gz WJFYXKNFPDGXHY-UHFFFAOYSA-N -1 3 345.420 4.264 20 0 EIADHM CSc1cccc(C)c1[N-]C(=O)c1nc(C)cc(C(F)(F)F)n1 ZINC000822037794 1049720897 /nfs/dbraw/zinc/72/08/97/1049720897.db2.gz LZYOEPBPPAKQEE-UHFFFAOYSA-N -1 3 341.358 4.086 20 0 EIADHM CC(C)c1ccc2c(c1)CN(Cc1cc(=O)oc3cc([O-])ccc13)CC2 ZINC001171820611 1049803028 /nfs/dbraw/zinc/80/30/28/1049803028.db2.gz PZXDSJHNKOWQQH-UHFFFAOYSA-N -1 3 349.430 4.180 20 0 EIADHM O=C(c1cccc(Nc2cc(=O)[n-]n2C2CCCC2)c1)C(F)(F)F ZINC001203336839 1049814266 /nfs/dbraw/zinc/81/42/66/1049814266.db2.gz QGBFFKFSSXTIIY-UHFFFAOYSA-N -1 3 339.317 4.192 20 0 EIADHM CSc1ccc([O-])c(C(=O)N2CC3(CCC3)[C@H]2c2ccco2)c1 ZINC000615995649 1049829530 /nfs/dbraw/zinc/82/95/30/1049829530.db2.gz YXPOFIDWVGWCPV-MRXNPFEDSA-N -1 3 329.421 4.075 20 0 EIADHM [O-]c1cc(Br)cnc1Nc1ccc(C2CCOCC2)cc1 ZINC001212650378 1049876839 /nfs/dbraw/zinc/87/68/39/1049876839.db2.gz DQOMRQVXDUYYGD-UHFFFAOYSA-N -1 3 349.228 4.187 20 0 EIADHM Cc1cccc(C)c1[C@@H]1CCCN1C(=O)c1cc(=O)c2ccccc2[n-]1 ZINC000617176026 1049963033 /nfs/dbraw/zinc/96/30/33/1049963033.db2.gz UTUQEBWWXXJOSE-IBGZPJMESA-N -1 3 346.430 4.122 20 0 EIADHM O=C([O-])c1ccc(CN2CCC(Oc3ccccc3Cl)CC2)cc1 ZINC000263577978 1050065205 /nfs/dbraw/zinc/06/52/05/1050065205.db2.gz SCXCNZHQIHOJAW-UHFFFAOYSA-N -1 3 345.826 4.082 20 0 EIADHM CC(=O)OCc1cccc(Cl)c1Nc1ccc([O-])c(F)c1F ZINC001212777495 1050285903 /nfs/dbraw/zinc/28/59/03/1050285903.db2.gz ONIUSVQMDLSORD-UHFFFAOYSA-N -1 3 327.714 4.131 20 0 EIADHM O=C(Nc1ccc(F)c([O-])c1)c1ccc(OC(F)(F)C(F)F)cc1 ZINC001186685935 1050383929 /nfs/dbraw/zinc/38/39/29/1050383929.db2.gz BZPRTQGLBMEHLM-UHFFFAOYSA-N -1 3 347.239 4.020 20 0 EIADHM CC(C)(C)OC(=O)c1ccc(C(=O)Nc2cc([O-])cc(Cl)c2)cc1 ZINC001186870206 1050429695 /nfs/dbraw/zinc/42/96/95/1050429695.db2.gz WUTINIJMPHTWPY-UHFFFAOYSA-N -1 3 347.798 4.253 20 0 EIADHM Cc1cc(F)c(S(=O)(=O)[N-][C@@H](CCC(C)C)C(C)(C)C)cc1F ZINC001187005724 1050457373 /nfs/dbraw/zinc/45/73/73/1050457373.db2.gz OTKOFMZAOQSOPB-INIZCTEOSA-N -1 3 347.471 4.402 20 0 EIADHM O=C(Nc1cc(F)cc(F)c1)Nc1c([O-])cccc1C(F)(F)F ZINC001187577877 1050577257 /nfs/dbraw/zinc/57/72/57/1050577257.db2.gz SQYQJPSPFWXJRV-UHFFFAOYSA-N -1 3 332.228 4.333 20 0 EIADHM O=C(Nc1ccc(F)c([O-])c1)c1cccc(COc2ccccc2)c1 ZINC001187967643 1050669604 /nfs/dbraw/zinc/66/96/04/1050669604.db2.gz IUHSYRYQGOZQBF-UHFFFAOYSA-N -1 3 337.350 4.363 20 0 EIADHM O=C([N-]c1nnc(C2CCCCC2)s1)c1ccnc(Cl)c1F ZINC000763553439 1050749356 /nfs/dbraw/zinc/74/93/56/1050749356.db2.gz SQEWDSUVUGROAJ-UHFFFAOYSA-N -1 3 340.811 4.026 20 0 EIADHM O=C(NC1CCCCC1)c1ccc(Nc2ccc([O-])c(F)c2F)cc1 ZINC001174084293 1050759769 /nfs/dbraw/zinc/75/97/69/1050759769.db2.gz SZLABUGGJOIOHF-UHFFFAOYSA-N -1 3 346.377 4.477 20 0 EIADHM CC1CCN(C(=O)c2ccc(Nc3ncc(Cl)cc3[O-])cc2)CC1 ZINC001174157523 1050797916 /nfs/dbraw/zinc/79/79/16/1050797916.db2.gz BPDLDNMNKCZMOT-UHFFFAOYSA-N -1 3 345.830 4.056 20 0 EIADHM O=C(c1cccc(Nc2ccc([O-])c(Cl)c2)c1)N1CCCCC1 ZINC001174174297 1050814792 /nfs/dbraw/zinc/81/47/92/1050814792.db2.gz JMYHGVSLSVCKFW-UHFFFAOYSA-N -1 3 330.815 4.415 20 0 EIADHM CCOC(=O)c1cccc(NC(=O)Nc2ccc(C)c([O-])c2Cl)c1 ZINC001188672396 1050830075 /nfs/dbraw/zinc/83/00/75/1050830075.db2.gz HAILIMUKXYWKIU-UHFFFAOYSA-N -1 3 348.786 4.175 20 0 EIADHM C[C@H]1CN(Cc2cccc([O-])c2Br)[C@@H]1c1ccccc1 ZINC001180143357 1050886345 /nfs/dbraw/zinc/88/63/45/1050886345.db2.gz WDQPYBNKKDPDHQ-SJCJKPOMSA-N -1 3 332.241 4.348 20 0 EIADHM C[C@@H]1CC[C@@H]([N-]S(=O)(=O)c2cc(Cl)ccc2Cl)C[C@@H]1C ZINC001189050160 1050893860 /nfs/dbraw/zinc/89/38/60/1050893860.db2.gz ZTBHBUVRZHTHAX-JFGNBEQYSA-N -1 3 336.284 4.096 20 0 EIADHM COc1cccc(CN(Cc2c(F)ccc([O-])c2F)CC(C)C)c1 ZINC001180154864 1050901111 /nfs/dbraw/zinc/90/11/11/1050901111.db2.gz YAJZKULXEGBJAO-UHFFFAOYSA-N -1 3 335.394 4.337 20 0 EIADHM O=S(=O)(CCc1ccc(Cl)cc1)[N-]c1cc(F)cc(Cl)c1 ZINC001189101375 1050909409 /nfs/dbraw/zinc/90/94/09/1050909409.db2.gz XETBWJCNBUEERS-UHFFFAOYSA-N -1 3 348.226 4.117 20 0 EIADHM CC(C)n1cnc2cc(Nc3ncc(Br)cc3[O-])ccc21 ZINC001174381319 1050942437 /nfs/dbraw/zinc/94/24/37/1050942437.db2.gz WAOROHPDQUWGOW-UHFFFAOYSA-N -1 3 347.216 4.224 20 0 EIADHM Cc1c(NCc2ccc([O-])c(F)c2)cnn1-c1cc(C)ccc1C ZINC001180339318 1050957997 /nfs/dbraw/zinc/95/79/97/1050957997.db2.gz NWQTVDNPWXGGDL-UHFFFAOYSA-N -1 3 325.387 4.254 20 0 EIADHM O=C(Nc1cncc([O-])c1)Nc1c(Cl)cccc1C(F)(F)F ZINC001189447378 1050994351 /nfs/dbraw/zinc/99/43/51/1050994351.db2.gz MZRACIMJDDHOAC-UHFFFAOYSA-N -1 3 331.681 4.103 20 0 EIADHM CCc1cccc(CC)c1NC(=O)Nc1cccc(C(C)=O)c1[O-] ZINC001189773015 1051059712 /nfs/dbraw/zinc/05/97/12/1051059712.db2.gz UMCJEIDYGSABGR-UHFFFAOYSA-N -1 3 326.396 4.364 20 0 EIADHM Cc1cc(S(=O)(=O)[N-]C[C@@H]2CCC[C@@H](C)[C@H]2C)sc1Cl ZINC001189793720 1051066787 /nfs/dbraw/zinc/06/67/87/1051066787.db2.gz LSHYNRZLWLYPHK-JLLWLGSASA-N -1 3 335.922 4.061 20 0 EIADHM [O-]c1ccc(CN2CCn3c(cc4cc(Cl)ccc43)C2)cc1F ZINC001180872342 1051096124 /nfs/dbraw/zinc/09/61/24/1051096124.db2.gz CKWUFKMIJMWADR-UHFFFAOYSA-N -1 3 330.790 4.155 20 0 EIADHM CCCCC[C@H]1CCCCN1C(=O)c1cc(=O)c2ccccc2[n-]1 ZINC000620563775 1051156162 /nfs/dbraw/zinc/15/61/62/1051156162.db2.gz QAGCXGYDXJKQJF-HNNXBMFYSA-N -1 3 326.440 4.103 20 0 EIADHM Cc1nc(C(F)(F)F)c(C(=O)[N-]c2cc(CC(C)(C)C)no2)s1 ZINC001190488091 1051188393 /nfs/dbraw/zinc/18/83/93/1051188393.db2.gz FMHSKWSWLWRVER-UHFFFAOYSA-N -1 3 347.362 4.299 20 0 EIADHM O=C(Nc1ccc(Cl)cc1[O-])[C@@H]1SCCc2sccc21 ZINC000153550799 1051193019 /nfs/dbraw/zinc/19/30/19/1051193019.db2.gz LXPNWMMFQZLVOP-CYBMUJFWSA-N -1 3 325.842 4.076 20 0 EIADHM [O-]c1c(F)cc(Br)cc1Nc1cc(F)c(F)c(F)c1 ZINC001174960003 1051275338 /nfs/dbraw/zinc/27/53/38/1051275338.db2.gz DELCFIHZRSPSHN-UHFFFAOYSA-N -1 3 336.082 4.455 20 0 EIADHM [O-]c1cc(F)c(Nc2ccc(Br)c(F)c2F)c(F)c1 ZINC001175099495 1051345579 /nfs/dbraw/zinc/34/55/79/1051345579.db2.gz JSCZRFKHJLRJQC-UHFFFAOYSA-N -1 3 336.082 4.455 20 0 EIADHM [O-]c1cc(F)c(Nc2ccc(OC3CCOCC3)c(F)c2)c(F)c1 ZINC001175099569 1051346164 /nfs/dbraw/zinc/34/61/64/1051346164.db2.gz NCVXWQUQVFTEEU-UHFFFAOYSA-N -1 3 339.313 4.111 20 0 EIADHM O=c1cc(Nc2ccc(F)cc2C(F)(F)F)[n-]n1-c1ccccc1 ZINC001175101127 1051347615 /nfs/dbraw/zinc/34/76/15/1051347615.db2.gz RTSOAOHAKQLLTR-UHFFFAOYSA-N -1 3 337.276 4.479 20 0 EIADHM [O-]c1cc(F)c(Nc2ccc3cnn([C@H]4CCCCO4)c3c2)c(F)c1 ZINC001175100586 1051347790 /nfs/dbraw/zinc/34/77/90/1051347790.db2.gz XAAQZWGVKNAYMN-QGZVFWFLSA-N -1 3 345.349 4.463 20 0 EIADHM O=c1cc(Nc2cccc(C(F)(F)F)c2F)[n-]n1-c1ccccc1 ZINC001175134639 1051401447 /nfs/dbraw/zinc/40/14/47/1051401447.db2.gz WETRRTVAHFDPGI-UHFFFAOYSA-N -1 3 337.276 4.479 20 0 EIADHM CCCCc1ccc(S(=O)(=O)[N-]c2cc(Cl)ncc2F)cc1 ZINC001191232992 1051405210 /nfs/dbraw/zinc/40/52/10/1051405210.db2.gz ISAJGHJDOXFJAD-UHFFFAOYSA-N -1 3 342.823 4.018 20 0 EIADHM CCCCc1ccc(S(=O)(=O)[N-]c2ncc(F)cc2Cl)cc1 ZINC001191234076 1051407674 /nfs/dbraw/zinc/40/76/74/1051407674.db2.gz YJDQMUHRCDJUPQ-UHFFFAOYSA-N -1 3 342.823 4.018 20 0 EIADHM Cc1cc([O-])c(NC(=O)NC2CCCCCC2)cc1Br ZINC001191273267 1051413185 /nfs/dbraw/zinc/41/31/85/1051413185.db2.gz PBAYFVXKMDIXAQ-UHFFFAOYSA-N -1 3 341.249 4.307 20 0 EIADHM [O-]c1ccc(F)c(Nc2cncc(OCc3ccccc3)c2)c1F ZINC001175262957 1051501285 /nfs/dbraw/zinc/50/12/85/1051501285.db2.gz FDWHBKYBABKWJZ-UHFFFAOYSA-N -1 3 328.318 4.388 20 0 EIADHM COc1ccc(Nc2c(F)ccc([O-])c2F)c(Br)c1 ZINC001175265343 1051501580 /nfs/dbraw/zinc/50/15/80/1051501580.db2.gz MBUWISFJZCFLNW-UHFFFAOYSA-N -1 3 330.128 4.185 20 0 EIADHM COc1cc(Br)c(Nc2c(F)ccc([O-])c2F)cc1C ZINC001175268852 1051503158 /nfs/dbraw/zinc/50/31/58/1051503158.db2.gz ZHUXJVJVINFEQO-UHFFFAOYSA-N -1 3 344.155 4.494 20 0 EIADHM CCc1cc(Br)ncc1Nc1c(F)ccc([O-])c1F ZINC001175265557 1051504918 /nfs/dbraw/zinc/50/49/18/1051504918.db2.gz GEBMHRDWQBQCRK-UHFFFAOYSA-N -1 3 329.144 4.134 20 0 EIADHM CCOC(=O)c1cc(F)c(C)c(Nc2c(F)ccc([O-])c2F)c1 ZINC001175269129 1051507407 /nfs/dbraw/zinc/50/74/07/1051507407.db2.gz DBRPNWWHGXWWDB-UHFFFAOYSA-N -1 3 325.286 4.038 20 0 EIADHM COc1ccc(C(=O)Nc2cc([O-])cc(Cl)c2)cc1OCC1CC1 ZINC001191643616 1051508036 /nfs/dbraw/zinc/50/80/36/1051508036.db2.gz BSHAHXFWCSUASK-UHFFFAOYSA-N -1 3 347.798 4.095 20 0 EIADHM O=c1cc(Nc2c(F)c(F)c(F)c(F)c2F)[n-]n1-c1ccccc1 ZINC001175382990 1051562468 /nfs/dbraw/zinc/56/24/68/1051562468.db2.gz JEYFPIWYCHMXFF-UHFFFAOYSA-N -1 3 341.239 4.017 20 0 EIADHM CC(=O)c1cc(Cl)c(Nc2ccc(-c3nn[n-]n3)cc2)c(Cl)c1 ZINC001175429895 1051585909 /nfs/dbraw/zinc/58/59/09/1051585909.db2.gz UPJRLQIUCIOFIX-UHFFFAOYSA-N -1 3 348.193 4.120 20 0 EIADHM COc1cccc(-c2cccc(Nc3ccc(-c4nn[n-]n4)cc3)c2)c1 ZINC001175428949 1051586199 /nfs/dbraw/zinc/58/61/99/1051586199.db2.gz CNKJUIJSNYMDGA-UHFFFAOYSA-N -1 3 343.390 4.286 20 0 EIADHM CC(C)n1nc(-c2ccccc2)cc1Nc1ccc(-c2nn[n-]n2)cc1 ZINC001175427071 1051588439 /nfs/dbraw/zinc/58/84/39/1051588439.db2.gz HDPUPPFYXNSHMW-UHFFFAOYSA-N -1 3 345.410 4.055 20 0 EIADHM CCc1cccc(C(=O)Nc2ccc(N3CCCCC3)c(F)c2)c1[O-] ZINC001175641789 1051689127 /nfs/dbraw/zinc/68/91/27/1051689127.db2.gz QGSUVJWKJGBKFK-UHFFFAOYSA-N -1 3 342.414 4.336 20 0 EIADHM CN(CCC(=O)c1cccs1)C(=O)c1ccc(C(C)(C)C)cc1[O-] ZINC001192322518 1051689642 /nfs/dbraw/zinc/68/96/42/1051689642.db2.gz BVHXTRBTJMPQNF-UHFFFAOYSA-N -1 3 345.464 4.096 20 0 EIADHM CC(C)(C)c1ccc(C(=O)N2CCC[C@H]2c2nccs2)c([O-])c1 ZINC001192322861 1051691918 /nfs/dbraw/zinc/69/19/18/1051691918.db2.gz QIBMKQGOTSFQTE-AWEZNQCLSA-N -1 3 330.453 4.124 20 0 EIADHM Cc1cccnc1[C@H](NC(=O)c1ccc(C(C)(C)C)cc1[O-])C1CC1 ZINC001192336103 1051694127 /nfs/dbraw/zinc/69/41/27/1051694127.db2.gz RNLGNKDNKLOFAW-LJQANCHMSA-N -1 3 338.451 4.274 20 0 EIADHM Cc1ccc(OCc2ccccc2)c(Nc2ccc(C(N)=O)c([O-])c2)c1 ZINC001175719560 1051739358 /nfs/dbraw/zinc/73/93/58/1051739358.db2.gz KNJWJRZVMPGUMZ-UHFFFAOYSA-N -1 3 348.402 4.122 20 0 EIADHM CC(C)Nc1cccc(F)c1[N-]S(=O)(=O)c1ccc(Cl)cc1 ZINC000158868071 1051795378 /nfs/dbraw/zinc/79/53/78/1051795378.db2.gz QKPPLJVPYMPHSN-UHFFFAOYSA-N -1 3 342.823 4.100 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)N[C@@H](c1ccc(F)cc1)C1CCC1 ZINC000159060345 1051808772 /nfs/dbraw/zinc/80/87/72/1051808772.db2.gz NDAWCVHCAWZOML-GOSISDBHSA-N -1 3 346.377 4.011 20 0 EIADHM C[C@H](CC1CCCC1)C(=O)Nc1n[n-]c(-c2cc3ccccc3o2)n1 ZINC001183367776 1051835946 /nfs/dbraw/zinc/83/59/46/1051835946.db2.gz KPBDWKUFBYSYQD-GFCCVEGCSA-N -1 3 338.411 4.373 20 0 EIADHM CC[C@H](C)Sc1ccc(NC([O-])=NO[C@H]2CCCCO2)c(C)c1 ZINC000775581688 1051890546 /nfs/dbraw/zinc/89/05/46/1051890546.db2.gz INJUTYGRWDRXMS-BBRMVZONSA-N -1 3 338.473 4.465 20 0 EIADHM CC[C@H](C)Sc1ccc(NC(=O)[N-]O[C@H]2CCCCO2)c(C)c1 ZINC000775581688 1051890556 /nfs/dbraw/zinc/89/05/56/1051890556.db2.gz INJUTYGRWDRXMS-BBRMVZONSA-N -1 3 338.473 4.465 20 0 EIADHM CCCCOc1ccc(C(=O)NCC2C[C@@H](C)C[C@H](C)C2)c([O-])c1 ZINC001183953058 1051931422 /nfs/dbraw/zinc/93/14/22/1051931422.db2.gz YCXAQKDXGIBQFQ-GJZGRUSLSA-N -1 3 333.472 4.373 20 0 EIADHM COc1cccc(-c2nc(C3(c4ccc(F)cc4)CCC3)no2)c1[O-] ZINC000621809779 1051964491 /nfs/dbraw/zinc/96/44/91/1051964491.db2.gz LYOCQBGPURYHSQ-UHFFFAOYSA-N -1 3 340.354 4.060 20 0 EIADHM CC[C@H](NC(=O)c1cc([O-])cc(C(F)(F)F)c1)c1nc(C)cs1 ZINC000621856778 1051980325 /nfs/dbraw/zinc/98/03/25/1051980325.db2.gz DEBKLEXPQLXPRB-LBPRGKRZSA-N -1 3 344.358 4.057 20 0 EIADHM O=C(NCc1ccccc1C1CC1)c1ccc([O-])cc1C(F)(F)F ZINC001193758069 1051991022 /nfs/dbraw/zinc/99/10/22/1051991022.db2.gz KNHWLRVUQRKWFG-UHFFFAOYSA-N -1 3 335.325 4.218 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)N(Cc1ccc(Cl)cc1)C1CC1 ZINC000163777623 1052005738 /nfs/dbraw/zinc/00/57/38/1052005738.db2.gz LLXHWTWPCLWJHK-UHFFFAOYSA-N -1 3 348.805 4.059 20 0 EIADHM O=S(=O)([N-]CCCC1CCCC1)c1cc(Cl)ccc1Cl ZINC001184462603 1052016625 /nfs/dbraw/zinc/01/66/25/1052016625.db2.gz MZMRKEWUAVTFOT-UHFFFAOYSA-N -1 3 336.284 4.242 20 0 EIADHM Cc1cccc([N-]S(=O)(=O)c2ccc(C)c3ccccc32)c1F ZINC001193858064 1052016747 /nfs/dbraw/zinc/01/67/47/1052016747.db2.gz SYWGJFBRRYDLTD-UHFFFAOYSA-N -1 3 329.396 4.397 20 0 EIADHM O=C(Nc1ccc(F)c([O-])c1)C1(CC2CC2)CCC(F)(F)CC1 ZINC001184665100 1052075643 /nfs/dbraw/zinc/07/56/43/1052075643.db2.gz XFXSBAKMVNFSPB-UHFFFAOYSA-N -1 3 327.346 4.466 20 0 EIADHM CCN(CC)C(=O)c1cc(Nc2ccc([O-])c(Cl)c2)ccc1F ZINC001176518462 1052106845 /nfs/dbraw/zinc/10/68/45/1052106845.db2.gz ZQANMYJQMPCPDF-UHFFFAOYSA-N -1 3 336.794 4.410 20 0 EIADHM COc1ccc(OC(=O)Nc2ccc(C(F)(F)F)cc2[O-])cc1 ZINC001194534738 1052165791 /nfs/dbraw/zinc/16/57/91/1052165791.db2.gz IEBNKRDXFGHVLE-UHFFFAOYSA-N -1 3 327.258 4.031 20 0 EIADHM COc1ccccc1NC(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000622272771 1052171636 /nfs/dbraw/zinc/17/16/36/1052171636.db2.gz HYKALVNHPBAKOU-UHFFFAOYSA-N -1 3 333.387 4.244 20 0 EIADHM O=S(=O)(Cc1cc(F)cc(F)c1)[N-]c1cccc2sccc21 ZINC001185134723 1052180599 /nfs/dbraw/zinc/18/05/99/1052180599.db2.gz ATEJIKMDLTVUCF-UHFFFAOYSA-N -1 3 339.388 4.121 20 0 EIADHM CC[C@H](CNC(=O)c1cc([O-])cc(C(F)(F)F)c1)c1ccccc1 ZINC000622286404 1052182243 /nfs/dbraw/zinc/18/22/43/1052182243.db2.gz CYGMRDNAGBBODP-GFCCVEGCSA-N -1 3 337.341 4.335 20 0 EIADHM CCc1ccc(C(=O)N2CCC(Cc3cccc(F)c3)CC2)c([O-])c1 ZINC000622313689 1052201517 /nfs/dbraw/zinc/20/15/17/1052201517.db2.gz YNATZYYGRPHNNH-UHFFFAOYSA-N -1 3 341.426 4.189 20 0 EIADHM O=C(Nc1cc(Br)ccc1[O-])c1ncccc1C1CCC1 ZINC001185276935 1052208025 /nfs/dbraw/zinc/20/80/25/1052208025.db2.gz DBZBGMHHRAAQKV-UHFFFAOYSA-N -1 3 347.212 4.070 20 0 EIADHM COc1c(Cl)cc(NC(=O)Cc2ccc([O-])c(F)c2)cc1Cl ZINC000622344573 1052219033 /nfs/dbraw/zinc/21/90/33/1052219033.db2.gz XHELPPCUSAMIHA-UHFFFAOYSA-N -1 3 344.169 4.028 20 0 EIADHM CC[C@H](NC(=O)c1cc(Cc2ccccc2)ccc1[O-])c1ccncc1 ZINC000622388676 1052242574 /nfs/dbraw/zinc/24/25/74/1052242574.db2.gz ZKXVJQVMVAVSQS-FQEVSTJZSA-N -1 3 346.430 4.259 20 0 EIADHM Cc1cc(F)ccc1[C@@H]1CCCN1C(=O)c1cc([O-])ccc1Cl ZINC000622667625 1052371959 /nfs/dbraw/zinc/37/19/59/1052371959.db2.gz MZAXLONCCWGXFM-KRWDZBQOSA-N -1 3 333.790 4.470 20 0 EIADHM CCc1ccc([O-])c(C(=O)N2CCC[C@H]2c2ccc(F)cc2C)c1 ZINC000622667782 1052382006 /nfs/dbraw/zinc/38/20/06/1052382006.db2.gz SMNDVVIJHUVWGN-SFHVURJKSA-N -1 3 327.399 4.379 20 0 EIADHM CC(C)(C)C[C@@H]1CCN(C(=O)c2cc([O-])cc(C(F)(F)F)c2)C1 ZINC000622673398 1052383148 /nfs/dbraw/zinc/38/31/48/1052383148.db2.gz MNAMWIAYNFPUND-NSHDSACASA-N -1 3 329.362 4.309 20 0 EIADHM O=C(Nc1cc(F)ccc1[O-])c1cc(Cl)ccc1OC(F)F ZINC000174880915 1052577014 /nfs/dbraw/zinc/57/70/14/1052577014.db2.gz YWWSTTBHQMLYDD-UHFFFAOYSA-N -1 3 331.677 4.038 20 0 EIADHM CC(C)Cc1ccc(C(=O)CCC(=O)Nc2cccc([O-])c2F)cc1 ZINC000179147941 1052724865 /nfs/dbraw/zinc/72/48/65/1052724865.db2.gz HPUIVDRFTUEINY-UHFFFAOYSA-N -1 3 343.398 4.331 20 0 EIADHM C[C@@H](CC(=O)Nc1cccc([O-])c1F)C(=O)c1ccc(Cl)cc1 ZINC000180928080 1052819081 /nfs/dbraw/zinc/81/90/81/1052819081.db2.gz YBUWUHJJBPHFAS-JTQLQIEISA-N -1 3 335.762 4.032 20 0 EIADHM c1c2ccccc2oc1C[N-]c1nnc([C@@H]2Cc3ccccc3O2)o1 ZINC000181957220 1052905238 /nfs/dbraw/zinc/90/52/38/1052905238.db2.gz PRGNVCHRKMLVBV-KRWDZBQOSA-N -1 3 333.347 4.104 20 0 EIADHM Cc1cccc([N-]S(=O)(=O)c2c[nH]c3cccc(F)c32)c1Cl ZINC000185259533 1053014623 /nfs/dbraw/zinc/01/46/23/1053014623.db2.gz YLBWWXZQLUQOEA-UHFFFAOYSA-N -1 3 338.791 4.070 20 0 EIADHM Cc1nn(-c2cc(C)ccc2C)c(Cl)c1C=Cc1nccc(=O)[n-]1 ZINC000764433174 1053100358 /nfs/dbraw/zinc/10/03/58/1053100358.db2.gz DJZJRVNZUKJEOD-SREVYHEPSA-N -1 3 340.814 4.117 20 0 EIADHM CC(C)(C)Oc1cccc(CN[C@@H](CC(=O)[O-])c2cccs2)c1 ZINC000864510334 1053296577 /nfs/dbraw/zinc/29/65/77/1053296577.db2.gz ZXWBYUYWKFUQKH-HNNXBMFYSA-N -1 3 333.453 4.231 20 0 EIADHM O=C([O-])C[C@@H](CNCc1csc(C2CC2)n1)C1CCCCCC1 ZINC000864523329 1053303823 /nfs/dbraw/zinc/30/38/23/1053303823.db2.gz XXCIOIKWCDFOQF-HNNXBMFYSA-N -1 3 336.501 4.171 20 0 EIADHM Cc1cc(C(C)(C)C)cc(C)c1NS(=O)(=O)c1ccc([O-])cc1 ZINC001195795637 1053488147 /nfs/dbraw/zinc/48/81/47/1053488147.db2.gz FKYKVFWDTKENDU-UHFFFAOYSA-N -1 3 333.453 4.107 20 0 EIADHM Cc1c([O-])ccc2c(CN[C@H](C)c3ccccc3Cl)cc(=O)oc12 ZINC000008173037 1053544617 /nfs/dbraw/zinc/54/46/17/1053544617.db2.gz BFXIOLMCUSCHRS-GFCCVEGCSA-N -1 3 343.810 4.311 20 0 EIADHM COc1ccc(NC(=O)c2cc([O-])c3ccccc3c2)cc1Cl ZINC000471563726 1053621083 /nfs/dbraw/zinc/62/10/83/1053621083.db2.gz PPRCGZJRDZRJHV-UHFFFAOYSA-N -1 3 327.767 4.460 20 0 EIADHM Cc1ccc(C(=O)N2CCC(c3ccnc4ccccc43)CC2)c([O-])c1 ZINC000854757263 1053843279 /nfs/dbraw/zinc/84/32/79/1053843279.db2.gz HAKGNDUBHNFNNN-UHFFFAOYSA-N -1 3 346.430 4.269 20 0 EIADHM O=S(=O)(Cc1ccccc1Oc1ccccc1)c1cccc([O-])c1 ZINC000544596906 1053849685 /nfs/dbraw/zinc/84/96/85/1053849685.db2.gz ZMMXDNJVFNEALB-UHFFFAOYSA-N -1 3 340.400 4.158 20 0 EIADHM [O-]c1cc(NC(=S)Nc2ccccc2C(F)(F)F)ccc1F ZINC001197260506 1053863705 /nfs/dbraw/zinc/86/37/05/1053863705.db2.gz RWTUPMCADFSRTR-UHFFFAOYSA-N -1 3 330.306 4.359 20 0 EIADHM Cc1ccc(NC(=S)Nc2ccc([O-])c(Br)c2)cc1 ZINC001197922912 1054023397 /nfs/dbraw/zinc/02/33/97/1054023397.db2.gz HEJPMDLMWIBVAV-UHFFFAOYSA-N -1 3 337.242 4.272 20 0 EIADHM C[C@@H]([N-]S(=O)(=O)c1cc(Cl)sc1Cl)c1ccccc1 ZINC000032548411 1054105177 /nfs/dbraw/zinc/10/51/77/1054105177.db2.gz ODMHKYAXHUGTRA-MRVPVSSYSA-N -1 3 336.265 4.094 20 0 EIADHM O=C(CCc1ccccc1C(F)(F)F)[N-]OCCCC(F)(F)F ZINC000871217501 1054172975 /nfs/dbraw/zinc/17/29/75/1054172975.db2.gz JFMDETPFWQLNFP-UHFFFAOYSA-N -1 3 343.267 4.028 20 0 EIADHM C=CS(=O)(=O)[N-]c1cccnc1Oc1ccccc1C(C)(C)C ZINC001198579032 1054192886 /nfs/dbraw/zinc/19/28/86/1054192886.db2.gz IHNBPCZYTZWKHS-UHFFFAOYSA-N -1 3 332.425 4.057 20 0 EIADHM CC(C)c1ccc(C(=O)N2CCC[C@H](OC3CCC3)CC2)c([O-])c1 ZINC000871328196 1054193370 /nfs/dbraw/zinc/19/33/70/1054193370.db2.gz FVJNOKUNLNJELY-KRWDZBQOSA-N -1 3 331.456 4.079 20 0 EIADHM C[C@H](CC(=O)[N-]OCc1ccc(C(F)(F)F)cc1)c1ccccc1 ZINC000857473086 1054265482 /nfs/dbraw/zinc/26/54/82/1054265482.db2.gz JCWYGUHBUPVEKA-CYBMUJFWSA-N -1 3 337.341 4.447 20 0 EIADHM CCc1cc2c([n-]c(COc3ccc4ccccc4c3)nc2=O)s1 ZINC000045111883 1054315504 /nfs/dbraw/zinc/31/55/04/1054315504.db2.gz PRGSCNOWGHJFDV-UHFFFAOYSA-N -1 3 336.416 4.279 20 0 EIADHM CCc1ccc(Cl)cc1[N-]S(=O)(=O)c1ccc(OC)cc1C ZINC001198951114 1054320564 /nfs/dbraw/zinc/32/05/64/1054320564.db2.gz NZQOPKCYAQMWDE-UHFFFAOYSA-N -1 3 339.844 4.020 20 0 EIADHM O=C(COC(=O)c1cc(Cl)c(Cl)[n-]1)c1ccc(Cl)cc1 ZINC000011808715 1054320734 /nfs/dbraw/zinc/32/07/34/1054320734.db2.gz QNCIQQGARULCOR-UHFFFAOYSA-N -1 3 332.570 4.015 20 0 EIADHM C[C@H](Nc1ccc(OC[C@@H]2CCCO2)cc1)c1cccc([O-])c1F ZINC000872055814 1054365800 /nfs/dbraw/zinc/36/58/00/1054365800.db2.gz LHBTWPCLQUBBLG-BBRMVZONSA-N -1 3 331.387 4.262 20 0 EIADHM O=C(Nc1cc(Br)ccc1[O-])c1ccc(C2CCC2)nc1 ZINC001199289631 1054380132 /nfs/dbraw/zinc/38/01/32/1054380132.db2.gz ZVNTWEMUAORCHF-UHFFFAOYSA-N -1 3 347.212 4.070 20 0 EIADHM C[C@@H](NCc1cccc([O-])c1Cl)c1ccc(C(F)(F)F)nc1 ZINC000873184239 1054502869 /nfs/dbraw/zinc/50/28/69/1054502869.db2.gz HQOSOVLIQHXTKN-SECBINFHSA-N -1 3 330.737 4.310 20 0 EIADHM CCC[C@H](CC)C(=O)Nc1cccc(-c2nc(CC)cc(=O)[n-]2)c1 ZINC000874072612 1054618621 /nfs/dbraw/zinc/61/86/21/1054618621.db2.gz TWVUZLPYPXHPQK-ZDUSSCGKSA-N -1 3 327.428 4.176 20 0 EIADHM Cc1csc([C@@H]2CCN(C(=O)c3cc4sccc4c([O-])c3)C2)n1 ZINC000874497437 1054688079 /nfs/dbraw/zinc/68/80/79/1054688079.db2.gz BNLSYTPXRRQCFY-LLVKDONJSA-N -1 3 344.461 4.002 20 0 EIADHM Cc1cc(Br)c(C(=O)[N-]c2nc(C(C)C)ns2)s1 ZINC000874692491 1054717793 /nfs/dbraw/zinc/71/77/93/1054717793.db2.gz XKFAVYUHYRGZMW-UHFFFAOYSA-N -1 3 346.275 4.046 20 0 EIADHM Cc1cc(C)cc(NC(=S)Nc2nc3c(cccc3[O-])s2)c1 ZINC001201193061 1054714089 /nfs/dbraw/zinc/71/40/89/1054714089.db2.gz CLWUSYDZWSPOLA-UHFFFAOYSA-N -1 3 329.450 4.428 20 0 EIADHM Cc1cc(C)cc(NC(=S)Nc2cc(=O)n(-c3ccccc3)[n-]2)c1 ZINC001201198375 1054714898 /nfs/dbraw/zinc/71/48/98/1054714898.db2.gz AZHWBOZNMGDRGY-UHFFFAOYSA-N -1 3 338.436 4.004 20 0 EIADHM C[C@@H]1CN(Cc2ccc(-c3ccccc3C(=O)[O-])o2)C[C@@H](C)C1(F)F ZINC000859818893 1054737800 /nfs/dbraw/zinc/73/78/00/1054737800.db2.gz XAUMYWLPNUWKFH-CHWSQXEVSA-N -1 3 349.377 4.368 20 0 EIADHM CC(C)Oc1cc(Cl)c(C=C2SC(=O)[N-]C2=O)cc1Cl ZINC000874930271 1054743070 /nfs/dbraw/zinc/74/30/70/1054743070.db2.gz ZLPCTOJXTVPKPR-WCIBSUBMSA-N -1 3 332.208 4.105 20 0 EIADHM CCc1c(C)sc2[n-]c(COc3ccc(Cl)cc3)nc(=O)c12 ZINC000063579517 1054816139 /nfs/dbraw/zinc/81/61/39/1054816139.db2.gz YNLDAWCPSIKBSU-UHFFFAOYSA-N -1 3 334.828 4.088 20 0 EIADHM CC(=O)c1cc(Cl)c(Nc2cncc([O-])c2)c(C(F)(F)F)c1 ZINC001201641108 1054874639 /nfs/dbraw/zinc/87/46/39/1054874639.db2.gz IZJJGXFDFZOXCE-UHFFFAOYSA-N -1 3 330.693 4.406 20 0 EIADHM Cc1c(C)c(C)c(S(=O)(=O)[N-]c2ccc3oncc3c2)c(C)c1C ZINC001201799784 1054909029 /nfs/dbraw/zinc/90/90/29/1054909029.db2.gz OEOFRVVQMBUJHE-UHFFFAOYSA-N -1 3 344.436 4.171 20 0 EIADHM Cc1nc(C(F)(F)F)ccc1C(=O)Nc1cc(Cl)ccc1[O-] ZINC000067138895 1055028519 /nfs/dbraw/zinc/02/85/19/1055028519.db2.gz NQIBMVOTVDTYJP-UHFFFAOYSA-N -1 3 330.693 4.020 20 0 EIADHM CN(Cc1ccc(F)cc1F)C(=O)c1cc([O-])c2ccccc2c1 ZINC000352302364 1055029762 /nfs/dbraw/zinc/02/97/62/1055029762.db2.gz AXULRVWFAWRNHK-UHFFFAOYSA-N -1 3 327.330 4.096 20 0 EIADHM O=C(N[C@@H](c1ccccn1)C1CCC1)c1cc2sccc2c([O-])c1 ZINC000862745966 1055105835 /nfs/dbraw/zinc/10/58/35/1055105835.db2.gz JYOKHFBJENKRRJ-GOSISDBHSA-N -1 3 338.432 4.273 20 0 EIADHM O=C([N-]c1nnc(-c2ccco2)s1)c1cc2cccc(Cl)c2o1 ZINC000084521781 1055107967 /nfs/dbraw/zinc/10/79/67/1055107967.db2.gz KSEOVXACNBSZAP-UHFFFAOYSA-N -1 3 345.767 4.450 20 0 EIADHM CCOC(=O)c1nc(C2CC2)oc1[N-]C(=O)Nc1cccc(Cl)c1 ZINC001202239675 1055113349 /nfs/dbraw/zinc/11/33/49/1055113349.db2.gz NBQCZADISWFYDZ-UHFFFAOYSA-N -1 3 349.774 4.026 20 0 EIADHM [O-]c1coc2cc(OCCOc3cc(Cl)ccc3Cl)ccc12 ZINC000642608472 1055377650 /nfs/dbraw/zinc/37/76/50/1055377650.db2.gz BOAUGKGEOIIZJS-UHFFFAOYSA-N -1 3 339.174 4.026 20 0 EIADHM CCOc1ccc(C[C@H](C)C(=O)Nc2c([O-])cccc2Cl)cc1 ZINC000655110415 1055479266 /nfs/dbraw/zinc/47/92/66/1055479266.db2.gz RNRCNAXZAXAEDY-LBPRGKRZSA-N -1 3 333.815 4.262 20 0 EIADHM CCC(CC)c1cc(C[N-]C(=O)C(F)(F)c2ccccc2F)on1 ZINC000765841363 1055832227 /nfs/dbraw/zinc/83/22/27/1055832227.db2.gz ZRMGALUXBBWACM-UHFFFAOYSA-N -1 3 340.345 4.126 20 0 EIADHM Cc1ccc(C)n1C1CCN(C(=O)c2cc([O-])c3ccccc3c2)CC1 ZINC000353779285 1056074740 /nfs/dbraw/zinc/07/47/40/1056074740.db2.gz PQNOORGUQITFLL-UHFFFAOYSA-N -1 3 348.446 4.441 20 0 EIADHM Cc1ccccc1[C@H](NC(=O)NCc1ccc([O-])c(F)c1)C(C)C ZINC000303744926 1056267722 /nfs/dbraw/zinc/26/77/22/1056267722.db2.gz AEUBSENYROXUFJ-GOSISDBHSA-N -1 3 330.403 4.036 20 0 EIADHM O=C(NCCc1c[nH]c2ccc(F)cc12)c1cc([O-])c2ccccc2c1 ZINC000354434008 1056505150 /nfs/dbraw/zinc/50/51/50/1056505150.db2.gz QCOGQWHCEZVCCU-UHFFFAOYSA-N -1 3 348.377 4.138 20 0 EIADHM CCCc1ccc(S(=O)(=O)[N-]c2ccc(OC)c(Cl)c2)cc1 ZINC000007428333 1056794445 /nfs/dbraw/zinc/79/44/45/1056794445.db2.gz NATFYENBGRLHKS-UHFFFAOYSA-N -1 3 339.844 4.102 20 0 EIADHM C[C@H](OC(=O)c1cc(-c2ccco2)[n-]n1)c1ncc(-c2ccccc2)o1 ZINC000741326707 1058199324 /nfs/dbraw/zinc/19/93/24/1058199324.db2.gz STBDOMXTEJMTET-LBPRGKRZSA-N -1 3 349.346 4.243 20 0 EIADHM C[C@H](OC(=O)c1cc(-c2ccco2)n[n-]1)c1ncc(-c2ccccc2)o1 ZINC000741326707 1058199339 /nfs/dbraw/zinc/19/93/39/1058199339.db2.gz STBDOMXTEJMTET-LBPRGKRZSA-N -1 3 349.346 4.243 20 0 EIADHM [O-]c1ccc(CNC(=S)Nc2cc(Cl)cc(Cl)c2)cc1F ZINC000737459986 1058495188 /nfs/dbraw/zinc/49/51/88/1058495188.db2.gz LIYCTPGRASBVAN-UHFFFAOYSA-N -1 3 345.226 4.325 20 0 EIADHM Cc1cc(=O)[n-]c(-c2cccc(OC(=O)CCc3ccccc3C)c2)n1 ZINC000744217619 1059334042 /nfs/dbraw/zinc/33/40/42/1059334042.db2.gz DJYFLPXRCYWDKR-UHFFFAOYSA-N -1 3 348.402 4.004 20 0 EIADHM Cc1cc(=O)[n-]c(-c2cccc(OC(=O)CCCC(C)(C)C)c2)n1 ZINC000744217239 1059335220 /nfs/dbraw/zinc/33/52/20/1059335220.db2.gz PABLCKOAFSEGRT-UHFFFAOYSA-N -1 3 328.412 4.279 20 0 EIADHM C[C@H](OC(=O)c1ccc([O-])cc1)c1nnc(-c2cccc(Cl)c2)o1 ZINC000745889878 1059908363 /nfs/dbraw/zinc/90/83/63/1059908363.db2.gz XRHGCIXTHIKWQG-JTQLQIEISA-N -1 3 344.754 4.014 20 0 EIADHM C[C@H](OC(=O)c1ccc([O-])cc1)c1nc(-c2ccc(Cl)cc2)no1 ZINC000746058814 1059996509 /nfs/dbraw/zinc/99/65/09/1059996509.db2.gz QXGFOXQMTDFJAF-JTQLQIEISA-N -1 3 344.754 4.014 20 0 EIADHM CC(C)CCOc1ccc(CN[C@@H](CC(=O)[O-])c2cccs2)cc1 ZINC000392115736 1060308013 /nfs/dbraw/zinc/30/80/13/1060308013.db2.gz XAXQVDASCGZCOR-KRWDZBQOSA-N -1 3 347.480 4.479 20 0 EIADHM CC(C)CCOc1ccc(CN[C@H](CC(=O)[O-])c2cccs2)cc1 ZINC000392115738 1060308531 /nfs/dbraw/zinc/30/85/31/1060308531.db2.gz XAXQVDASCGZCOR-QGZVFWFLSA-N -1 3 347.480 4.479 20 0 EIADHM CCCCCC[C@](C)(CCC)C(=O)N1Cc2nc(C)[n-]c(=O)c2C1 ZINC001168938522 1060530595 /nfs/dbraw/zinc/53/05/95/1060530595.db2.gz ILWWNNHTPACRCM-IBGZPJMESA-N -1 3 333.476 4.110 20 0 EIADHM CC(C)(C)OC(=O)NCc1cncc(Nc2ccc(Cl)c([O-])c2)c1 ZINC001212590638 1060841416 /nfs/dbraw/zinc/84/14/16/1060841416.db2.gz WSJWMLXQEIHKSB-UHFFFAOYSA-N -1 3 349.818 4.209 20 0 EIADHM CSc1ccccc1[C@H](C)NCc1nnc(-c2ccccc2[O-])o1 ZINC001169760782 1060950734 /nfs/dbraw/zinc/95/07/34/1060950734.db2.gz BBJMTRXUUJLKOB-LBPRGKRZSA-N -1 3 341.436 4.015 20 0 EIADHM CC(C)Cc1nnc([N-]C(=O)c2c(Cl)cccc2Cl)s1 ZINC000005909280 201667536 /nfs/dbraw/zinc/66/75/36/201667536.db2.gz LTCPHNVPQYIBNT-UHFFFAOYSA-N -1 3 330.240 4.296 20 0 EIADHM O=C(Nc1ccccc1[O-])c1cccc(NC(=O)C2CCCCC2)c1 ZINC000071891754 203139073 /nfs/dbraw/zinc/13/90/73/203139073.db2.gz PKUWYSPKNZYCKH-UHFFFAOYSA-N -1 3 338.407 4.163 20 0 EIADHM O=C(Cc1ccc([O-])c(F)c1)Nc1cccc(NC2CCCC2)c1 ZINC000449847951 1032062479 /nfs/dbraw/zinc/06/24/79/1032062479.db2.gz CTEQONLTCUBUQH-UHFFFAOYSA-N -1 3 328.387 4.067 20 0 EIADHM CC[C@H](CC(F)(F)F)C(=O)Nc1cc(Br)ccc1[O-] ZINC000450046003 1032248838 /nfs/dbraw/zinc/24/88/38/1032248838.db2.gz HRGDIXJMIUKPRI-SSDOTTSWSA-N -1 3 340.139 4.072 20 0 EIADHM Cc1cc(OC(F)F)c(C(=O)Nc2ccc(Cl)cc2[O-])s1 ZINC000532836483 1032341373 /nfs/dbraw/zinc/34/13/73/1032341373.db2.gz BFKHILWRUWATNU-UHFFFAOYSA-N -1 3 333.743 4.269 20 0 EIADHM COc1ccc(S[C@@H](C)C(=O)Nc2ccc(Cl)cc2[O-])cc1 ZINC000532837740 1032343753 /nfs/dbraw/zinc/34/37/53/1032343753.db2.gz RURHMHNWFJOVMW-JTQLQIEISA-N -1 3 337.828 4.174 20 0 EIADHM C[C@@H](CC(=O)Nc1ccc(Cl)cc1[O-])C(=O)c1cccc(F)c1 ZINC000533159264 1032514845 /nfs/dbraw/zinc/51/48/45/1032514845.db2.gz QZKLCZCMWXJPIL-JTQLQIEISA-N -1 3 335.762 4.032 20 0 EIADHM C[C@H]1C[C@@H](c2ccccc2)CCN1C(=O)c1cc([O-])ccc1Cl ZINC000512422225 1032728954 /nfs/dbraw/zinc/72/89/54/1032728954.db2.gz YHKYLNRHONOJLO-ZFWWWQNUSA-N -1 3 329.827 4.454 20 0 EIADHM Cc1cccc(Oc2ccccc2NC(=O)NCc2ncccc2[O-])c1 ZINC000471121243 1018999984 /nfs/dbraw/zinc/99/99/84/1018999984.db2.gz GZXMUUJUKCLCQL-UHFFFAOYSA-N -1 3 349.390 4.210 20 0 EIADHM C[C@@H](C(=O)Nc1ccc(Br)cc1[O-])c1ccccc1F ZINC000108988875 1019179611 /nfs/dbraw/zinc/17/96/11/1019179611.db2.gz ZOHFFGXPWIGWAD-SECBINFHSA-N -1 3 338.176 4.036 20 0 EIADHM Cc1ccc([N+](=O)[O-])cc1N=Cc1cc(Br)ccc1[O-] ZINC000254838838 1019344777 /nfs/dbraw/zinc/34/47/77/1019344777.db2.gz UKTIVKFSZLXYMG-UHFFFAOYSA-N -1 3 335.157 4.122 20 0 EIADHM COc1ccccc1[C@H]1CCCN1C(=O)c1cc([O-])ccc1Cl ZINC000339856201 1019939735 /nfs/dbraw/zinc/93/97/35/1019939735.db2.gz DMZIHRLZOHITJQ-MRXNPFEDSA-N -1 3 331.799 4.032 20 0 EIADHM O=C(Nc1ccc([O-])c(C(F)(F)F)c1)c1cc2sccc2[nH]1 ZINC000430307852 1020312879 /nfs/dbraw/zinc/31/28/79/1020312879.db2.gz SRXPUMUTEQGRAD-UHFFFAOYSA-N -1 3 326.299 4.206 20 0 EIADHM O=c1[n-]nc([C@H]2CCCN(Cc3sc4ccccc4c3Cl)C2)o1 ZINC000340217652 1020641125 /nfs/dbraw/zinc/64/11/25/1020641125.db2.gz JZYOMUUEGMPHPF-JTQLQIEISA-N -1 3 349.843 4.023 20 0 EIADHM COc1ccc(-c2nc3cc(C)ccc3n2C)c(Br)c1[O-] ZINC000544880712 1020661262 /nfs/dbraw/zinc/66/12/62/1020661262.db2.gz RUYHWBNHOSLFQE-UHFFFAOYSA-N -1 3 347.212 4.025 20 0 EIADHM Cc1noc(C)c1[N-]C(=O)c1occc1CSc1ccccc1 ZINC000340250797 1020685018 /nfs/dbraw/zinc/68/50/18/1020685018.db2.gz GACIBYNZKJRKPY-UHFFFAOYSA-N -1 3 328.393 4.429 20 0 EIADHM Cc1cccc(S(=O)(=O)[N-]c2ccc(OC(F)(F)F)cc2C)c1 ZINC000033615499 1020986553 /nfs/dbraw/zinc/98/65/53/1020986553.db2.gz BNUQFVHAHMQQAM-UHFFFAOYSA-N -1 3 345.342 4.003 20 0 EIADHM CC(C)c1ccc(-c2nc(CN3CC[C@H](C(=O)[O-])[C@@H]3C)cs2)cc1 ZINC000579968015 1021040050 /nfs/dbraw/zinc/04/00/50/1021040050.db2.gz DEKNFUUPSUTQGM-GUYCJALGSA-N -1 3 344.480 4.229 20 0 EIADHM CCO[C@@H](C)C(=O)Nc1ccc([O-])c(-c2nc3ccccc3s2)c1 ZINC000093095711 1021226233 /nfs/dbraw/zinc/22/62/33/1021226233.db2.gz ZRKFLNDHVJLKEZ-NSHDSACASA-N -1 3 342.420 4.032 20 0 EIADHM CC(=O)c1ccc(Oc2ccc(C(=O)Nc3ncccc3[O-])cc2)cc1 ZINC000340570919 1021534545 /nfs/dbraw/zinc/53/45/45/1021534545.db2.gz FWAAGBHOSAMRQF-UHFFFAOYSA-N -1 3 348.358 4.034 20 0 EIADHM CCOc1cc(Nc2cccc([O-])c2Cl)cnc1Br ZINC001210852073 1021800261 /nfs/dbraw/zinc/80/02/61/1021800261.db2.gz UTCCPQHBKAZFFN-UHFFFAOYSA-N -1 3 343.608 4.345 20 0 EIADHM Cc1cccc(CN[C@@H](CC(=O)[O-])c2cccc(C(F)(F)F)c2)c1 ZINC000340678972 1021906529 /nfs/dbraw/zinc/90/65/29/1021906529.db2.gz NQTNDIWTUXGYEL-INIZCTEOSA-N -1 3 337.341 4.319 20 0 EIADHM FC(F)(F)[C@@H](C[C@@H]1CCCO1)[N-]c1nc(C2CCCC2)ns1 ZINC000656227141 1022066272 /nfs/dbraw/zinc/06/62/72/1022066272.db2.gz JVNQDOVXCWVJDA-WDEREUQCSA-N -1 3 335.395 4.108 20 0 EIADHM CCC(CC)(CC)[S@@](=O)Cc1cc(=O)[n-]c(-c2ccccc2)n1 ZINC000414251032 1022314054 /nfs/dbraw/zinc/31/40/54/1022314054.db2.gz XIHZCOKWVQTRFB-QHCPKHFHSA-N -1 3 332.469 4.067 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)N1CCCSc2ccccc21 ZINC000580684820 1022379339 /nfs/dbraw/zinc/37/93/39/1022379339.db2.gz XBEHAAQORBMJGF-UHFFFAOYSA-N -1 3 345.439 4.383 20 0 EIADHM O=C([O-])c1occc1CN1CCC([C@@H](F)c2ccccc2F)CC1 ZINC000580785631 1022496882 /nfs/dbraw/zinc/49/68/82/1022496882.db2.gz IKEOIIJGYIJNOD-MRXNPFEDSA-N -1 3 335.350 4.040 20 0 EIADHM CC(C)c1ncc(C(=O)[N-]c2c3nsnc3ccc2Cl)s1 ZINC000181229001 1022617840 /nfs/dbraw/zinc/61/78/40/1022617840.db2.gz YVQVTPWXKZLJOA-UHFFFAOYSA-N -1 3 338.845 4.177 20 0 EIADHM Cc1cc(C)cc(-c2nnc(S[C@H](C)c3nc(C)cc(=O)[n-]3)o2)c1 ZINC000155905656 1022669997 /nfs/dbraw/zinc/66/99/97/1022669997.db2.gz KAXJZQGQPFFVCT-GFCCVEGCSA-N -1 3 342.424 4.011 20 0 EIADHM O=C(Cc1coc2ccc3ccccc3c12)[N-]OCCC(F)(F)F ZINC000162817528 1022768628 /nfs/dbraw/zinc/76/86/28/1022768628.db2.gz FISTZOFBSCPOQY-UHFFFAOYSA-N -1 3 337.297 4.129 20 0 EIADHM Cc1ccc(CCC2CCN(Cc3cc(C(=O)[O-])co3)CC2)cc1 ZINC000581017943 1022802821 /nfs/dbraw/zinc/80/28/21/1022802821.db2.gz ZREGFSYSCMBEAI-UHFFFAOYSA-N -1 3 327.424 4.131 20 0 EIADHM CCOCc1cccc([N-]S(=O)(=O)c2c(C)c(C)cc(C)c2C)c1 ZINC000588077590 1022972487 /nfs/dbraw/zinc/97/24/87/1022972487.db2.gz ZCTADKFNYGBTBL-UHFFFAOYSA-N -1 3 347.480 4.258 20 0 EIADHM COc1cccc(-c2c[nH]cc2C(=O)Nc2ccc(Cl)cc2[O-])c1 ZINC000536222256 1022973338 /nfs/dbraw/zinc/97/33/38/1022973338.db2.gz VSKUTHZFGPPGNL-UHFFFAOYSA-N -1 3 342.782 4.302 20 0 EIADHM CC(C)Oc1c(Cl)cccc1NCc1cc(=O)[n-]c(C2CC2)n1 ZINC000417022386 1023116226 /nfs/dbraw/zinc/11/62/26/1023116226.db2.gz JFIDGDZVBGBOST-UHFFFAOYSA-N -1 3 333.819 4.112 20 0 EIADHM C[C@@H](c1ccncc1)N(C)C(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000179483756 1023213730 /nfs/dbraw/zinc/21/37/30/1023213730.db2.gz VWRFQQASRNCWDU-HNNXBMFYSA-N -1 3 348.402 4.413 20 0 EIADHM CC(=O)c1ccc(-c2noc(C=C([O-])c3ccccc3Cl)n2)cc1 ZINC001211647347 1023223864 /nfs/dbraw/zinc/22/38/64/1023223864.db2.gz LDJZQPUMKRYFIL-UHFFFAOYSA-N -1 3 340.766 4.018 20 0 EIADHM CCc1cccc2cc(CN[C@H](CC(=O)[O-])c3cccs3)oc21 ZINC000656574399 1023246196 /nfs/dbraw/zinc/24/61/96/1023246196.db2.gz UPSZJUHJNRSCIF-OAHLLOKOSA-N -1 3 329.421 4.362 20 0 EIADHM O=C([O-])c1ccc(CN2CCC(c3c(F)cccc3F)CC2)cc1 ZINC000414634900 1023303411 /nfs/dbraw/zinc/30/34/11/1023303411.db2.gz DVRJJHUNQHIIQE-UHFFFAOYSA-N -1 3 331.362 4.043 20 0 EIADHM O=C([O-])c1cccc(CN2CCC(F)(c3ccc(Cl)cc3)CC2)c1 ZINC000414637425 1023304360 /nfs/dbraw/zinc/30/43/60/1023304360.db2.gz MKCPOLOUZSKCPX-UHFFFAOYSA-N -1 3 347.817 4.499 20 0 EIADHM O=C([O-])[C@@H](CCc1ccccc1)NCc1cc(Cl)sc1Cl ZINC000417554176 1023353680 /nfs/dbraw/zinc/35/36/80/1023353680.db2.gz JGBBZZZUAZCHIE-GFCCVEGCSA-N -1 3 344.263 4.231 20 0 EIADHM Cc1cccc(C[C@H](CNCc2c(F)cc(C)cc2Cl)C(=O)[O-])c1 ZINC000417571932 1023356637 /nfs/dbraw/zinc/35/66/37/1023356637.db2.gz UGFJRWRSDKDCOV-OAHLLOKOSA-N -1 3 349.833 4.129 20 0 EIADHM O=C(OC[C@H]1CCC(F)(F)C1)c1cccc2[n-]c(C(F)F)nc21 ZINC000924085421 1023360755 /nfs/dbraw/zinc/36/07/55/1023360755.db2.gz FFTFQTPGTMHCRI-QMMMGPOBSA-N -1 3 330.281 4.093 20 0 EIADHM CSc1ccc(CN[C@@H](CC(=O)[O-])c2cccc(Cl)c2)s1 ZINC000417586020 1023364631 /nfs/dbraw/zinc/36/46/31/1023364631.db2.gz QPBWSKUQTIPYMV-ZDUSSCGKSA-N -1 3 341.885 4.429 20 0 EIADHM O=C([O-])[C@H]1C[C@@H](NCc2cscc2C(F)(F)F)c2ccccc21 ZINC000417626040 1023385926 /nfs/dbraw/zinc/38/59/26/1023385926.db2.gz MNUDYOFJKVKBLS-GXTWGEPZSA-N -1 3 341.354 4.170 20 0 EIADHM C[C@@H](CCC[C@H](C)C(=O)[O-])NCc1csc(-c2ccsc2)n1 ZINC000388324376 1023455508 /nfs/dbraw/zinc/45/55/08/1023455508.db2.gz DWLKVSLUGRHQBB-RYUDHWBXSA-N -1 3 338.498 4.241 20 0 EIADHM O=C([O-])[C@H](c1c(F)cccc1Cl)N1CCC(C2CCC2)CC1 ZINC000656758744 1023499395 /nfs/dbraw/zinc/49/93/95/1023499395.db2.gz NEBHHKFSCOXGQF-INIZCTEOSA-N -1 3 325.811 4.117 20 0 EIADHM COc1cc(/C=C2\CSc3ccccc3C2=O)cc(Cl)c1[O-] ZINC000057457675 1023499921 /nfs/dbraw/zinc/49/99/21/1023499921.db2.gz KMDYZYJIWWJRCW-IZZDOVSWSA-N -1 3 332.808 4.426 20 0 EIADHM O=C([O-])[C@@H]1CCN(Cc2cc(Cl)cc(Cl)c2)[C@@H]2CCCC[C@H]12 ZINC000656764254 1023504847 /nfs/dbraw/zinc/50/48/47/1023504847.db2.gz FUDSUUFENRKRKW-BZUAXINKSA-N -1 3 342.266 4.459 20 0 EIADHM O=C([O-])[C@@H]1CCN(Cc2cc(Cl)cc(Cl)c2)[C@H]2CCCC[C@H]12 ZINC000656764255 1023505801 /nfs/dbraw/zinc/50/58/01/1023505801.db2.gz FUDSUUFENRKRKW-OAGGEKHMSA-N -1 3 342.266 4.459 20 0 EIADHM CCc1nc(C(C)C)ccc1CN1CC[C@H](C(=O)[O-])[C@H]2CCCC[C@H]21 ZINC000656769390 1023511207 /nfs/dbraw/zinc/51/12/07/1023511207.db2.gz ZBBNIKDAPSTWEQ-FUHIMQAGSA-N -1 3 344.499 4.233 20 0 EIADHM [O-]c1ccc(F)c(CNCc2ccnc(OC3CCCCC3)c2)c1F ZINC000510455450 1023643246 /nfs/dbraw/zinc/64/32/46/1023643246.db2.gz BVTKPVYJVOCBRU-UHFFFAOYSA-N -1 3 348.393 4.067 20 0 EIADHM O=C([N-]OCc1ccccc1)C12CCC(C(F)(F)F)(CC1)CC2 ZINC000377675582 1023678719 /nfs/dbraw/zinc/67/87/19/1023678719.db2.gz LPTJJDQCAVSVAN-UHFFFAOYSA-N -1 3 327.346 4.137 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N1CCc2c1c(F)ccc2F ZINC000498930208 1023690464 /nfs/dbraw/zinc/69/04/64/1023690464.db2.gz NVNPENOVTBEROV-UHFFFAOYSA-N -1 3 325.314 4.027 20 0 EIADHM Cc1cc([C@@H]2CCCN2Cc2c3ccccc3sc2C(=O)[O-])on1 ZINC000652396977 1024806314 /nfs/dbraw/zinc/80/63/14/1024806314.db2.gz IQXBBNUPJNXNMI-AWEZNQCLSA-N -1 3 342.420 4.233 20 0 EIADHM CCC(CC)N(Cc1c(Br)cccc1C(=O)[O-])C1CC1 ZINC000652398287 1024806962 /nfs/dbraw/zinc/80/69/62/1024806962.db2.gz NKMGFCLQMAYYFN-UHFFFAOYSA-N -1 3 340.261 4.300 20 0 EIADHM C[C@H]([C@@H](C)c1ccc(Cl)cc1)N(C)Cc1nc(C(=O)[O-])cs1 ZINC000652429381 1024826460 /nfs/dbraw/zinc/82/64/60/1024826460.db2.gz NMIRGJPJIFWECU-GHMZBOCLSA-N -1 3 338.860 4.119 20 0 EIADHM O=C([O-])[C@H](c1ccc(F)cc1)N1CC[C@@H](C(F)(F)F)C2(CCC2)C1 ZINC000652446934 1024837161 /nfs/dbraw/zinc/83/71/61/1024837161.db2.gz GVFILYHVNJCWIQ-KGLIPLIRSA-N -1 3 345.336 4.006 20 0 EIADHM C[C@@H](CCSc1ccccc1)N1Cc2ccccc2[C@@H](C(=O)[O-])C1 ZINC000652469726 1024845141 /nfs/dbraw/zinc/84/51/41/1024845141.db2.gz CXGSFCRWRDOPBW-KXBFYZLASA-N -1 3 341.476 4.241 20 0 EIADHM O=C([O-])CC[C@H](CNCc1ccc(-c2ccccc2)o1)C(F)(F)F ZINC000663263039 1024968605 /nfs/dbraw/zinc/96/86/05/1024968605.db2.gz XVDUQNWHUCBQLS-CYBMUJFWSA-N -1 3 341.329 4.080 20 0 EIADHM [O-]c1ccc(Cc2ccccc2)cc1-c1nc(-c2ccccn2)no1 ZINC000184838816 1024982952 /nfs/dbraw/zinc/98/29/52/1024982952.db2.gz JKHSGTRVPLSHEU-UHFFFAOYSA-N -1 3 329.359 4.095 20 0 EIADHM CCc1ccc([O-])c(C(=O)N(C)CC(C)(C)c2ccc(C)cc2)c1 ZINC000440174379 1025711750 /nfs/dbraw/zinc/71/17/50/1025711750.db2.gz XBYDLZWSFVMMCJ-UHFFFAOYSA-N -1 3 325.452 4.313 20 0 EIADHM CCc1cccc(C)c1[N-]S(=O)(=O)c1ccc2c(c1)CC(C)(C)O2 ZINC000440290725 1025805532 /nfs/dbraw/zinc/80/55/32/1025805532.db2.gz LZRRXCHXXPAMMY-UHFFFAOYSA-N -1 3 345.464 4.072 20 0 EIADHM O=C(NCc1ncccc1[O-])Nc1ccc2c(c1)oc1ccccc12 ZINC000344000352 1025867170 /nfs/dbraw/zinc/86/71/70/1025867170.db2.gz AHYHNGQXKBJCLL-UHFFFAOYSA-N -1 3 333.347 4.008 20 0 EIADHM COc1ccc([C@H](NC(=O)c2cc([O-])ccc2Cl)C(C)C)cc1 ZINC000582033643 1026001961 /nfs/dbraw/zinc/00/19/61/1026001961.db2.gz MTWCLQUOEOTYNS-QGZVFWFLSA-N -1 3 333.815 4.181 20 0 EIADHM Cc1csc(CCCCNC(=O)c2ccc(C(C)C)cc2[O-])n1 ZINC000110619425 1026022951 /nfs/dbraw/zinc/02/29/51/1026022951.db2.gz SEOGJLSPTBHCON-UHFFFAOYSA-N -1 3 332.469 4.033 20 0 EIADHM O=C([O-])CC[C@@H]1CCCCN1Cc1ncc(-c2ccc(Cl)cc2)o1 ZINC000324442321 1026043499 /nfs/dbraw/zinc/04/34/99/1026043499.db2.gz SXEOUVLDLKTJEJ-HNNXBMFYSA-N -1 3 348.830 4.214 20 0 EIADHM O=C(Nc1c([O-])cccc1Cl)c1cc(C(F)(F)F)ccc1F ZINC000582091233 1026129804 /nfs/dbraw/zinc/12/98/04/1026129804.db2.gz HHPKIZSOOMXOKN-UHFFFAOYSA-N -1 3 333.668 4.456 20 0 EIADHM C[C@@H](c1ccc2ccccc2c1)N(C)Cc1nc(=O)c2sccc2[n-]1 ZINC000053643058 1026208236 /nfs/dbraw/zinc/20/82/36/1026208236.db2.gz LKXIGCNJMVGRQD-ZDUSSCGKSA-N -1 3 349.459 4.331 20 0 EIADHM Cc1c(NCc2cc([O-])cc(F)c2)cnn1-c1ccc(Cl)cc1 ZINC000342424402 1026214940 /nfs/dbraw/zinc/21/49/40/1026214940.db2.gz SNIKHBRSHOADQS-UHFFFAOYSA-N -1 3 331.778 4.291 20 0 EIADHM Cc1ccnc(Cl)c1[N-]S(=O)(=O)c1ccc(C(C)(C)C)cc1 ZINC000318704394 1026239371 /nfs/dbraw/zinc/23/93/71/1026239371.db2.gz NGPBSDYASKFKNV-UHFFFAOYSA-N -1 3 338.860 4.142 20 0 EIADHM O=C([O-])CCC1CCN(CCc2cccc(Cl)c2Cl)CC1 ZINC000563273920 1026278056 /nfs/dbraw/zinc/27/80/56/1026278056.db2.gz ZMYIJOWNBUAKCO-UHFFFAOYSA-N -1 3 330.255 4.113 20 0 EIADHM CC1(C)Cc2ccc(C(=O)N3CCCCc4sccc43)c([O-])c2O1 ZINC000684785238 1026291620 /nfs/dbraw/zinc/29/16/20/1026291620.db2.gz MMQGQLFREZXMCY-UHFFFAOYSA-N -1 3 343.448 4.150 20 0 EIADHM C[C@H](c1ccc(C(=O)[O-])o1)N1CCC(OC2CCC(C)CC2)CC1 ZINC000563278203 1026320458 /nfs/dbraw/zinc/32/04/58/1026320458.db2.gz SDDFOVQKOOBUDN-SHARSMKWSA-N -1 3 335.444 4.099 20 0 EIADHM Cc1ccccc1[C@@H](CC(C)C)NC(=O)NCc1ccc([O-])c(F)c1 ZINC000606687466 1026337480 /nfs/dbraw/zinc/33/74/80/1026337480.db2.gz GRQOFHJVBIIULL-GOSISDBHSA-N -1 3 344.430 4.426 20 0 EIADHM C[C@@H](CCC[C@H](C)C(=O)[O-])NCc1csc(-c2cccs2)n1 ZINC000426705516 1026489139 /nfs/dbraw/zinc/48/91/39/1026489139.db2.gz XEEIHCCKOGPWSS-RYUDHWBXSA-N -1 3 338.498 4.241 20 0 EIADHM C[C@H](CCC[C@H](C)NCc1csc(-c2cccs2)n1)C(=O)[O-] ZINC000426705514 1026489399 /nfs/dbraw/zinc/48/93/99/1026489399.db2.gz XEEIHCCKOGPWSS-NEPJUHHUSA-N -1 3 338.498 4.241 20 0 EIADHM Cc1cc(CNCc2ccc(C(=O)[O-])cc2)ccc1Oc1cccnc1 ZINC000426710917 1026509505 /nfs/dbraw/zinc/50/95/05/1026509505.db2.gz YJFPMJMOOKMPHD-UHFFFAOYSA-N -1 3 348.402 4.170 20 0 EIADHM O=C([O-])[C@H](NCc1cc(F)cc(Cl)c1)c1cccc(Cl)c1 ZINC000426738841 1026519819 /nfs/dbraw/zinc/51/98/19/1026519819.db2.gz ZGCHPXZIOGSUAW-CQSZACIVSA-N -1 3 328.170 4.048 20 0 EIADHM O=C([O-])[C@@H](NCc1cc(Cl)cc(C(F)(F)F)c1)c1cccs1 ZINC000426787557 1026563695 /nfs/dbraw/zinc/56/36/95/1026563695.db2.gz FUZBKRPCWGIBMV-LBPRGKRZSA-N -1 3 349.761 4.336 20 0 EIADHM COc1cc(-c2ccccc2)ccc1CN[C@@H](C(=O)[O-])c1ccccc1 ZINC000426789552 1026564384 /nfs/dbraw/zinc/56/43/84/1026564384.db2.gz VUHBQXAYXGKNSC-OAQYLSRUSA-N -1 3 347.414 4.278 20 0 EIADHM O=C([O-])[C@H]1CCCN([C@@H](c2ccc(F)cc2)c2ccc(Cl)cc2)C1 ZINC000107840376 1026573933 /nfs/dbraw/zinc/57/39/33/1026573933.db2.gz XLMZGOFPMDJNNY-MAUKXSAKSA-N -1 3 347.817 4.365 20 0 EIADHM O=C([O-])C[C@H](NCc1coc2ccccc12)c1cccc(Cl)c1 ZINC000426817795 1026577911 /nfs/dbraw/zinc/57/79/11/1026577911.db2.gz PZAXQDJDXXEIGW-INIZCTEOSA-N -1 3 329.783 4.392 20 0 EIADHM Cc1cccc(C)c1NC(=O)NCc1ccc([O-])c(Br)c1 ZINC000152488411 1026610440 /nfs/dbraw/zinc/61/04/40/1026610440.db2.gz AUSLRKFGRSHGLH-UHFFFAOYSA-N -1 3 349.228 4.093 20 0 EIADHM COC(=O)c1cnc(S[C@H](Cc2ccccc2)c2ccccc2)[n-]1 ZINC000432666163 1026698900 /nfs/dbraw/zinc/69/89/00/1026698900.db2.gz REXQENBKJFNMJF-QGZVFWFLSA-N -1 3 338.432 4.272 20 0 EIADHM CCOCCN(CC[C@@H]1CCC[C@@H](C)C1)Cc1ccc(C(=O)[O-])o1 ZINC000519604999 1026791120 /nfs/dbraw/zinc/79/11/20/1026791120.db2.gz KZTSSUMIIJXHLJ-CVEARBPZSA-N -1 3 337.460 4.033 20 0 EIADHM O=c1ccnc(C(=CC2=Cc3ccccc3OC2)Cc2ccccc2)[n-]1 ZINC000432708277 1026809359 /nfs/dbraw/zinc/80/93/59/1026809359.db2.gz FXBSNMXEFKQLRU-XMHGGMMESA-N -1 3 342.398 4.284 20 0 EIADHM CC(C)([N-]C(=O)C(F)(F)c1ccc(F)cc1)c1ccc(F)cc1 ZINC000728498324 1026841439 /nfs/dbraw/zinc/84/14/39/1026841439.db2.gz FLSYGNVMPKQHNS-UHFFFAOYSA-N -1 3 325.305 4.108 20 0 EIADHM CN(Cc1cccc(C(F)(F)F)c1)Cc1c(F)ccc([O-])c1F ZINC000507622317 1026850789 /nfs/dbraw/zinc/85/07/89/1026850789.db2.gz SHEFQUUUHOGETK-UHFFFAOYSA-N -1 3 331.284 4.321 20 0 EIADHM COc1ccccc1CC1CCN([C@@H](C)c2ccc(C(=O)[O-])o2)CC1 ZINC000582671674 1026924555 /nfs/dbraw/zinc/92/45/55/1026924555.db2.gz STDUTTYMJGSQJU-AWEZNQCLSA-N -1 3 343.423 4.002 20 0 EIADHM Cc1ccccc1C(C)(C)C(=O)Nc1ccc(Br)cc1[O-] ZINC000519912762 1027043577 /nfs/dbraw/zinc/04/35/77/1027043577.db2.gz DQCVCHZMHPGITG-UHFFFAOYSA-N -1 3 348.240 4.379 20 0 EIADHM O=C(Nc1ccc(Br)cc1[O-])c1sccc1C1CC1 ZINC000520057443 1027154222 /nfs/dbraw/zinc/15/42/22/1027154222.db2.gz XJVUMBBGOMXRCR-UHFFFAOYSA-N -1 3 338.226 4.346 20 0 EIADHM O=C(CCc1ccc(F)cc1)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000440993683 1027175893 /nfs/dbraw/zinc/17/58/93/1027175893.db2.gz RMRCSWNOYMPZJP-UHFFFAOYSA-N -1 3 327.277 4.121 20 0 EIADHM Cc1cccc(O[C@@H](C)C(=O)Nc2ccc([O-])c(C(F)(F)F)c2)c1 ZINC000440993705 1027176846 /nfs/dbraw/zinc/17/68/46/1027176846.db2.gz RRSXQYIXAPLMMA-NSHDSACASA-N -1 3 339.313 4.125 20 0 EIADHM Cc1ccc(OCC(=O)Nc2ccc([O-])c(C(F)(F)F)c2)c(C)c1 ZINC000440986664 1027182343 /nfs/dbraw/zinc/18/23/43/1027182343.db2.gz GDFBONCILHPOFL-UHFFFAOYSA-N -1 3 339.313 4.045 20 0 EIADHM CCCNC(=S)Nc1ccc([O-])c(-c2nc3ccccc3s2)c1 ZINC000007582983 1027438943 /nfs/dbraw/zinc/43/89/43/1027438943.db2.gz RPXIMWKXLJKONA-UHFFFAOYSA-N -1 3 343.477 4.365 20 0 EIADHM Cc1cc(Br)c(Nc2cc(F)c([O-])c(F)c2)nc1C ZINC001213375014 1027506024 /nfs/dbraw/zinc/50/60/24/1027506024.db2.gz LKHAUFZPKMXUGS-UHFFFAOYSA-N -1 3 329.144 4.188 20 0 EIADHM C[C@@H]1CCN(Cc2nc3c4ccccc4oc3c(=O)[n-]2)CC12CCC2 ZINC000329154773 1027613514 /nfs/dbraw/zinc/61/35/14/1027613514.db2.gz UTZAXUQVUKEMQF-CYBMUJFWSA-N -1 3 337.423 4.094 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(NC[C@H](CC)c3ccccc3)nc2)n1 ZINC000111221491 1027814753 /nfs/dbraw/zinc/81/47/53/1027814753.db2.gz IMYLSJSUAGISBJ-HNNXBMFYSA-N -1 3 348.450 4.000 20 0 EIADHM C[C@H]1C[C@H](CCNC(=O)c2cc(=O)c3ccccc3[n-]2)CC(C)(C)C1 ZINC000444465862 1027818196 /nfs/dbraw/zinc/81/81/96/1027818196.db2.gz SZMPEMAHLFDKGN-GJZGRUSLSA-N -1 3 340.467 4.110 20 0 EIADHM C[C@@H]1C[C@H](CCNC(=O)c2cc(=O)c3ccccc3[n-]2)CC(C)(C)C1 ZINC000444465861 1027818640 /nfs/dbraw/zinc/81/86/40/1027818640.db2.gz SZMPEMAHLFDKGN-CABCVRRESA-N -1 3 340.467 4.110 20 0 EIADHM COc1ccc(CCCC(=O)Nc2c([O-])cccc2Cl)c(OC)c1 ZINC000583033474 1027869613 /nfs/dbraw/zinc/86/96/13/1027869613.db2.gz HQPSHXSEUAKGKM-UHFFFAOYSA-N -1 3 349.814 4.024 20 0 EIADHM O=S(=O)([N-][C@H](c1ccccc1)c1cccc(Cl)c1)c1ccco1 ZINC000188612168 1028012228 /nfs/dbraw/zinc/01/22/28/1028012228.db2.gz MCKBCLHKUUUIEG-QGZVFWFLSA-N -1 3 347.823 4.001 20 0 EIADHM CC(C)(C)[C@H](NC(=O)NCc1ccc([O-])c(F)c1)c1ccc(F)cc1 ZINC000523467339 1028133522 /nfs/dbraw/zinc/13/35/22/1028133522.db2.gz SMMPKDATVBVQKT-QGZVFWFLSA-N -1 3 348.393 4.257 20 0 EIADHM O=C(Cc1c[nH]c2ccc(Cl)cc12)Nc1cc(Cl)ccc1[O-] ZINC000523488411 1028148497 /nfs/dbraw/zinc/14/84/97/1028148497.db2.gz BIZGWTMYZBDKDN-UHFFFAOYSA-N -1 3 335.190 4.362 20 0 EIADHM C[C@@H](c1ccc(Br)cc1)[S@@](=O)c1ccc([O-])cc1 ZINC000427469422 1028184076 /nfs/dbraw/zinc/18/40/76/1028184076.db2.gz BDQYMLAQOXAMQV-XTZNXHDOSA-N -1 3 325.227 4.024 20 0 EIADHM COC(=O)c1ccc(Nc2cc(F)c([O-])c(F)c2)c(C(F)(F)F)c1 ZINC001213379430 1028232318 /nfs/dbraw/zinc/23/23/18/1028232318.db2.gz YFOFUKCEKOFMRH-UHFFFAOYSA-N -1 3 347.239 4.219 20 0 EIADHM COc1ccc(Nc2cc(F)c([O-])c(F)c2)c(Br)c1 ZINC001213379313 1028241149 /nfs/dbraw/zinc/24/11/49/1028241149.db2.gz OAELISYRXVKJGG-UHFFFAOYSA-N -1 3 330.128 4.185 20 0 EIADHM CC(=O)c1ccc(Nc2cc(F)c([O-])c(F)c2)c(Br)c1 ZINC001213382006 1028526066 /nfs/dbraw/zinc/52/60/66/1028526066.db2.gz UZGBJTZTZKBTNX-UHFFFAOYSA-N -1 3 342.139 4.379 20 0 EIADHM COc1cccc(-c2nc(-c3ccc(Cl)cc3Cl)no2)c1[O-] ZINC000445455951 1028610963 /nfs/dbraw/zinc/61/09/63/1028610963.db2.gz RLOHZUXBGNRPSV-UHFFFAOYSA-N -1 3 337.162 4.425 20 0 EIADHM C[C@H](NC(=O)c1cc([O-])ccc1Cl)c1cccc(N2CCCC2)c1 ZINC000278379001 1029045818 /nfs/dbraw/zinc/04/58/18/1029045818.db2.gz MWOGQQLPCVUMNM-ZDUSSCGKSA-N -1 3 344.842 4.137 20 0 EIADHM O=C(/C=C\c1ccc(Br)o1)Nc1cc(Cl)ccc1[O-] ZINC000759654360 1029217953 /nfs/dbraw/zinc/21/79/53/1029217953.db2.gz CCNFNPMEWLWWBT-UTCJRWHESA-N -1 3 342.576 4.053 20 0 EIADHM Cc1c(C(=O)Nc2ccc(Br)cc2[O-])ccn1C(C)C ZINC000583825429 1029238076 /nfs/dbraw/zinc/23/80/76/1029238076.db2.gz OSFXTZMIVCAGTA-UHFFFAOYSA-N -1 3 337.217 4.098 20 0 EIADHM Cc1cc(C(=O)Nc2cc(Cl)ccc2[O-])c(Br)s1 ZINC000038260570 1029242614 /nfs/dbraw/zinc/24/26/14/1029242614.db2.gz MKAJWJYTNKXBJG-UHFFFAOYSA-N -1 3 346.633 4.430 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(NCc3csc(C)c3C)nc2)n1 ZINC000631452350 1029385449 /nfs/dbraw/zinc/38/54/49/1029385449.db2.gz WNAUVOPWUYQPAX-UHFFFAOYSA-N -1 3 340.452 4.097 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2ccc(OC(C)C)c(C)c2)c(C)c1 ZINC000525018392 1029391114 /nfs/dbraw/zinc/39/11/14/1029391114.db2.gz DSODUGADWPNJKM-UHFFFAOYSA-N -1 3 333.453 4.200 20 0 EIADHM CSCc1ccc(NC(=O)CCCc2ccc([O-])c(F)c2)cc1 ZINC000468877166 1029469803 /nfs/dbraw/zinc/46/98/03/1029469803.db2.gz IRHLLKIMZJFTPZ-UHFFFAOYSA-N -1 3 333.428 4.356 20 0 EIADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)[C@H]3CCCC3(C)C)c2)n1 ZINC000475374784 1029587680 /nfs/dbraw/zinc/58/76/80/1029587680.db2.gz RKEJWOQUCPLKIQ-MRXNPFEDSA-N -1 3 339.439 4.176 20 0 EIADHM C[C@H](c1ccc(C(=O)[O-])o1)N1CC=C(c2ccc(Cl)cc2)CC1 ZINC000565103766 1029617077 /nfs/dbraw/zinc/61/70/77/1029617077.db2.gz PKCLVJGLJLENSL-GFCCVEGCSA-N -1 3 331.799 4.482 20 0 EIADHM O=C(Nc1cc(Br)ccc1[O-])c1c[nH]c2cc(F)ccc21 ZINC000192965626 1029653779 /nfs/dbraw/zinc/65/37/79/1029653779.db2.gz DFOWIHUAYBJNIN-UHFFFAOYSA-N -1 3 349.159 4.027 20 0 EIADHM Cc1ccc(C[C@H](C)N(C)Cc2cc(C(=O)[O-])ccc2Cl)cc1 ZINC000584177984 1029661809 /nfs/dbraw/zinc/66/18/09/1029661809.db2.gz WIABBJFHQGUGON-AWEZNQCLSA-N -1 3 331.843 4.410 20 0 EIADHM Cc1cc(F)ccc1S(=O)(=O)[N-]c1ccc(CC(F)(F)F)cc1 ZINC000525534238 1029667045 /nfs/dbraw/zinc/66/70/45/1029667045.db2.gz RIFYUKDYDCJEPJ-UHFFFAOYSA-N -1 3 347.333 4.040 20 0 EIADHM [O-]c1cc(Cl)c(CN2CC[C@@H](F)C(F)(F)CC2)c(Cl)c1 ZINC001142105979 1029669705 /nfs/dbraw/zinc/66/97/05/1029669705.db2.gz VMDKIKNFYKCHQB-GFCCVEGCSA-N -1 3 328.161 4.268 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(NCc3ccccc3Cl)nc2)n1 ZINC000301157487 1029678970 /nfs/dbraw/zinc/67/89/70/1029678970.db2.gz DMLTZQMTZKZIAQ-UHFFFAOYSA-N -1 3 340.814 4.072 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(NC[C@@H]3CCC[C@@H](C)C3)nc2)n1 ZINC000301191736 1029683284 /nfs/dbraw/zinc/68/32/84/1029683284.db2.gz ZXZCFIGSUJOOSE-ZIAGYGMSSA-N -1 3 326.444 4.045 20 0 EIADHM Cc1nc(-c2ccc(NCc3ccccc3Cl)nc2)[n-]c(=O)c1C ZINC000301197306 1029685165 /nfs/dbraw/zinc/68/51/65/1029685165.db2.gz ZVUAPHGWNSJNKZ-UHFFFAOYSA-N -1 3 340.814 4.127 20 0 EIADHM C[C@@H]1C[C@@H](C(=O)[O-])C[C@H](C)N1Cc1ncc(-c2cccc(Cl)c2)o1 ZINC000530174790 1030197353 /nfs/dbraw/zinc/19/73/53/1030197353.db2.gz BCVQMKDSYDZZNB-DABQJJPHSA-N -1 3 348.830 4.069 20 0 EIADHM C[C@@H]1CC(C(=O)[O-])C[C@@H](C)N1Cc1ncc(-c2ccc(Cl)cc2)o1 ZINC000530179845 1030200891 /nfs/dbraw/zinc/20/08/91/1030200891.db2.gz ODHVLQUCZTXYHS-VXGBXAGGSA-N -1 3 348.830 4.069 20 0 EIADHM [O-]c1cc(F)cc(CN(Cc2ccco2)Cc2ccc(O)cc2)c1 ZINC000186211527 1030259880 /nfs/dbraw/zinc/25/98/80/1030259880.db2.gz BXTDJVKZGMLQGB-UHFFFAOYSA-N -1 3 327.355 4.032 20 0 EIADHM CCc1cccc(C(=O)N2C[C@@H](C)CSc3ccccc32)c1[O-] ZINC001143457814 1030290520 /nfs/dbraw/zinc/29/05/20/1030290520.db2.gz DGNJPVKBDSSCMY-CYBMUJFWSA-N -1 3 327.449 4.343 20 0 EIADHM O=C(/C=C\c1ccc(-c2ccccc2Cl)s1)[N-]OCC(F)F ZINC000760141978 1030627778 /nfs/dbraw/zinc/62/77/78/1030627778.db2.gz NLGRVTYPVAAWLP-VURMDHGXSA-N -1 3 343.782 4.395 20 0 EIADHM CCc1cccc(C(=O)N2C[C@H](c3ccc(F)cc3)C[C@H]2C)c1[O-] ZINC000530719668 1030672163 /nfs/dbraw/zinc/67/21/63/1030672163.db2.gz SVCOQQXEKATLMQ-CZUORRHYSA-N -1 3 327.399 4.112 20 0 EIADHM [O-]c1cc(Br)cnc1O[C@H]1CCc2cc(Cl)ccc21 ZINC001228956938 1030745055 /nfs/dbraw/zinc/74/50/55/1030745055.db2.gz SLEVNOZNXFJSOS-ZDUSSCGKSA-N -1 3 340.604 4.269 20 0 EIADHM COc1ccc([C@H](C)NCc2c([O-])ccc(Cl)c2F)cc1F ZINC000190702214 1030754376 /nfs/dbraw/zinc/75/43/76/1030754376.db2.gz FVMYDBUTAUDLLN-VIFPVBQESA-N -1 3 327.758 4.183 20 0 EIADHM O=C([O-])c1cccc(CNC2(c3cccc(C(F)(F)F)c3)CC2)c1 ZINC000263376806 1030840974 /nfs/dbraw/zinc/84/09/74/1030840974.db2.gz ATAVDARMFDANGT-UHFFFAOYSA-N -1 3 335.325 4.183 20 0 EIADHM O=C(Cc1ccc([O-])c(F)c1)NC1(Cc2ccc(Cl)cc2)CCC1 ZINC000452260276 1030908191 /nfs/dbraw/zinc/90/81/91/1030908191.db2.gz ZXWXRPWKNGBYDW-UHFFFAOYSA-N -1 3 347.817 4.009 20 0 EIADHM CCCCN(Cc1ccccc1F)C(=O)Cc1ccc([O-])c(F)c1 ZINC000448671698 1030945929 /nfs/dbraw/zinc/94/59/29/1030945929.db2.gz VAWJOZNOLIIENI-UHFFFAOYSA-N -1 3 333.378 4.042 20 0 EIADHM C[C@@H]1C[C@H]1c1ccc(CN2CCC(c3ccccc3C(=O)[O-])CC2)o1 ZINC000666586631 1031049224 /nfs/dbraw/zinc/04/92/24/1031049224.db2.gz SKNMHKDVUNAYPB-AUUYWEPGSA-N -1 3 339.435 4.481 20 0 EIADHM Cc1ccc([C@@H]2CCCN2C(=O)Cc2ccc([O-])c(F)c2)cc1C ZINC000448799237 1031112203 /nfs/dbraw/zinc/11/22/03/1031112203.db2.gz IYYHPYBEGFBWKD-SFHVURJKSA-N -1 3 327.399 4.054 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N1CCC[C@@H](CC(F)(F)F)C1 ZINC000421953140 1031120493 /nfs/dbraw/zinc/12/04/93/1031120493.db2.gz FJADAQVGGFBTNI-LBPRGKRZSA-N -1 3 337.341 4.350 20 0 EIADHM CCOc1cc(C(=O)[N-]c2nc(-c3ccc(C)s3)c(C)s2)on1 ZINC000448912782 1031237865 /nfs/dbraw/zinc/23/78/65/1031237865.db2.gz OQZVHHXAROIQCE-UHFFFAOYSA-N -1 3 349.437 4.127 20 0 EIADHM Cc1cccc([N-]S(=O)(=O)c2cnc3ccsc3c2)c1Cl ZINC000531472644 1031296447 /nfs/dbraw/zinc/29/64/47/1031296447.db2.gz GBFPWQHEKARMHM-UHFFFAOYSA-N -1 3 338.841 4.059 20 0 EIADHM CC(C)N(Cc1cccc(Cl)c1)C(=O)Cc1ccc([O-])c(F)c1 ZINC000448975172 1031311424 /nfs/dbraw/zinc/31/14/24/1031311424.db2.gz NWLLHHHNSIOENQ-UHFFFAOYSA-N -1 3 335.806 4.164 20 0 EIADHM CCCc1cc(=O)[n-]c(C(=Cc2cnc(N(CC)CC)s2)CC)n1 ZINC000453023859 1031499669 /nfs/dbraw/zinc/49/96/69/1031499669.db2.gz IMQNVPRNZFOJRX-JLHYYAGUSA-N -1 3 346.500 4.388 20 0 EIADHM O=C(Nc1cc(F)ccc1[O-])c1ccc(Br)c(Cl)c1 ZINC000531934400 1031843863 /nfs/dbraw/zinc/84/38/63/1031843863.db2.gz ROQKRSOVPWIWOF-UHFFFAOYSA-N -1 3 344.567 4.200 20 0 EIADHM O=C(Nc1cccc([O-])c1F)C1(c2cc(F)cc(F)c2)CCCC1 ZINC000528915766 1031938914 /nfs/dbraw/zinc/93/89/14/1031938914.db2.gz DRDVCMPGISLHCX-UHFFFAOYSA-N -1 3 335.325 4.260 20 0 EIADHM CCOc1ccc([N-]S(=O)(=O)c2cc(C)ccc2C)cc1Cl ZINC000614840490 1032014702 /nfs/dbraw/zinc/01/47/02/1032014702.db2.gz IDKPINJKUDTZJZ-UHFFFAOYSA-N -1 3 339.844 4.156 20 0 EIADHM COc1c(C)cc(S(=O)(=O)[N-]c2cccc(Cl)c2C)cc1C ZINC000512568047 1033388908 /nfs/dbraw/zinc/38/89/08/1033388908.db2.gz GMPJLVXYZVIUOK-UHFFFAOYSA-N -1 3 339.844 4.075 20 0 EIADHM C[C@H]1C[C@@H](C(F)(F)F)CCN1C(=O)c1cc([O-])c2ccccc2c1 ZINC000295706912 1033809482 /nfs/dbraw/zinc/80/94/82/1033809482.db2.gz CBTAGRQDEHSDJP-FZMZJTMJSA-N -1 3 337.341 4.348 20 0 EIADHM O=C(Nc1ccccc1Oc1ccccc1)c1cc(F)cc2n[n-]nc21 ZINC000433221950 1034068867 /nfs/dbraw/zinc/06/88/67/1034068867.db2.gz SKGSSDHKGCKSHN-UHFFFAOYSA-N -1 3 348.337 4.142 20 0 EIADHM COc1ccc(N(CC(C)C)C(=O)c2cc([O-])ccc2Cl)cc1 ZINC000433241740 1034103323 /nfs/dbraw/zinc/10/33/23/1034103323.db2.gz PLWCPESXKYVYCU-UHFFFAOYSA-N -1 3 333.815 4.357 20 0 EIADHM O=C(c1cc([O-])ccc1Cl)N1CCCCC[C@@H]1[C@@H]1CCCCC1=O ZINC000433367137 1034280052 /nfs/dbraw/zinc/28/00/52/1034280052.db2.gz PVLQGTNSFVLHLY-WMLDXEAASA-N -1 3 349.858 4.190 20 0 EIADHM CC(C)Oc1ccc(-c2nc3cc(C(F)(F)F)ccc3c(=O)[n-]2)cc1 ZINC000614443921 1034801083 /nfs/dbraw/zinc/80/10/83/1034801083.db2.gz LMZVTUGUPFMZEO-UHFFFAOYSA-N -1 3 348.324 4.396 20 0 EIADHM CC(C)c1oc([C@@H]2CCCN2CCCC(=O)[O-])nc1-c1ccccc1 ZINC000262183540 1034888323 /nfs/dbraw/zinc/88/83/23/1034888323.db2.gz DZJLDRBYGUTWSX-INIZCTEOSA-N -1 3 342.439 4.467 20 0 EIADHM Cc1nc([C@H]2CCCN2C(=O)c2cc([O-])c3ccccc3c2)cs1 ZINC000280174214 1035195801 /nfs/dbraw/zinc/19/58/01/1035195801.db2.gz CVOXOOCVZDBFNB-QGZVFWFLSA-N -1 3 338.432 4.288 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)Nc1nc(-c2ccco2)cs1 ZINC000345541255 1035248479 /nfs/dbraw/zinc/24/84/79/1035248479.db2.gz GZVZQZVJJHOTFK-UHFFFAOYSA-N -1 3 346.383 4.209 20 0 EIADHM CC[C@H]1c2ccsc2CCN1C(=O)CCCc1ccc([O-])c(F)c1 ZINC000469153192 1035483054 /nfs/dbraw/zinc/48/30/54/1035483054.db2.gz YJDWHYCBBDXROM-INIZCTEOSA-N -1 3 347.455 4.452 20 0 EIADHM O=C(Nc1ccc(Cl)cc1[O-])c1cccc(F)c1Br ZINC000490648586 1035566537 /nfs/dbraw/zinc/56/65/37/1035566537.db2.gz MNEVXNZWDOJOQJ-UHFFFAOYSA-N -1 3 344.567 4.200 20 0 EIADHM O=C(Nc1cc(C(F)(F)F)ccc1[O-])c1ccc2c(c1)CCCC2=O ZINC000490670500 1035589617 /nfs/dbraw/zinc/58/96/17/1035589617.db2.gz GAQOZPPNLRHLSN-UHFFFAOYSA-N -1 3 349.308 4.182 20 0 EIADHM CCOc1ccc(S(=O)(=O)[N-]c2c(C)cccc2CC)c(C)c1 ZINC000501801974 1035611940 /nfs/dbraw/zinc/61/19/40/1035611940.db2.gz WRVBYXMMNNALHX-UHFFFAOYSA-N -1 3 333.453 4.065 20 0 EIADHM O=C(OCc1ccc(C(F)(F)F)cc1)c1cc(-c2ccco2)[n-]n1 ZINC000913302358 1035644486 /nfs/dbraw/zinc/64/44/86/1035644486.db2.gz XNLXNBLESISRGG-UHFFFAOYSA-N -1 3 336.269 4.046 20 0 EIADHM O=C(OCc1ccc(C(F)(F)F)cc1)c1cc(-c2ccco2)n[n-]1 ZINC000913302358 1035644501 /nfs/dbraw/zinc/64/45/01/1035644501.db2.gz XNLXNBLESISRGG-UHFFFAOYSA-N -1 3 336.269 4.046 20 0 EIADHM Cc1cc(Cl)cc(NC(=O)c2ccc3c(c2)CCCC3=O)c1[O-] ZINC000490817307 1035681692 /nfs/dbraw/zinc/68/16/92/1035681692.db2.gz GQKVXIMUZLIJQP-UHFFFAOYSA-N -1 3 329.783 4.125 20 0 EIADHM COc1ccc([O-])c(-c2nc(-c3ccc(C(F)(F)F)s3)no2)c1 ZINC000904973411 1035689493 /nfs/dbraw/zinc/68/94/93/1035689493.db2.gz SLLWONNVIQPLHB-UHFFFAOYSA-N -1 3 342.298 4.198 20 0 EIADHM CCN(C(=O)c1ccc(OC)cc1[O-])[C@H](C)c1cc2ccccc2o1 ZINC000195645214 1035875649 /nfs/dbraw/zinc/87/56/49/1035875649.db2.gz OZXXDXGZQJGTBT-CYBMUJFWSA-N -1 3 339.391 4.370 20 0 EIADHM CC(C)[C@@H](c1ccc(F)cc1)N(C)C(=O)NCc1ccc([O-])c(F)c1 ZINC000434134501 1035876121 /nfs/dbraw/zinc/87/61/21/1035876121.db2.gz XNFDDAPATXFGRL-SFHVURJKSA-N -1 3 348.393 4.209 20 0 EIADHM CC1(C)[C@H](c2ccccc2)CCN1Cc1nc(=O)c2sccc2[n-]1 ZINC000421031361 1035965223 /nfs/dbraw/zinc/96/52/23/1035965223.db2.gz ZULYANVLKGLNRF-AWEZNQCLSA-N -1 3 339.464 4.165 20 0 EIADHM O=C([O-])[C@H](c1ccccc1F)N1CC[C@H](C(F)(F)F)C2(CCC2)C1 ZINC000571811388 1036260287 /nfs/dbraw/zinc/26/02/87/1036260287.db2.gz UUHMQWPKSQKIOZ-KBPBESRZSA-N -1 3 345.336 4.006 20 0 EIADHM Cc1cc([C@@H](C)N(C)CCCOc2ccccc2C)oc1C(=O)[O-] ZINC000571811729 1036261231 /nfs/dbraw/zinc/26/12/31/1036261231.db2.gz PPJKXXLWSCCWET-OAHLLOKOSA-N -1 3 331.412 4.057 20 0 EIADHM O=c1cc(C=Cc2ccc(Cl)c(Cl)c2)nc(-c2ccncc2)[n-]1 ZINC000485999324 1036414129 /nfs/dbraw/zinc/41/41/29/1036414129.db2.gz KNNBBHKFOUUFHM-HNQUOIGGSA-N -1 3 344.201 4.309 20 0 EIADHM Cc1cc(C(=O)N=c2cc(-c3cc(Cl)cc(Cl)c3)[n-][nH]2)c(C)[nH]1 ZINC000589166368 1036681794 /nfs/dbraw/zinc/68/17/94/1036681794.db2.gz AXDFLSQBYZSCHZ-UHFFFAOYSA-N -1 3 349.221 4.003 20 0 EIADHM CCCC[C@H](C)N(C)C(=O)c1c[n-]c(=NC(=O)OC(C)(C)C)s1 ZINC000908305510 1036833876 /nfs/dbraw/zinc/83/38/76/1036833876.db2.gz OXFFIAYUYNCYEY-NSHDSACASA-N -1 3 341.477 4.141 20 0 EIADHM CC(C)(CCc1ccccc1)[N-]S(=O)(=O)c1ccc(Cl)s1 ZINC000589629519 1036854485 /nfs/dbraw/zinc/85/44/85/1036854485.db2.gz GLAASRXOXLOTLT-UHFFFAOYSA-N -1 3 343.901 4.091 20 0 EIADHM Cc1cccc([O-])c1C(=O)Nc1cccc(C[S@@](=O)C(C)(C)C)c1 ZINC000599519173 1037050771 /nfs/dbraw/zinc/05/07/71/1037050771.db2.gz NQNQQJPUDNTARA-XMMPIXPASA-N -1 3 345.464 4.000 20 0 EIADHM CO[C@@H](C)c1cccc(NCc2cc(=O)oc3c(C)c([O-])ccc23)c1 ZINC000171091076 1037104036 /nfs/dbraw/zinc/10/40/36/1037104036.db2.gz OZCHUNGXYLHYNK-ZDUSSCGKSA-N -1 3 339.391 4.127 20 0 EIADHM CC1=C(C)C[C@@](C)(C(=O)OCc2nnc(-c3ccccc3[O-])o2)CC1 ZINC000909737583 1037166540 /nfs/dbraw/zinc/16/65/40/1037166540.db2.gz QVMOJQXIGSXNPM-IBGZPJMESA-N -1 3 342.395 4.012 20 0 EIADHM CC(C)(C)C[C@@H](NC(=O)c1cc(=O)c2ccccc2[n-]1)C(F)(F)F ZINC000272441206 1037188476 /nfs/dbraw/zinc/18/84/76/1037188476.db2.gz IGJGHPZRJSWDOQ-CQSZACIVSA-N -1 3 340.345 4.037 20 0 EIADHM Cc1sc2[n-]c([C@H](C)OC(=O)CCC3(C)CC3)nc(=O)c2c1C ZINC000910038398 1037277062 /nfs/dbraw/zinc/27/70/62/1037277062.db2.gz SHZJXSBSVJNZLS-JTQLQIEISA-N -1 3 334.441 4.198 20 0 EIADHM CC[C@@H](C)c1ccc(S(=O)(=O)[N-]c2cc(F)c(F)cc2F)cc1 ZINC000591683370 1037548511 /nfs/dbraw/zinc/54/85/11/1037548511.db2.gz CTIFIGQFJUEYSK-SNVBAGLBSA-N -1 3 343.370 4.418 20 0 EIADHM Cc1cc(S(=O)(=O)[N-]c2ccc(OC(C)C)cc2C)ccc1F ZINC000591796913 1037585000 /nfs/dbraw/zinc/58/50/00/1037585000.db2.gz BFWFXRHKJKYUKR-UHFFFAOYSA-N -1 3 337.416 4.031 20 0 EIADHM C[C@H]1CCN([C@@H](C(=O)[O-])c2ccc(Cl)c(Cl)c2)CC1(C)C ZINC000573616239 1037602282 /nfs/dbraw/zinc/60/22/82/1037602282.db2.gz ICXAPEKQDKFABR-IINYFYTJSA-N -1 3 330.255 4.487 20 0 EIADHM O=C([O-])C[C@@H](NCc1cscc1C(F)(F)F)c1cccs1 ZINC000669472747 1037941186 /nfs/dbraw/zinc/94/11/86/1037941186.db2.gz RNNGUWGFXBNXTD-SNVBAGLBSA-N -1 3 335.372 4.134 20 0 EIADHM Cc1oc(CN(C)CCCSCc2ccccc2)cc1C(=O)[O-] ZINC000593742863 1038147229 /nfs/dbraw/zinc/14/72/29/1038147229.db2.gz QUCVSRYBIHNROU-UHFFFAOYSA-N -1 3 333.453 4.042 20 0 EIADHM CC(C)(C)c1ccc2cc(C(=O)NCc3ccc([O-])c(F)c3)[nH]c2c1 ZINC000606536744 1038154351 /nfs/dbraw/zinc/15/43/51/1038154351.db2.gz ZEQJEHLASICWBM-UHFFFAOYSA-N -1 3 340.398 4.240 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)N1CCCCC[C@@H]1c1ccccc1 ZINC000606714744 1038226657 /nfs/dbraw/zinc/22/66/57/1038226657.db2.gz FPQDOUNKCMHWOG-GOSISDBHSA-N -1 3 342.414 4.358 20 0 EIADHM Cc1cc([N-]S(=O)(=O)c2ccc(F)cc2C)ccc1OC(C)C ZINC000607616712 1038240093 /nfs/dbraw/zinc/24/00/93/1038240093.db2.gz MEOMXLMBVVOFCZ-UHFFFAOYSA-N -1 3 337.416 4.031 20 0 EIADHM COc1ccc(-c2ccc(-c3nc4ccc(F)cc4c(=O)[n-]3)cc2)cc1 ZINC000608103007 1038610342 /nfs/dbraw/zinc/61/03/42/1038610342.db2.gz ZPMQYDUWDHJGRY-UHFFFAOYSA-N -1 3 346.361 4.405 20 0 EIADHM CC[C@H]1CCc2c(sc3[n-]c(COC4CCCC4)nc(=O)c23)C1 ZINC000608386163 1038811531 /nfs/dbraw/zinc/81/15/31/1038811531.db2.gz NLJXOGBZRRXSEM-NSHDSACASA-N -1 3 332.469 4.371 20 0 EIADHM Cc1ccccc1[C@H]1CN(C(=O)c2ccc(C(C)C)cc2[O-])CCO1 ZINC000608443505 1038824306 /nfs/dbraw/zinc/82/43/06/1038824306.db2.gz MYQOTVJVZNAJKA-HXUWFJFHSA-N -1 3 339.435 4.038 20 0 EIADHM Cc1cc(-c2nc3cc(F)ccc3c(=O)[n-]2)cc(C)c1Br ZINC000477832330 1039128934 /nfs/dbraw/zinc/12/89/34/1039128934.db2.gz CMZUXVMTEPKAQQ-UHFFFAOYSA-N -1 3 347.187 4.109 20 0 EIADHM Cc1ccc(C(=O)N(Cc2ccco2)Cc2cccs2)c([O-])c1 ZINC000120915682 1039236699 /nfs/dbraw/zinc/23/66/99/1039236699.db2.gz HTQRGBJQKAHKNN-UHFFFAOYSA-N -1 3 327.405 4.198 20 0 EIADHM CCOc1ccccc1OCCCC(=O)Nc1c([O-])cccc1Cl ZINC000552432543 1039512016 /nfs/dbraw/zinc/51/20/16/1039512016.db2.gz PHZZLVCILCTDHB-UHFFFAOYSA-N -1 3 349.814 4.242 20 0 EIADHM O=C(Oc1cccc(OC(F)(F)F)c1)c1cccc(Cl)c1[O-] ZINC001269803339 1039567573 /nfs/dbraw/zinc/56/75/73/1039567573.db2.gz LPTYODAQTKFQEU-UHFFFAOYSA-N -1 3 332.661 4.163 20 0 EIADHM CCc1ccc([O-])c(C(=O)N(CC)[C@@H](C)Cc2ccc(OC)cc2)c1 ZINC000537642479 1039727522 /nfs/dbraw/zinc/72/75/22/1039727522.db2.gz BMMPBZOCEWYZBF-HNNXBMFYSA-N -1 3 341.451 4.057 20 0 EIADHM O=C(Cc1ccc([O-])c(F)c1)N[C@@H]1CC[C@@H](c2cccc(Cl)c2)C1 ZINC000457076751 1039830190 /nfs/dbraw/zinc/83/01/90/1039830190.db2.gz KZPBDYXSQROYAD-GDBMZVCRSA-N -1 3 347.817 4.180 20 0 EIADHM C[C@H]1[C@H](c2ccccc2)CCN1C(=O)CCCc1ccc([O-])c(F)c1 ZINC000468970507 1039851358 /nfs/dbraw/zinc/85/13/58/1039851358.db2.gz NJAZOSFCJPXAGH-MAUKXSAKSA-N -1 3 341.426 4.259 20 0 EIADHM CCc1c([N-]C(=O)c2cc([C@H](C)CC)no2)onc1C(F)(F)F ZINC000476744639 1039853509 /nfs/dbraw/zinc/85/35/09/1039853509.db2.gz JVPNRCQPBIBHSY-SSDOTTSWSA-N -1 3 331.294 4.010 20 0 EIADHM C[C@H](c1ccccc1Cl)N(C)C(=O)c1c[n-]c2ccccc2c1=O ZINC000097106396 1039863568 /nfs/dbraw/zinc/86/35/68/1039863568.db2.gz MNXBLPFSNUFBSW-GFCCVEGCSA-N -1 3 340.810 4.015 20 0 EIADHM CCCCCc1nnc([N-]C(=O)c2oc(SC)cc2C)s1 ZINC000666968513 1040037003 /nfs/dbraw/zinc/03/70/03/1040037003.db2.gz OFTFXMSLUCDLAV-UHFFFAOYSA-N -1 3 325.459 4.146 20 0 EIADHM Cc1sc2[n-]c([C@H](C)OC(=O)C=C3CCCCC3)nc(=O)c2c1C ZINC000064132247 1040394187 /nfs/dbraw/zinc/39/41/87/1040394187.db2.gz QHHTYQDIFWIWQE-NSHDSACASA-N -1 3 346.452 4.096 20 0 EIADHM Cc1cc(CN2CCC(Cc3ccc(F)c(F)c3)CC2)oc1C(=O)[O-] ZINC000568062634 1040471498 /nfs/dbraw/zinc/47/14/98/1040471498.db2.gz KHRSMGIRWDTNAL-UHFFFAOYSA-N -1 3 349.377 4.019 20 0 EIADHM CC(C)Oc1ccc(C=C(Cc2ccccc2)c2nccc(=O)[n-]2)cc1 ZINC000477415706 1040491662 /nfs/dbraw/zinc/49/16/62/1040491662.db2.gz SSPWBKNFCWMQFI-CYVLTUHYSA-N -1 3 346.430 4.340 20 0 EIADHM Cc1cc(C)cc(NC(=O)NCc2ccc([O-])c(Br)c2)c1 ZINC000479664827 1040546879 /nfs/dbraw/zinc/54/68/79/1040546879.db2.gz RYQWGALBKXEBPP-UHFFFAOYSA-N -1 3 349.228 4.093 20 0 EIADHM COc1cc(C)c([N-]S(=O)(=O)c2ccccc2C(C)C)cc1C ZINC000435724167 1040578545 /nfs/dbraw/zinc/57/85/45/1040578545.db2.gz WLINBQCAFMWFAR-UHFFFAOYSA-N -1 3 333.453 4.236 20 0 EIADHM COc1ccc([O-])c(C(=O)Nc2cc(-c3cccnc3)ccc2C)c1 ZINC000477537876 1040581008 /nfs/dbraw/zinc/58/10/08/1040581008.db2.gz SNBKWXKGPHBMJX-UHFFFAOYSA-N -1 3 334.375 4.024 20 0 EIADHM C[C@@H]1CCN(Cc2nc(=O)c3sccc3[n-]2)CC12CCCCC2 ZINC000462464572 1040622189 /nfs/dbraw/zinc/62/21/89/1040622189.db2.gz PRACGLQPTYOTPT-CYBMUJFWSA-N -1 3 331.485 4.189 20 0 EIADHM CN(C)Cc1cccc(C(=O)Nc2cc(Cl)cc(Cl)c2[O-])c1 ZINC000537728733 1040778324 /nfs/dbraw/zinc/77/83/24/1040778324.db2.gz PYONRWROVKGZKK-UHFFFAOYSA-N -1 3 339.222 4.013 20 0 EIADHM CCOc1ccc(F)c([N-]C(=O)c2ncccc2C(F)(F)F)c1F ZINC000537755495 1040808430 /nfs/dbraw/zinc/80/84/30/1040808430.db2.gz CZJKJLJLQRWDRP-UHFFFAOYSA-N -1 3 346.255 4.030 20 0 EIADHM CCOc1ccc([N-]S(=O)(=O)c2ccc(C(C)(C)C)cc2)c(C)c1 ZINC000515699065 1041003568 /nfs/dbraw/zinc/00/35/68/1041003568.db2.gz CVWHDTSLPVPQEP-UHFFFAOYSA-N -1 3 347.480 4.492 20 0 EIADHM CC(C)c1ccc([C@H]2CCCN2C(=O)N=c2cc3ccccn3[n-]2)cc1 ZINC000554412603 1041092653 /nfs/dbraw/zinc/09/26/53/1041092653.db2.gz DUQNZRARWAPMBE-LJQANCHMSA-N -1 3 348.450 4.249 20 0 EIADHM O=C(c1cc(Oc2ccccc2)ccc1[O-])N1CCCC[C@H]1C(F)F ZINC000436485403 1041285026 /nfs/dbraw/zinc/28/50/26/1041285026.db2.gz AHAMATJNIRASNI-INIZCTEOSA-N -1 3 347.361 4.444 20 0 EIADHM O=C(c1cc(Oc2ccccc2)ccc1[O-])N1CCCC[C@@H]1C(F)F ZINC000436485408 1041287303 /nfs/dbraw/zinc/28/73/03/1041287303.db2.gz AHAMATJNIRASNI-MRXNPFEDSA-N -1 3 347.361 4.444 20 0 EIADHM COc1ccc2oc(CN[C@@H](CC(=O)[O-])c3cccc(C)c3)cc2c1 ZINC000904046188 1041300818 /nfs/dbraw/zinc/30/08/18/1041300818.db2.gz WTQLQURKJLWLLC-SFHVURJKSA-N -1 3 339.391 4.055 20 0 EIADHM Cc1ccc(C(=O)N(C)[C@@H](C)c2ccccc2Br)c([O-])c1 ZINC000436522269 1041305158 /nfs/dbraw/zinc/30/51/58/1041305158.db2.gz SPAJTUUAHJMKAP-LBPRGKRZSA-N -1 3 348.240 4.296 20 0 EIADHM O=C([O-])C[C@H](CNCc1nc2cc(F)ccc2o1)C1CCCCCC1 ZINC000904026754 1041306771 /nfs/dbraw/zinc/30/67/71/1041306771.db2.gz JVIMWPNIEQHIEH-CQSZACIVSA-N -1 3 348.418 4.118 20 0 EIADHM CC(=O)c1ccc(C(=O)N2CCC[C@@H]2c2ccc(Cl)cc2)cc1[O-] ZINC000436526722 1041310174 /nfs/dbraw/zinc/31/01/74/1041310174.db2.gz BJRUMQQLPHMIKN-QGZVFWFLSA-N -1 3 343.810 4.226 20 0 EIADHM COc1ccc(C(=O)N2CCCCC[C@H]2c2ccc(C)o2)c([O-])c1 ZINC000436529015 1041313037 /nfs/dbraw/zinc/31/30/37/1041313037.db2.gz NNXLWMXRLGQLAQ-INIZCTEOSA-N -1 3 329.396 4.060 20 0 EIADHM O=C(c1cc(Cc2ccccc2)ccc1[O-])N1CCCC[C@H]1C(F)F ZINC000436518881 1041322024 /nfs/dbraw/zinc/32/20/24/1041322024.db2.gz MSQXKLVVZXFSTH-KRWDZBQOSA-N -1 3 345.389 4.243 20 0 EIADHM Cc1cnc([C@H](NC(=O)c2ccc(C(C)C)cc2[O-])C2CC2)s1 ZINC000436591392 1041351408 /nfs/dbraw/zinc/35/14/08/1041351408.db2.gz PXTMKXZWHLZBLP-MRXNPFEDSA-N -1 3 330.453 4.162 20 0 EIADHM CC[C@H]1CN(C(=O)c2ccc(OC)cc2[O-])CC[C@@H]1c1ccccc1 ZINC000436587261 1041363815 /nfs/dbraw/zinc/36/38/15/1041363815.db2.gz OWPSDGPSSMESEO-YJBOKZPZSA-N -1 3 339.435 4.057 20 0 EIADHM CC(C)c1ccc(C(=O)N2CC[C@H](c3ccc(F)cc3)C2)c([O-])c1 ZINC000436588983 1041364040 /nfs/dbraw/zinc/36/40/40/1041364040.db2.gz NYVFILWKXOOXIU-INIZCTEOSA-N -1 3 327.399 4.284 20 0 EIADHM Cc1ccc(C(=O)Nc2ccc(F)cc2OC(F)F)c([O-])c1C ZINC000436586378 1041364194 /nfs/dbraw/zinc/36/41/94/1041364194.db2.gz BNBLCPCUGBPHLQ-UHFFFAOYSA-N -1 3 325.286 4.002 20 0 EIADHM CC(C)c1ccc(C(=O)N2CCc3[nH]c4ccccc4c3C2)c([O-])c1 ZINC000436643890 1041400336 /nfs/dbraw/zinc/40/03/36/1041400336.db2.gz ZKRZYOGPERCMKC-UHFFFAOYSA-N -1 3 334.419 4.195 20 0 EIADHM O=C(c1c([O-])cccc1O)N1CCC(c2cccc3ccccc32)CC1 ZINC000436648594 1041404808 /nfs/dbraw/zinc/40/48/08/1041404808.db2.gz OMKZAVHAZIBMQP-UHFFFAOYSA-N -1 3 347.414 4.271 20 0 EIADHM CC(C)Oc1ncccc1-c1noc(-c2cc3ccccc3cc2[O-])n1 ZINC000436691038 1041425043 /nfs/dbraw/zinc/42/50/43/1041425043.db2.gz WVKUNLNPQWFKQF-UHFFFAOYSA-N -1 3 347.374 4.445 20 0 EIADHM O=C(c1ccccc1[O-])N(Cc1cccs1)C1Cc2ccccc2C1 ZINC000436716141 1041439173 /nfs/dbraw/zinc/43/91/73/1041439173.db2.gz ZOLPCAAGAMEPKF-UHFFFAOYSA-N -1 3 349.455 4.264 20 0 EIADHM Cc1cc(C(=O)Nc2cc(Cl)ccc2[O-])nn1C1CCCCC1 ZINC000436765875 1041474195 /nfs/dbraw/zinc/47/41/95/1041474195.db2.gz BTCUDRGVYJHPMV-UHFFFAOYSA-N -1 3 333.819 4.308 20 0 EIADHM COCc1ccc([C@@H]2CCCN2C(=O)c2ccc(C(C)C)cc2[O-])o1 ZINC000436813768 1041493611 /nfs/dbraw/zinc/49/36/11/1041493611.db2.gz GALMGNCSZXBTKE-KRWDZBQOSA-N -1 3 343.423 4.232 20 0 EIADHM CCc1ccc(C(=O)N(C)[C@@H](COC)c2ccc(Cl)cc2)c([O-])c1 ZINC000436834237 1041498202 /nfs/dbraw/zinc/49/82/02/1041498202.db2.gz LKTFZWAJRDVVRL-KRWDZBQOSA-N -1 3 347.842 4.068 20 0 EIADHM CCc1ccc(C(=O)Nc2cnn([C@H](C)CC)c2C2CC2)c([O-])c1 ZINC000436832568 1041499605 /nfs/dbraw/zinc/49/96/05/1041499605.db2.gz SJOYMPSCOIRPLM-GFCCVEGCSA-N -1 3 327.428 4.252 20 0 EIADHM CCc1ccc(C(=O)N(CC)[C@@H](C)Cc2ccc(OC)cc2)c([O-])c1 ZINC000436820288 1041501612 /nfs/dbraw/zinc/50/16/12/1041501612.db2.gz GHYMWJRAXPQTOU-HNNXBMFYSA-N -1 3 341.451 4.057 20 0 EIADHM Cc1ccc(C(=O)N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)c([O-])c1 ZINC000436854507 1041506079 /nfs/dbraw/zinc/50/60/79/1041506079.db2.gz SOLWDKMRJKYEGU-CQSZACIVSA-N -1 3 349.352 4.349 20 0 EIADHM Cc1ccc(C(=O)Nc2ccccc2O[C@@H](C)C(F)(F)F)c([O-])c1 ZINC000436841384 1041510044 /nfs/dbraw/zinc/51/00/44/1041510044.db2.gz AHPZBTCNOXRHDG-NSHDSACASA-N -1 3 339.313 4.283 20 0 EIADHM CCc1ccc(-c2nc(-c3ccccc3OC(F)F)no2)c([O-])c1 ZINC000436844097 1041513097 /nfs/dbraw/zinc/51/30/97/1041513097.db2.gz LVMCNAYUFUIXRF-UHFFFAOYSA-N -1 3 332.306 4.273 20 0 EIADHM CC[C@H](C)CN(C)C(=O)c1cc(CCc2ccccc2)ccc1[O-] ZINC000436861738 1041522384 /nfs/dbraw/zinc/52/23/84/1041522384.db2.gz FNIJKVODNUCBDC-INIZCTEOSA-N -1 3 325.452 4.296 20 0 EIADHM CC(C)c1ccc(C(=O)N2CC[C@H](Cc3ccc(F)cc3)C2)c([O-])c1 ZINC000436878166 1041536426 /nfs/dbraw/zinc/53/64/26/1041536426.db2.gz ITQZLQLXELVQJR-MRXNPFEDSA-N -1 3 341.426 4.360 20 0 EIADHM COc1ccc2cc(-c3noc(-c4cc(OC)ccc4[O-])n3)ccc2c1 ZINC000436907954 1041548640 /nfs/dbraw/zinc/54/86/40/1041548640.db2.gz ZTBOOOQXYLDRGT-UHFFFAOYSA-N -1 3 348.358 4.280 20 0 EIADHM CC(=O)c1ccc(C(=O)N(Cc2ccc(C)s2)C(C)C)cc1[O-] ZINC000667148094 1041556420 /nfs/dbraw/zinc/55/64/20/1041556420.db2.gz QQJAHCABMFMETK-UHFFFAOYSA-N -1 3 331.437 4.016 20 0 EIADHM O=C(c1ccc(O)cc1[O-])N(Cc1ccc2ccccc2c1)C1CC1 ZINC000436915811 1041556389 /nfs/dbraw/zinc/55/63/89/1041556389.db2.gz QLNATHKRORZAPT-UHFFFAOYSA-N -1 3 333.387 4.056 20 0 EIADHM Cc1csc(-c2noc(-c3cc(Cc4ccccc4)ccc3[O-])n2)n1 ZINC000436930294 1041561830 /nfs/dbraw/zinc/56/18/30/1041561830.db2.gz WPDVWRAZZFQMTP-UHFFFAOYSA-N -1 3 349.415 4.465 20 0 EIADHM [O-]c1cc2ccccc2cc1-c1nc(-c2ccc3nccnc3c2)no1 ZINC000436932942 1041563538 /nfs/dbraw/zinc/56/35/38/1041563538.db2.gz RNHLNQBBZZAPSJ-UHFFFAOYSA-N -1 3 340.342 4.206 20 0 EIADHM CCC(C)(C)OCc1ccccc1NC(=O)c1cc(OC)ccc1[O-] ZINC000436936826 1041565550 /nfs/dbraw/zinc/56/55/50/1041565550.db2.gz CRZQTPCSEUKZSO-UHFFFAOYSA-N -1 3 343.423 4.358 20 0 EIADHM CO[C@H](c1noc(-c2ccc(C)cc2[O-])n1)c1ccccc1Cl ZINC000436951578 1041573630 /nfs/dbraw/zinc/57/36/30/1041573630.db2.gz GHYLCRXYHNXXRO-HNNXBMFYSA-N -1 3 330.771 4.140 20 0 EIADHM CCCCOc1ccc(C(=O)N2CC[C@H](c3ccccc3)C2)c([O-])c1 ZINC000436973293 1041578339 /nfs/dbraw/zinc/57/83/39/1041578339.db2.gz SRNCINVLYHVWHP-KRWDZBQOSA-N -1 3 339.435 4.201 20 0 EIADHM COc1ccc([O-])c(-c2nc(-c3ccccc3C(F)(F)F)no2)c1 ZINC000437007049 1041590215 /nfs/dbraw/zinc/59/02/15/1041590215.db2.gz YXPOELYWZGAPGB-UHFFFAOYSA-N -1 3 336.269 4.137 20 0 EIADHM CCOc1ccccc1-c1cccc(C(=O)Nc2ncccc2[O-])c1 ZINC000539016879 1041609563 /nfs/dbraw/zinc/60/95/63/1041609563.db2.gz YFUHETCKZHRZQZ-UHFFFAOYSA-N -1 3 334.375 4.105 20 0 EIADHM CN(Cc1ccccc1Cl)C(=O)c1cc([O-])cc(C(F)(F)F)c1 ZINC000646565742 1041660967 /nfs/dbraw/zinc/66/09/67/1041660967.db2.gz MHXODFPOIKUDHC-UHFFFAOYSA-N -1 3 343.732 4.337 20 0 EIADHM O=C(Nc1cccc([O-])c1F)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F ZINC000516646802 1041689185 /nfs/dbraw/zinc/68/91/85/1041689185.db2.gz ROLGWCOLGYQHIF-KGXPXNLBSA-N -1 3 331.309 4.085 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)N[C@H]1C[C@H](c2cccc(F)c2)C1 ZINC000437424813 1041797238 /nfs/dbraw/zinc/79/72/38/1041797238.db2.gz FGWYXCBAEVXNGV-JCNLHEQBSA-N -1 3 345.389 4.056 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@@H]3CC[C@@H](C)[C@@H](C)C3)nc2)n1 ZINC000541593777 1042026082 /nfs/dbraw/zinc/02/60/82/1042026082.db2.gz ACLDDRIOAVJBRF-DVOMOZLQSA-N -1 3 326.444 4.043 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@@H]3CC[C@@H](C)[C@H](C)C3)nc2)n1 ZINC000541593780 1042026136 /nfs/dbraw/zinc/02/61/36/1042026136.db2.gz ACLDDRIOAVJBRF-XJKCOSOUSA-N -1 3 326.444 4.043 20 0 EIADHM Cc1oc(C(C)C)cc1C(=O)N=c1cc(-c2ccccc2F)o[n-]1 ZINC000509496622 1042074504 /nfs/dbraw/zinc/07/45/04/1042074504.db2.gz XUGKTONODBKXOS-UHFFFAOYSA-N -1 3 328.343 4.180 20 0 EIADHM COc1ccc(CCCCC(=O)Nc2cc(Cl)ccc2[O-])cc1 ZINC000517560014 1042075497 /nfs/dbraw/zinc/07/54/97/1042075497.db2.gz OUNBTIOARHNXNL-UHFFFAOYSA-N -1 3 333.815 4.406 20 0 EIADHM CSc1ccc(C(=O)[N-]c2nnc(CC3CCCCC3)s2)o1 ZINC000303427752 1042425369 /nfs/dbraw/zinc/42/53/69/1042425369.db2.gz CKSKZJLVRQFHHH-UHFFFAOYSA-N -1 3 337.470 4.228 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@@H](CC)Cc3ccccc3)nc2)n1 ZINC000518318026 1042464943 /nfs/dbraw/zinc/46/49/43/1042464943.db2.gz DPUYEUCYVHYXKX-KRWDZBQOSA-N -1 3 348.450 4.240 20 0 EIADHM CC(C)(C)CN(Cc1ccccc1)Cc1nc(=O)c2sccc2[n-]1 ZINC000506619799 1042692793 /nfs/dbraw/zinc/69/27/93/1042692793.db2.gz REZONHLJARIUSG-UHFFFAOYSA-N -1 3 341.480 4.445 20 0 EIADHM O=S(=O)([N-]c1cc(F)c(F)cc1Cl)c1ccccc1Cl ZINC000176726011 1042816813 /nfs/dbraw/zinc/81/68/13/1042816813.db2.gz OLYYJDYPRXFNCP-UHFFFAOYSA-N -1 3 338.162 4.072 20 0 EIADHM Cc1onc(-c2ccccn2)c1C(=O)[N-]c1cc(Cl)cc(F)c1F ZINC000441574613 1042893732 /nfs/dbraw/zinc/89/37/32/1042893732.db2.gz QIDFCGCCCDHAOB-UHFFFAOYSA-N -1 3 349.724 4.229 20 0 EIADHM O=C(/C=C\c1nc2ccccc2s1)Nc1c([O-])cccc1Cl ZINC000493355822 1042897394 /nfs/dbraw/zinc/89/73/94/1042897394.db2.gz QPISAVFVNGTLCU-HJWRWDBZSA-N -1 3 330.796 4.307 20 0 EIADHM O=C(/C=C\Sc1cc(F)ccc1F)Nc1cccc([O-])c1F ZINC000493342407 1042899313 /nfs/dbraw/zinc/89/93/13/1042899313.db2.gz YAQBWYONUQXVSZ-SREVYHEPSA-N -1 3 325.311 4.054 20 0 EIADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)C=CC3CCCC3)c2)n1 ZINC000493703116 1042950259 /nfs/dbraw/zinc/95/02/59/1042950259.db2.gz DLLFMYVZXUSEEL-KHPPLWFESA-N -1 3 337.423 4.097 20 0 EIADHM CCc1c(C(=O)Nc2cc(Cl)ccc2[O-])cnn1CCC(C)C ZINC000427616027 1042986855 /nfs/dbraw/zinc/98/68/55/1042986855.db2.gz SBTNGNFWKOCYDL-UHFFFAOYSA-N -1 3 335.835 4.103 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N1CCc2ccc(F)c(F)c2C1 ZINC000355228824 1043068056 /nfs/dbraw/zinc/06/80/56/1043068056.db2.gz NORUFCALAAIXLZ-UHFFFAOYSA-N -1 3 339.341 4.022 20 0 EIADHM CSc1ccccc1[N-]C(=O)c1ncoc1-c1ccc(F)cc1 ZINC000184647927 1043118213 /nfs/dbraw/zinc/11/82/13/1043118213.db2.gz VMUMDRWMJCUUGC-UHFFFAOYSA-N -1 3 328.368 4.455 20 0 EIADHM O=C([N-]c1cc(F)c(F)cc1F)c1ncoc1-c1ccc(F)cc1 ZINC000185647335 1043207722 /nfs/dbraw/zinc/20/77/22/1043207722.db2.gz GBIXJSZOXRPBEX-UHFFFAOYSA-N -1 3 336.244 4.150 20 0 EIADHM Cc1cccc([C@H]2CCN(C(=O)c3cc([O-])c4ccccc4c3)C2)c1 ZINC000525931392 1043236233 /nfs/dbraw/zinc/23/62/33/1043236233.db2.gz GWYAUMLTDQJKGI-SFHVURJKSA-N -1 3 331.415 4.484 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N1CCc2c([nH]c3ccccc32)C1 ZINC000525928317 1043236309 /nfs/dbraw/zinc/23/63/09/1043236309.db2.gz DGFLTENDDPJMDC-UHFFFAOYSA-N -1 3 342.398 4.225 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2ccc(C3CCCC3)cc2)cc1N ZINC001212457934 1043241065 /nfs/dbraw/zinc/24/10/65/1043241065.db2.gz TUJQEGKMXFWCQV-UHFFFAOYSA-N -1 3 330.453 4.036 20 0 EIADHM COc1ccc([C@@H](NC(=O)c2cc([O-])c3ccccc3c2)C2CC2)cc1 ZINC000526910311 1043245958 /nfs/dbraw/zinc/24/59/58/1043245958.db2.gz ZDQAQEWFARWQCG-NRFANRHFSA-N -1 3 347.414 4.435 20 0 EIADHM CC(C)C(=O)Nc1ccc(NC(=O)c2cc([O-])c3ccccc3c2)cc1 ZINC000527154425 1043251470 /nfs/dbraw/zinc/25/14/70/1043251470.db2.gz WROSQONWSJNYRX-UHFFFAOYSA-N -1 3 348.402 4.392 20 0 EIADHM COc1ccc(C(=O)N(Cc2cccc(Cl)c2)C(C)C)c([O-])c1 ZINC000220098916 1043290457 /nfs/dbraw/zinc/29/04/57/1043290457.db2.gz TVELLGWKQNJZOM-UHFFFAOYSA-N -1 3 333.815 4.105 20 0 EIADHM O=C(Nc1cc(F)ccc1[O-])c1c[nH]c2ccc(Br)cc21 ZINC000674015546 1043304446 /nfs/dbraw/zinc/30/44/46/1043304446.db2.gz RUCGWIMMNQUDIN-UHFFFAOYSA-N -1 3 349.159 4.027 20 0 EIADHM Cc1ccc([O-])c(C(=O)Nc2ncc(Cc3cccc(F)c3)s2)c1 ZINC001626096043 1043323593 /nfs/dbraw/zinc/32/35/93/1043323593.db2.gz NJDAQZNCHFJAGZ-UHFFFAOYSA-N -1 3 342.395 4.139 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]Cc2ccc(-c3ccccc3)c(C)c2)o1 ZINC000494270966 1043391583 /nfs/dbraw/zinc/39/15/83/1043391583.db2.gz MARNWQXTAMYWCA-UHFFFAOYSA-N -1 3 341.432 4.042 20 0 EIADHM Cc1nc(CC(C)C)oc1C(=O)[N-]c1c(F)cc(Cl)cc1F ZINC000189124381 1043440765 /nfs/dbraw/zinc/44/07/65/1043440765.db2.gz JPHBJZNZJSZCIZ-UHFFFAOYSA-N -1 3 328.746 4.365 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2cc(Cl)cc(F)c2F)c(C)c1 ZINC000442242546 1043578428 /nfs/dbraw/zinc/57/84/28/1043578428.db2.gz MHEWNJMEJAEMHZ-UHFFFAOYSA-N -1 3 331.771 4.036 20 0 EIADHM Cc1c(Br)ccc([O-])c1NC(=O)C=C(C1CC1)C1CC1 ZINC001117822124 1043650234 /nfs/dbraw/zinc/65/02/34/1043650234.db2.gz RTAZTSIDWCQPHN-UHFFFAOYSA-N -1 3 336.229 4.148 20 0 EIADHM CSc1cc(O)ccc1[N-]C(=O)c1cc(-c2ccc(F)cc2)on1 ZINC000191203222 1043796530 /nfs/dbraw/zinc/79/65/30/1043796530.db2.gz YGCDQQYWFBECDO-UHFFFAOYSA-N -1 3 344.367 4.161 20 0 EIADHM CSc1cc(O)ccc1[N-]C(=O)c1coc(-c2ccccc2)n1 ZINC000191195109 1043798105 /nfs/dbraw/zinc/79/81/05/1043798105.db2.gz LSTXEFPLYHHHFN-UHFFFAOYSA-N -1 3 326.377 4.021 20 0 EIADHM Cc1cccc(F)c1[N-]S(=O)(=O)c1ccc(CC(F)(F)F)cc1 ZINC000191789082 1043848068 /nfs/dbraw/zinc/84/80/68/1043848068.db2.gz HCPSTFJOAQQNGN-UHFFFAOYSA-N -1 3 347.333 4.040 20 0 EIADHM CC(C)(C(=O)[O-])[C@H]1CCCN(Cc2ccc(Cl)c(Cl)c2)C1 ZINC000169106263 1043961662 /nfs/dbraw/zinc/96/16/62/1043961662.db2.gz ZDPARSOQRZJSMY-LBPRGKRZSA-N -1 3 330.255 4.316 20 0 EIADHM C[C@@H](c1ccccc1F)N1CCC(C(=O)c2ccc([O-])cc2)CC1 ZINC000079949166 1044043447 /nfs/dbraw/zinc/04/34/47/1044043447.db2.gz DAZYGYPMJCDKQH-AWEZNQCLSA-N -1 3 327.399 4.187 20 0 EIADHM Cc1cc(O[C@@H](C)c2cc(Br)ccc2F)[n-]c(=S)n1 ZINC001226797995 1044150370 /nfs/dbraw/zinc/15/03/70/1044150370.db2.gz FUPTWNWWKOHRHP-QMMMGPOBSA-N -1 3 343.221 4.115 20 0 EIADHM [O-]c1ccc(-c2nc(-c3ccccc3Oc3ccccc3)no2)nc1 ZINC001212558728 1044315246 /nfs/dbraw/zinc/31/52/46/1044315246.db2.gz BTYFCUDJDSSZHM-UHFFFAOYSA-N -1 3 331.331 4.297 20 0 EIADHM O=C(Nc1ccc(Br)cc1[O-])c1coc2ccccc12 ZINC000522201894 1044375565 /nfs/dbraw/zinc/37/55/65/1044375565.db2.gz TZCHWPZSYBZXIB-UHFFFAOYSA-N -1 3 332.153 4.153 20 0 EIADHM O=C([N-]c1nnc(C(F)(F)F)s1)c1ccc(-c2ccco2)s1 ZINC000675751253 1044467711 /nfs/dbraw/zinc/46/77/11/1044467711.db2.gz QJDQCUYNTNASCV-UHFFFAOYSA-N -1 3 345.327 4.131 20 0 EIADHM Cc1c(F)cccc1-c1ccc(/C=C2/C(=O)[N-]C(=O)c3ccccc32)o1 ZINC000734305716 1044527243 /nfs/dbraw/zinc/52/72/43/1044527243.db2.gz DIMYSVHQVHPERV-GZTJUZNOSA-N -1 3 347.345 4.205 20 0 EIADHM Cc1cc(=O)[n-]c(-c2ccc(NC(=O)[C@@H](C)CCC(C)(C)C)cc2)n1 ZINC000543468385 1044659089 /nfs/dbraw/zinc/65/90/89/1044659089.db2.gz BCRMKLXIEJEJKC-ZDUSSCGKSA-N -1 3 341.455 4.146 20 0 EIADHM Cc1csc(C(C)(C)[N-]C(=O)C(F)(F)c2cccc(Cl)c2)n1 ZINC000734805584 1044693659 /nfs/dbraw/zinc/69/36/59/1044693659.db2.gz QNCDGKDQEYMTGN-UHFFFAOYSA-N -1 3 344.814 4.248 20 0 EIADHM O=S(=O)([N-]Cc1cccc2ccccc21)c1ccc(Cl)s1 ZINC000033859595 1044744877 /nfs/dbraw/zinc/74/48/77/1044744877.db2.gz QPFIWNKSFOOKRJ-UHFFFAOYSA-N -1 3 337.853 4.033 20 0 EIADHM Cc1cc(=O)[n-]c(CSc2ccc(Cl)c(C(F)(F)F)c2)n1 ZINC000761852084 1044805442 /nfs/dbraw/zinc/80/54/42/1044805442.db2.gz HXPBOPPOASWQBG-UHFFFAOYSA-N -1 3 334.750 4.455 20 0 EIADHM C[C@H](OC(=O)c1cc2ccsc2[n-]1)c1nc(-c2cccs2)no1 ZINC000914890497 1044852781 /nfs/dbraw/zinc/85/27/81/1044852781.db2.gz ARBIJPLMKWJGSZ-QMMMGPOBSA-N -1 3 345.405 4.259 20 0 EIADHM O=C(Nc1nc2c(ccc(F)c2F)s1)c1cc([O-])ccc1Cl ZINC000495284999 1044854025 /nfs/dbraw/zinc/85/40/25/1044854025.db2.gz GRAJPYYUUWTJPR-UHFFFAOYSA-N -1 3 340.738 4.186 20 0 EIADHM Cc1ccc(Cl)c([N-]S(=O)(=O)c2cc(C)c(F)cc2F)c1 ZINC000474317182 1044854413 /nfs/dbraw/zinc/85/44/13/1044854413.db2.gz WJMNCEGVKFHBDB-UHFFFAOYSA-N -1 3 331.771 4.036 20 0 EIADHM O=C([N-]C1(c2ccccc2F)CC1)C(F)(F)c1cccc(Cl)c1 ZINC000736049409 1044896153 /nfs/dbraw/zinc/89/61/53/1044896153.db2.gz UELQZECKBHBJOG-UHFFFAOYSA-N -1 3 339.744 4.376 20 0 EIADHM CC[C@H]([N-]C(=O)C(F)(F)c1ccccc1)c1ccc(F)cc1F ZINC000737643155 1045016798 /nfs/dbraw/zinc/01/67/98/1045016798.db2.gz AKJWRKDKSWFWPZ-HNNXBMFYSA-N -1 3 325.305 4.324 20 0 EIADHM CC(C)Oc1cccc(CO[N-]C(=O)Cc2cccc3ccccc32)c1 ZINC000738295406 1045056187 /nfs/dbraw/zinc/05/61/87/1045056187.db2.gz XPSBDRTXGAAWTQ-UHFFFAOYSA-N -1 3 349.430 4.418 20 0 EIADHM CC[C@@H](NC(=O)c1c(C)cccc1[O-])c1nc(C(F)(F)F)cs1 ZINC000625951987 1045060167 /nfs/dbraw/zinc/06/01/67/1045060167.db2.gz LRAILFQXIOCBAT-SECBINFHSA-N -1 3 344.358 4.057 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)c1ccc2c(c1)-c1ccccc1C2 ZINC000738551764 1045064268 /nfs/dbraw/zinc/06/42/68/1045064268.db2.gz KYSGFCRHWKAKGU-UHFFFAOYSA-N -1 3 333.362 4.033 20 0 EIADHM CSc1cccc(S(=O)(=O)[N-]c2ccc(Cl)cc2F)c1 ZINC000509097675 1045123357 /nfs/dbraw/zinc/12/33/57/1045123357.db2.gz JCAAXYJSYNNFJJ-UHFFFAOYSA-N -1 3 331.821 4.002 20 0 EIADHM Cc1noc(C(F)F)c1C(=O)[N-]c1cc(C(F)(F)F)ccc1F ZINC000673657990 1045176001 /nfs/dbraw/zinc/17/60/01/1045176001.db2.gz JABJEMVIVWPIGJ-UHFFFAOYSA-N -1 3 338.207 4.331 20 0 EIADHM O=C(OCCC(Cl)(Cl)Cl)c1cc(Cl)c(Cl)[n-]1 ZINC000767475599 1045546869 /nfs/dbraw/zinc/54/68/69/1045546869.db2.gz OVDOLUVNHQYXDF-UHFFFAOYSA-N -1 3 325.406 4.239 20 0 EIADHM Cc1nc(C(C)(C)NC(=O)c2cc3sccc3c([O-])c2)sc1C ZINC000791368458 1045727034 /nfs/dbraw/zinc/72/70/34/1045727034.db2.gz YJGCVGUVSKWTBY-UHFFFAOYSA-N -1 3 346.477 4.345 20 0 EIADHM CCC(CC)[C@H]1C[C@H](NC(=O)c2cc3sccc3c([O-])c2)CCO1 ZINC000791398024 1045735043 /nfs/dbraw/zinc/73/50/43/1045735043.db2.gz FPVYGPDTFREPEF-RHSMWYFYSA-N -1 3 347.480 4.321 20 0 EIADHM Cc1cc(=O)[n-]c(CSCc2ccc(Cl)c3cccnc23)n1 ZINC000763208636 1045741094 /nfs/dbraw/zinc/74/10/94/1045741094.db2.gz AAPFWXDJVUPBCL-UHFFFAOYSA-N -1 3 331.828 4.126 20 0 EIADHM CCc1ccc(Cl)c(CC)c1NC([O-])=NO[C@H]1CCCCO1 ZINC000763266470 1045803085 /nfs/dbraw/zinc/80/30/85/1045803085.db2.gz FUNCPMWMRUBBQJ-AWEZNQCLSA-N -1 3 326.824 4.045 20 0 EIADHM CCc1ccc(Cl)c(CC)c1NC(=O)[N-]O[C@H]1CCCCO1 ZINC000763266470 1045803087 /nfs/dbraw/zinc/80/30/87/1045803087.db2.gz FUNCPMWMRUBBQJ-AWEZNQCLSA-N -1 3 326.824 4.045 20 0 EIADHM Cc1cccc(Oc2ccc(NC([O-])=NO[C@H]3CCCCO3)cc2)c1 ZINC000763268519 1045804024 /nfs/dbraw/zinc/80/40/24/1045804024.db2.gz QGWCSNSBKVTGIP-SFHVURJKSA-N -1 3 342.395 4.367 20 0 EIADHM Cc1cccc(Oc2ccc(NC(=O)[N-]O[C@H]3CCCCO3)cc2)c1 ZINC000763268519 1045804028 /nfs/dbraw/zinc/80/40/28/1045804028.db2.gz QGWCSNSBKVTGIP-SFHVURJKSA-N -1 3 342.395 4.367 20 0 EIADHM [O-]c1ccc(Nc2ccc(I)cc2)c(F)c1F ZINC001212011001 1045831983 /nfs/dbraw/zinc/83/19/83/1045831983.db2.gz LSFHQVJXXXVTGP-UHFFFAOYSA-N -1 3 347.102 4.019 20 0 EIADHM O=C(NC1CCCC1)c1ccc(Nc2ccc([O-])c(F)c2F)cc1 ZINC001212009465 1045832414 /nfs/dbraw/zinc/83/24/14/1045832414.db2.gz PRPKBSLCLMUGNZ-UHFFFAOYSA-N -1 3 332.350 4.086 20 0 EIADHM [O-]c1ccc(Nc2cccc([C@H]3CN4C=CSC4=N3)c2)c(F)c1F ZINC001212013883 1045835133 /nfs/dbraw/zinc/83/51/33/1045835133.db2.gz OBBCGVMNDRYIEV-CYBMUJFWSA-N -1 3 345.374 4.345 20 0 EIADHM O=S(=O)(/C=C\c1cccc(Cl)c1)[N-]c1cc(F)cc(F)c1 ZINC000768861095 1045857322 /nfs/dbraw/zinc/85/73/22/1045857322.db2.gz IAEDTZILVJIGMB-PLNGDYQASA-N -1 3 329.755 4.031 20 0 EIADHM C[C@@H](CNC(=O)c1cc([O-])c2ccccc2c1)c1nc2ccccc2o1 ZINC000792208198 1045870958 /nfs/dbraw/zinc/87/09/58/1045870958.db2.gz RQUHCXOUZMATCZ-ZDUSSCGKSA-N -1 3 346.386 4.220 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N1CCS[C@H](c2ccccc2)C1 ZINC000792186340 1045877070 /nfs/dbraw/zinc/87/70/70/1045877070.db2.gz OTVIBBGXMARSGA-FQEVSTJZSA-N -1 3 349.455 4.476 20 0 EIADHM O=C(Nc1nc2ccccc2n1C1CC1)c1cc([O-])c2ccccc2c1 ZINC000792280444 1045884768 /nfs/dbraw/zinc/88/47/68/1045884768.db2.gz VQPPXTRZHPLWQH-UHFFFAOYSA-N -1 3 343.386 4.482 20 0 EIADHM O=C([O-])[C@@H]1CCN(Cc2cc(Cl)ccc2Cl)[C@H]2CCC[C@@H]21 ZINC000629374933 1045898820 /nfs/dbraw/zinc/89/88/20/1045898820.db2.gz XEHUBNISLKSXSJ-NFAWXSAZSA-N -1 3 328.239 4.069 20 0 EIADHM C[C@H]1CCCN(Cc2nc(=O)c3c(-c4ccco4)csc3[n-]2)[C@H]1C ZINC000253544559 1046059311 /nfs/dbraw/zinc/05/93/11/1046059311.db2.gz PFVQJOHOISCXRL-RYUDHWBXSA-N -1 3 343.452 4.277 20 0 EIADHM COc1ccc(N(C(=O)c2ccc(C)cc2[O-])[C@H](C)C2CC2)cc1 ZINC000124611294 1046252996 /nfs/dbraw/zinc/25/29/96/1046252996.db2.gz LNIOCYLEPTWBEB-CQSZACIVSA-N -1 3 325.408 4.155 20 0 EIADHM CCc1nc(C(=O)[N-]c2ccccc2SCC(F)(F)F)co1 ZINC000154688548 1046319269 /nfs/dbraw/zinc/31/92/69/1046319269.db2.gz AYDNKKJRBCYKIT-UHFFFAOYSA-N -1 3 330.331 4.144 20 0 EIADHM O=C(c1cc([O-])ccc1Cl)N1CC[C@@H](c2cccc(Cl)c2)C1 ZINC000497094363 1046338630 /nfs/dbraw/zinc/33/86/30/1046338630.db2.gz DGQXIWUSOMIQDS-GFCCVEGCSA-N -1 3 336.218 4.329 20 0 EIADHM O=C(Nc1ccc(Nc2ccccc2)cc1)c1cc2c(cc1[O-])OCO2 ZINC000916739409 1046346649 /nfs/dbraw/zinc/34/66/49/1046346649.db2.gz DPIBYMRBPPXIPE-UHFFFAOYSA-N -1 3 348.358 4.117 20 0 EIADHM O=C([N-]Cc1cc(F)c(Cl)cc1F)C(F)(F)Cc1ccccc1 ZINC000793982844 1046361357 /nfs/dbraw/zinc/36/13/57/1046361357.db2.gz QXGSAYUGDLOBRA-UHFFFAOYSA-N -1 3 345.723 4.112 20 0 EIADHM CCCCC[C@](C)(CC)C(=O)Nc1nc2c(cccc2C(=O)OC)[n-]1 ZINC001127419634 1046370331 /nfs/dbraw/zinc/37/03/31/1046370331.db2.gz QFRPVJCIHVMKDJ-IBGZPJMESA-N -1 3 345.443 4.285 20 0 EIADHM [O-]c1cccc(CN[C@H](c2cccs2)C2CC2)c1Br ZINC000459396922 1046595400 /nfs/dbraw/zinc/59/54/00/1046595400.db2.gz WYEJFBQLLXULIL-HNNXBMFYSA-N -1 3 338.270 4.457 20 0 EIADHM CCOc1cc(CNc2ccc(N3CCCC3)nc2)cc(Cl)c1[O-] ZINC000459441921 1046672076 /nfs/dbraw/zinc/67/20/76/1046672076.db2.gz BTVSTERQAIBVKE-UHFFFAOYSA-N -1 3 347.846 4.052 20 0 EIADHM Cc1sc2[n-]c([C@H](C)OC(=O)[C@H]3CCCC3(C)C)nc(=O)c2c1C ZINC000772608422 1046673976 /nfs/dbraw/zinc/67/39/76/1046673976.db2.gz MPHUKUWWNKBCEQ-CMPLNLGQSA-N -1 3 348.468 4.444 20 0 EIADHM COc1cccc(SC)c1[N-]C(=O)c1sc(Cl)nc1C ZINC001129823696 1046742627 /nfs/dbraw/zinc/74/26/27/1046742627.db2.gz DXVQYPBMTBXEDV-UHFFFAOYSA-N -1 3 328.846 4.088 20 0 EIADHM Cc1ccc(C)c(OCCCCC(=O)Nc2cccc([O-])c2F)c1 ZINC000128181831 1046776433 /nfs/dbraw/zinc/77/64/33/1046776433.db2.gz OIHOGTZQPHIZNW-UHFFFAOYSA-N -1 3 331.387 4.336 20 0 EIADHM C[C@@H](OC(=O)c1cc2occc2[n-]1)c1nc2ccccc2n1C(F)F ZINC000786028653 1046799496 /nfs/dbraw/zinc/79/94/96/1046799496.db2.gz JUCWGCYCSXVDLV-SECBINFHSA-N -1 3 345.305 4.424 20 0 EIADHM O=C(OCc1csc(C2CC2)n1)c1cc2sccc2c([O-])c1 ZINC000786140555 1046811979 /nfs/dbraw/zinc/81/19/79/1046811979.db2.gz RERFWTUTIWHQQH-UHFFFAOYSA-N -1 3 331.418 4.298 20 0 EIADHM CC(C)c1ccoc1C(=O)[N-]c1nc(-c2ccc(F)cc2)ns1 ZINC000786156856 1046813268 /nfs/dbraw/zinc/81/32/68/1046813268.db2.gz PXNPRIXBWRVFDQ-UHFFFAOYSA-N -1 3 331.372 4.313 20 0 EIADHM Cn1ncc(NC(=O)c2cc3sccc3c([O-])c2)c1-c1ccccc1 ZINC000805455668 1046897218 /nfs/dbraw/zinc/89/72/18/1046897218.db2.gz FTLTYCUUKCYDHC-UHFFFAOYSA-N -1 3 349.415 4.260 20 0 EIADHM Cc1cc(C(=O)Nc2cccc([O-])c2F)cc(C)c1OC(F)F ZINC000128643044 1047001989 /nfs/dbraw/zinc/00/19/89/1047001989.db2.gz BHLDRYZSWUKYOC-UHFFFAOYSA-N -1 3 325.286 4.002 20 0 EIADHM CC[C@H](OC(=O)CCCc1ccc([O-])c(F)c1)C(=O)c1ccccc1 ZINC000787847376 1047057751 /nfs/dbraw/zinc/05/77/51/1047057751.db2.gz DRBUPVWQGRCLHH-SFHVURJKSA-N -1 3 344.382 4.059 20 0 EIADHM CCOc1cccc([C@@H](C)NC(=O)c2cc3sccc3c([O-])c2)c1 ZINC000788294361 1047150835 /nfs/dbraw/zinc/15/08/35/1047150835.db2.gz WICDQFLNEOMUGW-GFCCVEGCSA-N -1 3 341.432 4.497 20 0 EIADHM CC[C@@H](NC(=O)c1cc2sccc2c([O-])c1)c1ccc(OC)cc1 ZINC000788267074 1047155063 /nfs/dbraw/zinc/15/50/63/1047155063.db2.gz RYVHBOJKYYPCGF-MRXNPFEDSA-N -1 3 341.432 4.497 20 0 EIADHM CN(C(=O)c1cc2sccc2c([O-])c1)[C@@H]1CCc2ccccc2C1 ZINC000788299329 1047155301 /nfs/dbraw/zinc/15/53/01/1047155301.db2.gz RTYQTWQKNNYBIH-MRXNPFEDSA-N -1 3 337.444 4.236 20 0 EIADHM CN(CCc1ccc(F)cc1)C(=O)c1cc2sccc2c([O-])c1 ZINC000788290834 1047159797 /nfs/dbraw/zinc/15/97/97/1047159797.db2.gz OWPPUOIIGFNWTN-UHFFFAOYSA-N -1 3 329.396 4.061 20 0 EIADHM C[C@H](Cc1ccccc1F)NC(=O)c1cc2sccc2c([O-])c1 ZINC000788290517 1047160397 /nfs/dbraw/zinc/16/03/97/1047160397.db2.gz NYLQXALMLSOFOZ-LLVKDONJSA-N -1 3 329.396 4.107 20 0 EIADHM Cc1ccc(Cl)cc1S(=O)(=O)[N-]c1ccc(Cl)cc1F ZINC000031665911 1047232506 /nfs/dbraw/zinc/23/25/06/1047232506.db2.gz ZHCHIRPPNFEUCF-UHFFFAOYSA-N -1 3 334.199 4.242 20 0 EIADHM O=C(CCc1cccc(OC2CCCC2)c1)Nc1cccc([O-])c1F ZINC000129131506 1047309334 /nfs/dbraw/zinc/30/93/34/1047309334.db2.gz NYDXEAWPOAJVSW-UHFFFAOYSA-N -1 3 343.398 4.424 20 0 EIADHM O=C(Nc1ccc([O-])c(-c2nc3ccccc3s2)c1)c1ccncc1 ZINC000129493749 1047405204 /nfs/dbraw/zinc/40/52/04/1047405204.db2.gz IZWYRRMQSXJWAI-UHFFFAOYSA-N -1 3 347.399 4.316 20 0 EIADHM O=C(Nc1cccc(-c2ccc(Cl)c(Cl)c2)c1)c1cnn[n-]1 ZINC000918367215 1047424529 /nfs/dbraw/zinc/42/45/29/1047424529.db2.gz UKIFWXICIBOTKV-UHFFFAOYSA-N -1 3 333.178 4.031 20 0 EIADHM O=C(Nc1cccc(-c2ccc(Cl)c(Cl)c2)c1)c1c[n-]nn1 ZINC000918367215 1047424533 /nfs/dbraw/zinc/42/45/33/1047424533.db2.gz UKIFWXICIBOTKV-UHFFFAOYSA-N -1 3 333.178 4.031 20 0 EIADHM O=C(Nc1cccc(-c2ccc(Cl)c(Cl)c2)c1)c1cn[n-]n1 ZINC000918367215 1047424537 /nfs/dbraw/zinc/42/45/37/1047424537.db2.gz UKIFWXICIBOTKV-UHFFFAOYSA-N -1 3 333.178 4.031 20 0 EIADHM CN(C(=O)c1c[n-]c2ccccc2c1=O)c1ccc(C(C)(C)C)cc1 ZINC000918684254 1047581655 /nfs/dbraw/zinc/58/16/55/1047581655.db2.gz AYYCZBMUUQSNRS-UHFFFAOYSA-N -1 3 334.419 4.102 20 0 EIADHM C[C@@H]1C[C@@H](c2ccc(F)cc2)CN1C(=O)c1cc([O-])ccc1Cl ZINC000556266312 1047644981 /nfs/dbraw/zinc/64/49/81/1047644981.db2.gz LFWLLEKFFDDUJN-DGCLKSJQSA-N -1 3 333.790 4.203 20 0 EIADHM O=C([N-]c1nc(Cc2ccccc2)ns1)c1cc2ccccc2o1 ZINC000107197665 1047713173 /nfs/dbraw/zinc/71/31/73/1047713173.db2.gz MTVCPAVRSHYXII-UHFFFAOYSA-N -1 3 335.388 4.127 20 0 EIADHM CC(C)c1cccc(S(=O)(=O)[N-]c2ccc(OC(F)F)cc2)c1 ZINC000460414899 1047773116 /nfs/dbraw/zinc/77/31/16/1047773116.db2.gz YWNHHDLKHMHUAH-UHFFFAOYSA-N -1 3 341.379 4.212 20 0 EIADHM O=C(Nc1cc(Br)ccc1[O-])[C@@H](c1ccccc1)C1CC1 ZINC000498648893 1047802827 /nfs/dbraw/zinc/80/28/27/1047802827.db2.gz DIQQXCPIGAPZCG-INIZCTEOSA-N -1 3 346.224 4.287 20 0 EIADHM O=C(c1cc([O-])ccc1Cl)N1CCC[C@H]1/C=C\c1ccccc1 ZINC000498709838 1047818750 /nfs/dbraw/zinc/81/87/50/1047818750.db2.gz CJSJUPLEMRTMIV-CDNLZTBQSA-N -1 3 327.811 4.364 20 0 EIADHM Cc1cc(C)n(-c2ccc(NC(=O)c3cc([O-])ccc3Cl)cc2)n1 ZINC000814267480 1047914696 /nfs/dbraw/zinc/91/46/96/1047914696.db2.gz IMCBIYYLXUPSPP-UHFFFAOYSA-N -1 3 341.798 4.100 20 0 EIADHM CC(=O)c1cccc(NC(=O)c2cc3c(s2)CC[C@@H](C)C3)c1[O-] ZINC000556893078 1048119775 /nfs/dbraw/zinc/11/97/75/1048119775.db2.gz QZRUOSYDVPBTRJ-SNVBAGLBSA-N -1 3 329.421 4.033 20 0 EIADHM O=C(Nc1ccc2c(Cl)cccc2n1)c1cc([O-])ccc1Cl ZINC000556932108 1048241431 /nfs/dbraw/zinc/24/14/31/1048241431.db2.gz OUBRIORQOWZJSN-UHFFFAOYSA-N -1 3 333.174 4.500 20 0 EIADHM CC(F)(F)C(=O)[N-][C@H](c1ccc(F)cc1)c1ccccc1Cl ZINC000815047398 1048303808 /nfs/dbraw/zinc/30/38/08/1048303808.db2.gz FWYYHUYPNSBBEK-CQSZACIVSA-N -1 3 327.733 4.340 20 0 EIADHM Cc1nc(C2CCC2)sc1CC(=O)Nc1ccc(Cl)cc1[O-] ZINC001138014986 1048536903 /nfs/dbraw/zinc/53/69/03/1048536903.db2.gz LQOKSDCCHUGSFD-UHFFFAOYSA-N -1 3 336.844 4.259 20 0 EIADHM O=C([N-]c1nnc(-c2ccc(C(F)(F)F)cc2)s1)c1ccco1 ZINC001131988968 1048586155 /nfs/dbraw/zinc/58/61/55/1048586155.db2.gz UIBMFFUPIJWMOZ-UHFFFAOYSA-N -1 3 339.298 4.069 20 0 EIADHM CCCC(C)=CC(=O)Nc1cccc(-c2nc(CC)cc(=O)[n-]2)c1 ZINC000920223043 1048598585 /nfs/dbraw/zinc/59/85/85/1048598585.db2.gz ZDXYCPNTYQASJM-RAXLEYEMSA-N -1 3 325.412 4.097 20 0 EIADHM Cc1sc2[n-]c([C@H](C)OC(=O)[C@H]3CC[C@H](C)CC3)nc(=O)c2c1C ZINC000845422296 1048662980 /nfs/dbraw/zinc/66/29/80/1048662980.db2.gz XWGATUAWDDPEOZ-GAFUQQFSSA-N -1 3 348.468 4.444 20 0 EIADHM Cc1ccc([C@H](C)C(=O)Nc2cc(Br)ccc2[O-])cc1 ZINC001144454521 1048689673 /nfs/dbraw/zinc/68/96/73/1048689673.db2.gz YEVUXNKTZWBLRV-NSHDSACASA-N -1 3 334.213 4.205 20 0 EIADHM Cc1ncc(C(=O)[N-]c2nc(Sc3ccc(C)cc3)ns2)s1 ZINC000075178607 1048694739 /nfs/dbraw/zinc/69/47/39/1048694739.db2.gz RKMAMSFTXUQXTJ-UHFFFAOYSA-N -1 3 348.478 4.015 20 0 EIADHM COc1ccc2[nH]c(NC(=O)c3cc([O-])c4ccccc4c3)cc2c1 ZINC000816323771 1048769255 /nfs/dbraw/zinc/76/92/55/1048769255.db2.gz KNFIIPGLSODFMP-UHFFFAOYSA-N -1 3 332.359 4.288 20 0 EIADHM C[C@H]1CN(Cc2cc(F)c([O-])cc2F)CC[C@@]1(C)c1cccc(O)c1 ZINC001144657749 1048778122 /nfs/dbraw/zinc/77/81/22/1048778122.db2.gz GPDJYBVXPSGVGY-RNODOKPDSA-N -1 3 347.405 4.176 20 0 EIADHM O=C([N-]c1nc(C2CCC2)cs1)c1snc(Cl)c1Cl ZINC000846013688 1048783636 /nfs/dbraw/zinc/78/36/36/1048783636.db2.gz LOYRWRBDCFSYLK-UHFFFAOYSA-N -1 3 334.253 4.426 20 0 EIADHM O=C(NCc1cccs1)c1cc(Oc2ccccc2)ccc1[O-] ZINC001135554797 1048791265 /nfs/dbraw/zinc/79/12/65/1048791265.db2.gz XMMAFBNLMFMSIN-UHFFFAOYSA-N -1 3 325.389 4.176 20 0 EIADHM O=C(OCc1cccnc1Cl)c1cc2cc(Cl)sc2[n-]1 ZINC000810561857 1048813165 /nfs/dbraw/zinc/81/31/65/1048813165.db2.gz AGEATZFKIAFLMF-UHFFFAOYSA-N -1 3 327.192 4.288 20 0 EIADHM CC(C)(CC(=O)Nc1cc(Br)ccc1[O-])c1ccccc1 ZINC001144731020 1048829685 /nfs/dbraw/zinc/82/96/85/1048829685.db2.gz IVOJFODDTWIGEA-UHFFFAOYSA-N -1 3 348.240 4.461 20 0 EIADHM O=C([O-])[C@@H](c1cccc(Cl)c1Cl)N1CCC2(CCCC2)C1 ZINC000846245298 1048844553 /nfs/dbraw/zinc/84/45/53/1048844553.db2.gz UEYXNVWBKNIEEO-CQSZACIVSA-N -1 3 328.239 4.385 20 0 EIADHM O=C([O-])[C@@H](c1ccc(Cl)cc1Cl)N1CCC2(CCCC2)C1 ZINC000846245627 1048848647 /nfs/dbraw/zinc/84/86/47/1048848647.db2.gz ZOVHAVJBWANHCM-CQSZACIVSA-N -1 3 328.239 4.385 20 0 EIADHM O=C([N-]c1nc2ccccc2s1)c1nc(Cl)sc1Cl ZINC000816831664 1048870679 /nfs/dbraw/zinc/87/06/79/1048870679.db2.gz BTUHZXISTYZDQV-UHFFFAOYSA-N -1 3 330.221 4.312 20 0 EIADHM CCO[C@@H](C(=O)Nc1ccc([O-])c(C(F)(F)F)c1)c1ccccc1 ZINC000134123506 1048885596 /nfs/dbraw/zinc/88/55/96/1048885596.db2.gz DPJHIZTXIAVWEZ-OAHLLOKOSA-N -1 3 339.313 4.127 20 0 EIADHM CC(C)c1ccc(C(=O)NCCCCOc2ccccc2)c([O-])c1 ZINC001135788102 1048886719 /nfs/dbraw/zinc/88/67/19/1048886719.db2.gz WVSWVXGLBAJLOE-UHFFFAOYSA-N -1 3 327.424 4.105 20 0 EIADHM C[C@@H](OC(=O)c1cc2cc(Cl)sc2[n-]1)c1ccc(N(C)C)cn1 ZINC000810970452 1048907011 /nfs/dbraw/zinc/90/70/11/1048907011.db2.gz KIUXRIWBHGWQBL-SECBINFHSA-N -1 3 349.843 4.262 20 0 EIADHM CC[C@@H](OCCNC(=O)c1cc(SC)ccc1[O-])c1ccccc1 ZINC001144955958 1048930889 /nfs/dbraw/zinc/93/08/89/1048930889.db2.gz LGUXYXULTPFEKH-GOSISDBHSA-N -1 3 345.464 4.012 20 0 EIADHM O=C([N-]OCCC1CC1)[C@H]1CC=CC[C@@H]1c1nc2ccccc2s1 ZINC000817388532 1048966785 /nfs/dbraw/zinc/96/67/85/1048966785.db2.gz YMZUXNMYJKHLNU-GJZGRUSLSA-N -1 3 342.464 4.194 20 0 EIADHM Cc1c([N-]C(=O)c2cc(F)c(Cl)cc2F)noc1C(C)(C)C ZINC001132674270 1048981829 /nfs/dbraw/zinc/98/18/29/1048981829.db2.gz CXVCAVBUZRQTLJ-UHFFFAOYSA-N -1 3 328.746 4.464 20 0 EIADHM CSc1ccc([O-])c(C(=O)NCCCO[C@H](C)c2ccccc2)c1 ZINC001135954399 1049021218 /nfs/dbraw/zinc/02/12/18/1049021218.db2.gz SRPHPIOKNBRQBN-CQSZACIVSA-N -1 3 345.464 4.012 20 0 EIADHM CC(C)c1ncc(C(=O)[N-]c2nnc(C3CCCCC3)s2)s1 ZINC000772973625 1049029787 /nfs/dbraw/zinc/02/97/87/1049029787.db2.gz AWKDPLSQKRODPR-UHFFFAOYSA-N -1 3 336.486 4.418 20 0 EIADHM Cc1ccc([O-])c(C(=O)Nc2ccc(-c3cn4ccccc4n3)cc2)c1 ZINC001136007592 1049036741 /nfs/dbraw/zinc/03/67/41/1049036741.db2.gz HKVBNRBVKJODDT-UHFFFAOYSA-N -1 3 343.386 4.268 20 0 EIADHM CC(C)c1noc([C@@H](C)OC(=O)c2cc3cc(Cl)sc3[n-]2)n1 ZINC000811394650 1049051384 /nfs/dbraw/zinc/05/13/84/1049051384.db2.gz WXVOMKBJKOGTSL-SSDOTTSWSA-N -1 3 339.804 4.307 20 0 EIADHM O=C([N-]c1cc(-c2ccc(Cl)s2)on1)c1cc(C2CC2)on1 ZINC001146917370 1049074657 /nfs/dbraw/zinc/07/46/57/1049074657.db2.gz GXUBCUIXXKGQRQ-UHFFFAOYSA-N -1 3 335.772 4.174 20 0 EIADHM CCc1ccc([O-])c(C(=O)Nc2ccccc2OC(F)(F)F)c1 ZINC001136106509 1049093508 /nfs/dbraw/zinc/09/35/08/1049093508.db2.gz LUGNRIOHTHTFIV-UHFFFAOYSA-N -1 3 325.286 4.106 20 0 EIADHM Cc1oc(-c2ccccc2)nc1C(=O)Nc1cc([O-])cc(Cl)c1 ZINC001147319063 1049134334 /nfs/dbraw/zinc/13/43/34/1049134334.db2.gz HWICWWCLRUWUIL-UHFFFAOYSA-N -1 3 328.755 4.261 20 0 EIADHM O=c1ccnc(C=Cc2cc(C(F)(F)F)ccc2Br)[n-]1 ZINC000811691457 1049226129 /nfs/dbraw/zinc/22/61/29/1049226129.db2.gz MYFMVMASTLHTFT-RJRFIUFISA-N -1 3 345.118 4.134 20 0 EIADHM O=C([N-]c1noc2cnccc21)c1sc2cc(F)ccc2c1Cl ZINC001147984242 1049248108 /nfs/dbraw/zinc/24/81/08/1049248108.db2.gz RZLUSRWXZJIOIM-UHFFFAOYSA-N -1 3 347.758 4.482 20 0 EIADHM Cc1ccc(C(=O)N[C@@H](C)c2nc(-c3ccccc3)cs2)c([O-])c1 ZINC000078554395 1049250432 /nfs/dbraw/zinc/25/04/32/1049250432.db2.gz LUEPESPHXAFNSG-ZDUSSCGKSA-N -1 3 338.432 4.315 20 0 EIADHM C[C@H]1CCC[C@H](NC(=O)c2cc(CCc3ccccc3)ccc2[O-])C1 ZINC001136204254 1049293530 /nfs/dbraw/zinc/29/35/30/1049293530.db2.gz ISLMRSDLNDAYDL-LPHOPBHVSA-N -1 3 337.463 4.486 20 0 EIADHM Cc1ccc(C(=O)Nc2cccc(CCc3ccccn3)c2)c([O-])c1 ZINC001148493473 1049326908 /nfs/dbraw/zinc/32/69/08/1049326908.db2.gz JDCSIBZZNRVIIU-UHFFFAOYSA-N -1 3 332.403 4.133 20 0 EIADHM CC(C)CC1(NC(=O)c2cc(Oc3ccccc3)ccc2[O-])CC1 ZINC001148505343 1049328513 /nfs/dbraw/zinc/32/85/13/1049328513.db2.gz FHEMZUAVLHANIW-UHFFFAOYSA-N -1 3 325.408 4.493 20 0 EIADHM CCN(CC)c1ccc(NC(=O)c2ccc([O-])c(C(C)=O)c2)c(C)c1 ZINC001148664688 1049357415 /nfs/dbraw/zinc/35/74/15/1049357415.db2.gz RMWKAHYJYPWZND-UHFFFAOYSA-N -1 3 340.423 4.002 20 0 EIADHM CCO[C@@H]1C[C@H](N(C)C(=O)c2cc([O-])ccc2Cl)C1(CC)CC ZINC001148987494 1049407374 /nfs/dbraw/zinc/40/73/74/1049407374.db2.gz FJZVNOLOBHJYRS-JKSUJKDBSA-N -1 3 339.863 4.101 20 0 EIADHM CCN(C(=O)c1ccc(C(C)C)cc1[O-])[C@@H](C)[C@H](O)c1ccccc1 ZINC000820108206 1049433036 /nfs/dbraw/zinc/43/30/36/1049433036.db2.gz LWVGKEMPVLUZKE-YWZLYKJASA-N -1 3 341.451 4.100 20 0 EIADHM COc1ccccc1-c1cc(C(=O)[N-]c2cscc2Cl)no1 ZINC001133290205 1049464939 /nfs/dbraw/zinc/46/49/39/1049464939.db2.gz ULJIXBNKQBUKDX-UHFFFAOYSA-N -1 3 334.784 4.317 20 0 EIADHM O=C(Nc1[nH][n-]c2cc(=O)ccc1-2)c1sc2ccccc2c1Cl ZINC000820219205 1049465535 /nfs/dbraw/zinc/46/55/35/1049465535.db2.gz SUMOOVTULBFJAR-UHFFFAOYSA-N -1 3 343.795 4.389 20 0 EIADHM O=C(CCC(=O)c1ccc(-c2ccccc2)cc1)[N-]OC/C=C/Cl ZINC000812406115 1049469612 /nfs/dbraw/zinc/46/96/12/1049469612.db2.gz NAZAXUXGKJLZGZ-YIXHJXPBSA-N -1 3 343.810 4.117 20 0 EIADHM CC[C@@H]1CCC[C@@]1(C)C(=O)Nc1ccc(Br)cc1[O-] ZINC001441343875 1049632532 /nfs/dbraw/zinc/63/25/32/1049632532.db2.gz RTSYCCOMHYGPQB-MEBBXXQBSA-N -1 3 326.234 4.310 20 0 EIADHM CN(Cc1ccc(Br)o1)Cc1cccc(Cl)c1[O-] ZINC000179681682 1049718693 /nfs/dbraw/zinc/71/86/93/1049718693.db2.gz OBBIVIABSQLIDN-UHFFFAOYSA-N -1 3 330.609 4.033 20 0 EIADHM CCOc1ccc2nc(NC(=O)c3cccc(CC)c3[O-])sc2c1 ZINC001136517748 1049714838 /nfs/dbraw/zinc/71/48/38/1049714838.db2.gz LYLYZWKMDNNTJU-UHFFFAOYSA-N -1 3 342.420 4.215 20 0 EIADHM [O-]c1ccc(CNc2cccc(Cl)c2OCC(F)F)cc1F ZINC001206077925 1049738841 /nfs/dbraw/zinc/73/88/41/1049738841.db2.gz PXIRUFLWMCMXKP-UHFFFAOYSA-N -1 3 331.721 4.441 20 0 EIADHM O=C([N-]c1scnc1-c1ccccc1)c1conc1C(F)(F)F ZINC001136620341 1049788468 /nfs/dbraw/zinc/78/84/68/1049788468.db2.gz ITMGAZZVDKXGEW-UHFFFAOYSA-N -1 3 339.298 4.069 20 0 EIADHM CC(C)C[C@@H]([N-]S(=O)(=O)c1cc(F)ccc1F)c1cccs1 ZINC000616021186 1049830475 /nfs/dbraw/zinc/83/04/75/1049830475.db2.gz AUDNXRRVEYVEFQ-CYBMUJFWSA-N -1 3 345.436 4.092 20 0 EIADHM CC(C)Oc1c(F)cc(F)c(Nc2ncc(Cl)cc2[O-])c1F ZINC001212643376 1049861468 /nfs/dbraw/zinc/86/14/68/1049861468.db2.gz ZSTWUOHQTZXINB-UHFFFAOYSA-N -1 3 332.709 4.389 20 0 EIADHM CN(CCC(F)(F)F)C(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000138632681 1049869949 /nfs/dbraw/zinc/86/99/49/1049869949.db2.gz VGIFZULTMSAFKH-UHFFFAOYSA-N -1 3 337.341 4.007 20 0 EIADHM CCC[C@H]1CCCCN1Cc1ccc(C(=O)[O-])c(Br)c1 ZINC000901451030 1049918663 /nfs/dbraw/zinc/91/86/63/1049918663.db2.gz HMZXGYIMVLFMQF-ZDUSSCGKSA-N -1 3 340.261 4.302 20 0 EIADHM Cc1ccc2oc(C(=O)Nc3ccc(Br)cc3[O-])cc2c1 ZINC000617015953 1049945772 /nfs/dbraw/zinc/94/57/72/1049945772.db2.gz VMPLELXTLBQZNM-UHFFFAOYSA-N -1 3 346.180 4.462 20 0 EIADHM Cc1nc([C@H](C)N2CC[C@@](C)(C(=O)[O-])C2)oc1-c1ccc(Cl)cc1 ZINC000263571520 1049995728 /nfs/dbraw/zinc/99/57/28/1049995728.db2.gz JMOUNCCPEQSCDO-KPZWWZAWSA-N -1 3 348.830 4.161 20 0 EIADHM CCc1onc(C)c1[N-]C(=O)c1csc(-c2ccc(C)cc2)n1 ZINC000089396281 1050117250 /nfs/dbraw/zinc/11/72/50/1050117250.db2.gz KCQRLYSMFQQFSK-UHFFFAOYSA-N -1 3 327.409 4.230 20 0 EIADHM Cc1c(F)cccc1S(=O)(=O)[N-]c1c(F)cccc1C(C)C ZINC001185837357 1050169081 /nfs/dbraw/zinc/16/90/81/1050169081.db2.gz XZULRNYTBQRBGK-UHFFFAOYSA-N -1 3 325.380 4.197 20 0 EIADHM CC(C)(C)C(=O)Nc1ccc(C(=O)Nc2cc([O-])cc(Cl)c2)cc1 ZINC001185839522 1050171010 /nfs/dbraw/zinc/17/10/10/1050171010.db2.gz OPOMEOQZPMPGLG-UHFFFAOYSA-N -1 3 346.814 4.283 20 0 EIADHM O=C(/C=C/c1cccc(OCc2ccccc2)c1)Nc1cncc([O-])c1 ZINC001186846716 1050421065 /nfs/dbraw/zinc/42/10/65/1050421065.db2.gz NRRZHUNCAYTUMA-MDZDMXLPSA-N -1 3 346.386 4.018 20 0 EIADHM CC[C@@H]1CCC[C@H]([N-]S(=O)(=O)c2cccc(Cl)c2Cl)C1 ZINC001187137851 1050490488 /nfs/dbraw/zinc/49/04/88/1050490488.db2.gz KIPVWYMCGLQMNT-MNOVXSKESA-N -1 3 336.284 4.241 20 0 EIADHM C[C@H]1CC([N-]S(=O)(=O)c2c(Cl)cccc2Cl)C[C@H](C)C1 ZINC001187164035 1050499080 /nfs/dbraw/zinc/49/90/80/1050499080.db2.gz KEQSWPDFTXLIRV-NXEZZACHSA-N -1 3 336.284 4.096 20 0 EIADHM CO[C@](C)(C(=O)Nc1ccc(F)c([O-])c1)c1cccc2ccccc21 ZINC001178679615 1050528819 /nfs/dbraw/zinc/52/88/19/1050528819.db2.gz CBRCBEJHUKFYSO-FQEVSTJZSA-N -1 3 339.366 4.185 20 0 EIADHM CCc1ccccc1NC(=O)Nc1ccc([O-])c(Br)c1 ZINC001187636825 1050585358 /nfs/dbraw/zinc/58/53/58/1050585358.db2.gz RNZTYXMRPRBAIE-UHFFFAOYSA-N -1 3 335.201 4.361 20 0 EIADHM COc1ccc(Nc2cc(Br)cc(F)c2[O-])cc1F ZINC001173864918 1050592289 /nfs/dbraw/zinc/59/22/89/1050592289.db2.gz KKICELXMRHPIDM-UHFFFAOYSA-N -1 3 330.128 4.185 20 0 EIADHM Cc1cccc([O-])c1C(=O)Nc1ccc2c(c1)Cc1cc(N)ccc1-2 ZINC001188649423 1050812974 /nfs/dbraw/zinc/81/29/74/1050812974.db2.gz ZTMYRBBAVKZLKC-UHFFFAOYSA-N -1 3 330.387 4.106 20 0 EIADHM [O-]c1cccc(Nc2cccc(-n3cccn3)c2)c1Br ZINC001174301026 1050869710 /nfs/dbraw/zinc/86/97/10/1050869710.db2.gz KJTOAMSDPVRAEH-UHFFFAOYSA-N -1 3 330.185 4.084 20 0 EIADHM O=C(Nc1cccc(Cl)c1Cl)Nc1ncc([O-])cc1Cl ZINC001189201614 1050925547 /nfs/dbraw/zinc/92/55/47/1050925547.db2.gz BAJCMJGZEPFWPX-UHFFFAOYSA-N -1 3 332.574 4.391 20 0 EIADHM Cc1cc(F)c([N-]S(=O)(=O)Cc2cccc(F)c2F)cc1Cl ZINC001189455572 1050996429 /nfs/dbraw/zinc/99/64/29/1050996429.db2.gz LJRHPKHQGJLOGA-UHFFFAOYSA-N -1 3 349.761 4.008 20 0 EIADHM Cc1ccc2cccc([N-]S(=O)(=O)Cc3cc(F)ccc3F)c2c1 ZINC001189691287 1051038428 /nfs/dbraw/zinc/03/84/28/1051038428.db2.gz RXSCCOPGCOMHAP-UHFFFAOYSA-N -1 3 347.386 4.368 20 0 EIADHM O=C(Nc1ccc(F)c([O-])c1)NC1c2ccccc2-c2ccccc21 ZINC001190039089 1051105835 /nfs/dbraw/zinc/10/58/35/1051105835.db2.gz YYKREQXGQHZKSL-UHFFFAOYSA-N -1 3 334.350 4.423 20 0 EIADHM Cc1c2ccccc2oc1[C@H](C)NCc1cc(=O)oc2cc([O-])ccc12 ZINC000183606385 1051183519 /nfs/dbraw/zinc/18/35/19/1051183519.db2.gz GKOXGMKVZLLIRE-ZDUSSCGKSA-N -1 3 349.386 4.404 20 0 EIADHM CCOc1cc(Nc2cccc([O-])c2Br)ccc1F ZINC001175057783 1051308448 /nfs/dbraw/zinc/30/84/48/1051308448.db2.gz RSIJUQMNDZVHNA-UHFFFAOYSA-N -1 3 326.165 4.436 20 0 EIADHM O=C(N[C@H](c1ccccc1)C1CCCC1)c1ccc(=O)[n-]c1Cl ZINC001190918467 1051311834 /nfs/dbraw/zinc/31/18/34/1051311834.db2.gz RJGLJLQIBGFEOM-MRXNPFEDSA-N -1 3 330.815 4.102 20 0 EIADHM [O-]c1cc(F)c(Nc2ccc(OCc3ccncc3)cc2)c(F)c1 ZINC001175099425 1051345690 /nfs/dbraw/zinc/34/56/90/1051345690.db2.gz GJUFNQIUVPDCJJ-UHFFFAOYSA-N -1 3 328.318 4.388 20 0 EIADHM CC(=O)N1CC(C)(C)c2ccc(Nc3c(F)cc([O-])cc3F)cc21 ZINC001175100471 1051348078 /nfs/dbraw/zinc/34/80/78/1051348078.db2.gz VCOWSILZPNPWOH-UHFFFAOYSA-N -1 3 332.350 4.058 20 0 EIADHM COc1cc(C(=O)[N-]c2nc(-c3ccccc3)c(C(C)C)s2)on1 ZINC000155003566 1051359710 /nfs/dbraw/zinc/35/97/10/1051359710.db2.gz JJIWBXHOUPXMCI-UHFFFAOYSA-N -1 3 343.408 4.182 20 0 EIADHM COC(=O)c1ccc([O-])cc1NC(=O)Nc1ccc(C(C)(C)C)cc1 ZINC001191151737 1051364850 /nfs/dbraw/zinc/36/48/50/1051364850.db2.gz OOIMWVAQAJRBAE-UHFFFAOYSA-N -1 3 342.395 4.120 20 0 EIADHM C[C@H](C(=O)Nc1ncccc1[O-])c1ccc(-c2ccccc2)c(F)c1 ZINC001182249176 1051440773 /nfs/dbraw/zinc/44/07/73/1051440773.db2.gz QUVROQPSOAAEOH-ZDUSSCGKSA-N -1 3 336.366 4.336 20 0 EIADHM C/C(=C\C(C)(C)C)C(=O)Oc1cccc(-c2nc(C)cc(=O)[n-]2)c1 ZINC000774104688 1051454400 /nfs/dbraw/zinc/45/44/00/1051454400.db2.gz JVEZUUDHPLDERH-VAWYXSNFSA-N -1 3 326.396 4.055 20 0 EIADHM CCOc1ccc(Nc2cccc([O-])c2Br)c(F)c1 ZINC001175248480 1051473063 /nfs/dbraw/zinc/47/30/63/1051473063.db2.gz BCTUSZPRTMVSOG-UHFFFAOYSA-N -1 3 326.165 4.436 20 0 EIADHM C[C@H]([N-]S(=O)(=O)c1cccc(Cl)c1Cl)C1CCCCC1 ZINC001191615719 1051491785 /nfs/dbraw/zinc/49/17/85/1051491785.db2.gz WPPOVTFXXWMEBJ-JTQLQIEISA-N -1 3 336.284 4.241 20 0 EIADHM COc1c(Br)cccc1Nc1c(F)ccc([O-])c1F ZINC001175268171 1051504231 /nfs/dbraw/zinc/50/42/31/1051504231.db2.gz MDSSZFHCQJDBMZ-UHFFFAOYSA-N -1 3 330.128 4.185 20 0 EIADHM CCOC(=O)Cc1ccc(Cl)c(Nc2c(F)ccc([O-])c2F)c1 ZINC001175271596 1051509308 /nfs/dbraw/zinc/50/93/08/1051509308.db2.gz WWRMGRMLWXJPPM-UHFFFAOYSA-N -1 3 341.741 4.173 20 0 EIADHM COCc1ccc(Br)c(Nc2c(F)ccc([O-])c2F)c1 ZINC001175271068 1051510303 /nfs/dbraw/zinc/51/03/03/1051510303.db2.gz QMIDPZBJYSQNFZ-UHFFFAOYSA-N -1 3 344.155 4.323 20 0 EIADHM Cc1cc(F)c([N-]S(=O)(=O)Cc2ccc(Cl)cc2F)cc1F ZINC001191903179 1051582855 /nfs/dbraw/zinc/58/28/55/1051582855.db2.gz FFNWCGQOUDSDDF-UHFFFAOYSA-N -1 3 349.761 4.008 20 0 EIADHM Fc1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1OC1CCCC1 ZINC001175431810 1051587046 /nfs/dbraw/zinc/58/70/46/1051587046.db2.gz OGHOPEPAPMSEBY-UHFFFAOYSA-N -1 3 339.374 4.071 20 0 EIADHM CCCCCCNC(=O)Nc1ccc(C(=O)OC(C)(C)C)cc1[O-] ZINC001191979039 1051606552 /nfs/dbraw/zinc/60/65/52/1051606552.db2.gz JFGFGCCHUKPCEM-UHFFFAOYSA-N -1 3 336.432 4.049 20 0 EIADHM C[C@H]1CN(CCSc2cc(Cl)ccc2Cl)CC[C@@H]1C(=O)[O-] ZINC000385874445 1051607010 /nfs/dbraw/zinc/60/70/10/1051607010.db2.gz OBXASROZKKMASS-JQWIXIFHSA-N -1 3 348.295 4.128 20 0 EIADHM CCCOc1ccc(NC(=O)c2cccc3n[n-]nc32)cc1C(C)C ZINC001175641743 1051690078 /nfs/dbraw/zinc/69/00/78/1051690078.db2.gz OSDKKGSXTYTACX-UHFFFAOYSA-N -1 3 338.411 4.122 20 0 EIADHM COc1ccccc1CCN(C)C(=O)c1ccc(C(C)(C)C)cc1[O-] ZINC001192322902 1051691799 /nfs/dbraw/zinc/69/17/99/1051691799.db2.gz RRKRKKLIBDSCQG-UHFFFAOYSA-N -1 3 341.451 4.013 20 0 EIADHM C/C(=C\c1c(Cl)cccc1Cl)C(=O)[N-]OCc1cccnc1 ZINC000184102251 1051830291 /nfs/dbraw/zinc/83/02/91/1051830291.db2.gz FNYBRPPBIJFSHW-DHZHZOJOSA-N -1 3 337.206 4.040 20 0 EIADHM Cc1c(C(=O)Nc2nnc(-c3cc4ccccc4o3)[n-]2)ccn1C(C)C ZINC001183367745 1051836332 /nfs/dbraw/zinc/83/63/32/1051836332.db2.gz JYYRAFQMPDKLKD-UHFFFAOYSA-N -1 3 349.394 4.161 20 0 EIADHM Cc1c(C(=O)Nc2n[n-]c(-c3cc4ccccc4o3)n2)ccn1C(C)C ZINC001183367745 1051836335 /nfs/dbraw/zinc/83/63/35/1051836335.db2.gz JYYRAFQMPDKLKD-UHFFFAOYSA-N -1 3 349.394 4.161 20 0 EIADHM COc1cc(Nc2cc(Br)cc(F)c2[O-])c(F)cc1F ZINC001176110800 1051915739 /nfs/dbraw/zinc/91/57/39/1051915739.db2.gz FENPLNFWSKIOTF-UHFFFAOYSA-N -1 3 348.118 4.324 20 0 EIADHM CN(C)C(=O)c1cc(Nc2cccc([O-])c2Cl)ccc1Cl ZINC001176153017 1051943556 /nfs/dbraw/zinc/94/35/56/1051943556.db2.gz DQOHONJIQXPGIO-UHFFFAOYSA-N -1 3 325.195 4.144 20 0 EIADHM C/C=C\C[C@@H]1CCCN(C(=O)c2ccc(OCCCC)cc2[O-])C1 ZINC001184099592 1051949135 /nfs/dbraw/zinc/94/91/35/1051949135.db2.gz YIUJJIBYHWMGIJ-OICCZTGUSA-N -1 3 331.456 4.390 20 0 EIADHM Cc1cc([O-])c(NC(=O)OC2CCCCC2)cc1Br ZINC001193632798 1051957900 /nfs/dbraw/zinc/95/79/00/1051957900.db2.gz RCTFMAVVBSZDJK-UHFFFAOYSA-N -1 3 328.206 4.344 20 0 EIADHM O=C(c1ccc(F)c(Nc2cccc(Cl)c2[O-])c1)N1CCCC1 ZINC001176212075 1051957958 /nfs/dbraw/zinc/95/79/58/1051957958.db2.gz CVIUAQAQSFLNDQ-UHFFFAOYSA-N -1 3 334.778 4.164 20 0 EIADHM Cc1nc(-c2ccc(NC(=O)c3cc([O-])ccc3Cl)cc2)[nH]c1C ZINC001176218532 1051960528 /nfs/dbraw/zinc/96/05/28/1051960528.db2.gz AMVBBAZERQRPMA-UHFFFAOYSA-N -1 3 341.798 4.305 20 0 EIADHM CCN(CC)C(=O)c1cc(F)cc(Nc2ccc([O-])c(Cl)c2)c1 ZINC001176299233 1052006682 /nfs/dbraw/zinc/00/66/82/1052006682.db2.gz NMNVIHXQLWRBFI-UHFFFAOYSA-N -1 3 336.794 4.410 20 0 EIADHM COc1ccc(-c2ccccc2NC(=O)c2c(C)cc(O)cc2[O-])cc1 ZINC001193936209 1052023300 /nfs/dbraw/zinc/02/33/00/1052023300.db2.gz KQAMDFSODCMQEI-UHFFFAOYSA-N -1 3 349.386 4.334 20 0 EIADHM CC(C)(C)c1ccc(NC(=O)c2nnc3ccccc3c2[O-])cc1F ZINC001176442221 1052059742 /nfs/dbraw/zinc/05/97/42/1052059742.db2.gz ZDASUJLMRDJYAA-UHFFFAOYSA-N -1 3 339.370 4.024 20 0 EIADHM O=c1cc(Nc2cccc(OC(F)(F)F)c2)[n-]n1-c1ccccc1 ZINC001176537359 1052114449 /nfs/dbraw/zinc/11/44/49/1052114449.db2.gz GRCXRHAWHWLCAE-UHFFFAOYSA-N -1 3 335.285 4.220 20 0 EIADHM CC[C@@H](CNC(=O)c1cc([O-])cc(C(F)(F)F)c1)c1ccccc1 ZINC000622286405 1052181721 /nfs/dbraw/zinc/18/17/21/1052181721.db2.gz CYGMRDNAGBBODP-LBPRGKRZSA-N -1 3 337.341 4.335 20 0 EIADHM O=C(Nc1ccccc1OC(F)F)c1cc2c(cc1[O-])CCCC2 ZINC000622289672 1052185395 /nfs/dbraw/zinc/18/53/95/1052185395.db2.gz ADBDXVAYZXLQNB-UHFFFAOYSA-N -1 3 333.334 4.125 20 0 EIADHM Cc1cccc(C)c1S(=O)(=O)[N-]c1ccc2ncc(Cl)cc2c1 ZINC001194644357 1052185942 /nfs/dbraw/zinc/18/59/42/1052185942.db2.gz RELRPBCXCBYYCX-UHFFFAOYSA-N -1 3 346.839 4.306 20 0 EIADHM O=C(CCCOc1cccc(Cl)c1Cl)[N-]OC1CCCC1 ZINC000774864033 1052226204 /nfs/dbraw/zinc/22/62/04/1052226204.db2.gz MBFURUGOBNSPRM-UHFFFAOYSA-N -1 3 332.227 4.143 20 0 EIADHM CCc1cccc(C(=O)N(C)[C@@H](CC)Cc2ccc(C)cc2)c1[O-] ZINC000622396439 1052243739 /nfs/dbraw/zinc/24/37/39/1052243739.db2.gz KQYMTSYLXYLBHN-SFHVURJKSA-N -1 3 325.452 4.356 20 0 EIADHM CC(C)c1cnc(NC(=O)c2cc([O-])cc(C(F)(F)F)c2)s1 ZINC000622394813 1052251001 /nfs/dbraw/zinc/25/10/01/1052251001.db2.gz VWIMNQHWSOWVSN-UHFFFAOYSA-N -1 3 330.331 4.243 20 0 EIADHM CC(C)CN(C(=O)Cc1ccc([O-])c(F)c1)c1ccc(Cl)cc1 ZINC000622442002 1052262327 /nfs/dbraw/zinc/26/23/27/1052262327.db2.gz YSCXEUWRMKMTCW-UHFFFAOYSA-N -1 3 335.806 4.416 20 0 EIADHM Cc1ccc(C(=O)N2CCCC[C@H]2c2ccc(F)cc2F)c([O-])c1 ZINC000622451665 1052272581 /nfs/dbraw/zinc/27/25/81/1052272581.db2.gz OOHBPPUOXIAFSC-KRWDZBQOSA-N -1 3 331.362 4.346 20 0 EIADHM CCc1ccc(NC(=O)c2cc([O-])cc(C(F)(F)F)c2)cc1F ZINC000622460306 1052276904 /nfs/dbraw/zinc/27/69/04/1052276904.db2.gz NSHKQUVRCJNRFZ-UHFFFAOYSA-N -1 3 327.277 4.365 20 0 EIADHM COc1ccc2[nH]cc(/C=C/C(=O)Nc3cc([O-])cc(Cl)c3)c2c1 ZINC001185756328 1052293466 /nfs/dbraw/zinc/29/34/66/1052293466.db2.gz ZJNFUUADVVBVFF-GORDUTHDSA-N -1 3 342.782 4.187 20 0 EIADHM Cc1ccc(C(=O)N2CCOc3c2cccc3C(C)(C)C)c([O-])c1 ZINC000622541270 1052320128 /nfs/dbraw/zinc/32/01/28/1052320128.db2.gz IXZSKPGLFBVBNC-UHFFFAOYSA-N -1 3 325.408 4.037 20 0 EIADHM O=C(Nc1cc(F)ccc1[O-])c1cc(Cl)ccc1Br ZINC000174895425 1052577361 /nfs/dbraw/zinc/57/73/61/1052577361.db2.gz NPWCKCFMMAKLQM-UHFFFAOYSA-N -1 3 344.567 4.200 20 0 EIADHM C[C@@H](c1ccco1)N(C(=O)c1cc([O-])cc(C(F)(F)F)c1)C1CC1 ZINC000623017387 1052570441 /nfs/dbraw/zinc/57/04/41/1052570441.db2.gz OOOXUTTZRNWCNK-JTQLQIEISA-N -1 3 339.313 4.370 20 0 EIADHM CC(C)(C)c1cc2c([n-]c(COc3ccc(F)cc3)nc2=O)s1 ZINC000180973506 1052820886 /nfs/dbraw/zinc/82/08/86/1052820886.db2.gz STVUBOSWCXAURN-UHFFFAOYSA-N -1 3 332.400 4.000 20 0 EIADHM Cc1ccc([C@H](C)NCc2cc(=O)oc3cc([O-])c(Cl)cc23)s1 ZINC000794569855 1053090051 /nfs/dbraw/zinc/09/00/51/1053090051.db2.gz LQMZYWKIUPEGDB-JTQLQIEISA-N -1 3 349.839 4.373 20 0 EIADHM CC(C)c1ccc(CN2CCC[C@H](c3n[nH]c(=O)[n-]3)C2)c(C(C)C)c1 ZINC001194765135 1053100023 /nfs/dbraw/zinc/10/00/23/1053100023.db2.gz WAKYDXDSCVWLLH-KRWDZBQOSA-N -1 3 342.487 4.137 20 0 EIADHM CCc1cccc(C)c1[N-]S(=O)(=O)c1c(C)cc(OC)c(C)c1C ZINC001194864270 1053131978 /nfs/dbraw/zinc/13/19/78/1053131978.db2.gz JWOKXEAQAQMWIX-UHFFFAOYSA-N -1 3 347.480 4.292 20 0 EIADHM Cc1cc([O-])c(NC(=O)Oc2ccc(F)cc2)cc1Br ZINC001195040618 1053236947 /nfs/dbraw/zinc/23/69/47/1053236947.db2.gz QAZWAVHDBKIBJZ-UHFFFAOYSA-N -1 3 340.148 4.213 20 0 EIADHM C[C@@H]1CCC[C@@H]([C@H](CNCc2csc(C3CC3)n2)CC(=O)[O-])C1 ZINC000864534229 1053311435 /nfs/dbraw/zinc/31/14/35/1053311435.db2.gz SJGWGJNBKWZQMY-YUELXQCFSA-N -1 3 336.501 4.027 20 0 EIADHM Cc1cccc([N-]S(=O)(=O)c2ccc(C(=O)C(C)(C)C)cc2)c1F ZINC000775675388 1053506231 /nfs/dbraw/zinc/50/62/31/1053506231.db2.gz YZYCRINERRLFAH-UHFFFAOYSA-N -1 3 349.427 4.164 20 0 EIADHM CCSc1nnc([N-]C(=O)c2occc2-c2ccccc2)s1 ZINC000021282191 1053732784 /nfs/dbraw/zinc/73/27/84/1053732784.db2.gz JBVCIZMDYHFPDE-UHFFFAOYSA-N -1 3 331.422 4.162 20 0 EIADHM [O-]c1ccc(NC(=S)NCc2ccccc2Cl)cc1Cl ZINC001196827575 1053783181 /nfs/dbraw/zinc/78/31/81/1053783181.db2.gz IMGZJXSBGYVZGZ-UHFFFAOYSA-N -1 3 327.236 4.186 20 0 EIADHM CC(C)Cc1nnc([N-]C(=O)c2ccc(C(F)(F)F)s2)s1 ZINC000671664944 1053965005 /nfs/dbraw/zinc/96/50/05/1053965005.db2.gz UFVXRQFAKNDYIU-UHFFFAOYSA-N -1 3 335.376 4.069 20 0 EIADHM CC(C)(C)c1nc(CO[N-]C(=O)CCCc2ccccc2)cs1 ZINC000104053708 1054014471 /nfs/dbraw/zinc/01/44/71/1054014471.db2.gz RDPFKMDSEULLPW-UHFFFAOYSA-N -1 3 332.469 4.011 20 0 EIADHM Cc1ccc(NC(=S)Nc2ccc(Br)cc2[O-])cc1 ZINC001197923306 1054023091 /nfs/dbraw/zinc/02/30/91/1054023091.db2.gz OJCGFHADFKZCID-UHFFFAOYSA-N -1 3 337.242 4.272 20 0 EIADHM Cc1ccc(NC(=S)Nc2cc(=O)n(-c3ccccc3)[n-]2)c(C)c1 ZINC001197966645 1054039844 /nfs/dbraw/zinc/03/98/44/1054039844.db2.gz JPRMSYPRMGZGLN-UHFFFAOYSA-N -1 3 338.436 4.004 20 0 EIADHM [O-]c1cnc(NC(=S)Nc2cccc(C(F)(F)F)c2)c(Cl)c1 ZINC001198037647 1054064963 /nfs/dbraw/zinc/06/49/63/1054064963.db2.gz OUFVTRIPMCFBLA-UHFFFAOYSA-N -1 3 347.749 4.268 20 0 EIADHM COc1c(C)ccc([N-]S(=O)(=O)c2ccc(C(C)(C)C)cc2)c1C ZINC000031722668 1054077007 /nfs/dbraw/zinc/07/70/07/1054077007.db2.gz DGBOYJZQZHIDDI-UHFFFAOYSA-N -1 3 347.480 4.410 20 0 EIADHM O=C([O-])CC[C@H](NCc1ccncc1)c1ccc(Cl)c(Cl)c1 ZINC000871066330 1054152664 /nfs/dbraw/zinc/15/26/64/1054152664.db2.gz QUEXEQBIPPSRET-HNNXBMFYSA-N -1 3 339.222 4.084 20 0 EIADHM CC[C@@](C)(NC(=O)c1cc([O-])c2ccccc2c1)c1nc(C)cs1 ZINC000472217606 1054255459 /nfs/dbraw/zinc/25/54/59/1054255459.db2.gz UZXLNMLIECQCKW-LJQANCHMSA-N -1 3 340.448 4.366 20 0 EIADHM COc1ccc(N(C)C(=O)c2cc([O-])c3ccccc3c2)cc1Cl ZINC000472318606 1054274668 /nfs/dbraw/zinc/27/46/68/1054274668.db2.gz YKAJPYPAVPBLJS-UHFFFAOYSA-N -1 3 341.794 4.484 20 0 EIADHM C[C@@H](CCc1ccc(O)cc1)NC(=O)c1cc([O-])c2ccccc2c1 ZINC000472353708 1054282316 /nfs/dbraw/zinc/28/23/16/1054282316.db2.gz SHRZRCCYAAHTIR-AWEZNQCLSA-N -1 3 335.403 4.002 20 0 EIADHM O=C(Nc1ccccc1OCC(F)F)c1cc([O-])c2ccccc2c1 ZINC000472352907 1054282840 /nfs/dbraw/zinc/28/28/40/1054282840.db2.gz FTNCRROFBOPATK-UHFFFAOYSA-N -1 3 343.329 4.442 20 0 EIADHM O=S(=O)([N-]c1cc(Cl)c(F)cc1F)c1ccc2occc2c1 ZINC001198858971 1054283928 /nfs/dbraw/zinc/28/39/28/1054283928.db2.gz OARCGCMJQCNEIO-UHFFFAOYSA-N -1 3 343.738 4.165 20 0 EIADHM O=C(c1cc(=O)c2ccccc2[n-]1)N1CCCCC[C@H]1c1ccco1 ZINC000265666323 1054303728 /nfs/dbraw/zinc/30/37/28/1054303728.db2.gz YMOWHFGOPIPTSM-KRWDZBQOSA-N -1 3 336.391 4.291 20 0 EIADHM C[C@H](NCc1cccc(NC(=O)C2CCC2)c1)c1cccc([O-])c1F ZINC000872021520 1054334274 /nfs/dbraw/zinc/33/42/74/1054334274.db2.gz RNUJQAPQSYQHEH-ZDUSSCGKSA-N -1 3 342.414 4.121 20 0 EIADHM C[C@H](NCc1ccc(OC2CCCC2)nc1)c1cccc([O-])c1F ZINC000872025573 1054342403 /nfs/dbraw/zinc/34/24/03/1054342403.db2.gz PAKUENGQWWNEKL-ZDUSSCGKSA-N -1 3 330.403 4.099 20 0 EIADHM CC(C)CC(=O)Nc1cccc(CN[C@H](C)c2cccc([O-])c2F)c1 ZINC000872027626 1054343246 /nfs/dbraw/zinc/34/32/46/1054343246.db2.gz MGWFWSKXFQGJLL-CQSZACIVSA-N -1 3 344.430 4.367 20 0 EIADHM [O-]c1cccc(C(F)(F)F)c1NC(=S)NCC1CCCCC1 ZINC001199928211 1054499767 /nfs/dbraw/zinc/49/97/67/1054499767.db2.gz OJAYXSJIWVIJMF-UHFFFAOYSA-N -1 3 332.391 4.278 20 0 EIADHM CCc1ccc([C@@H](NC(=O)c2cc(=O)c3ccccc3[n-]2)C(C)C)cc1 ZINC000061225706 1054747759 /nfs/dbraw/zinc/74/77/59/1054747759.db2.gz RKQIIFIBZCJBLH-NRFANRHFSA-N -1 3 348.446 4.218 20 0 EIADHM Cc1sc2[n-]c([C@@H](C)OC(=O)[C@H]3CCCC34CC4)nc(=O)c2c1C ZINC000860177041 1054781983 /nfs/dbraw/zinc/78/19/83/1054781983.db2.gz LZKUOMXVDXEOKI-ZYHUDNBSSA-N -1 3 346.452 4.198 20 0 EIADHM CCCOc1ccc(Cl)cc1Nc1cccc(C(=O)N(C)C)c1[O-] ZINC001201445467 1054812286 /nfs/dbraw/zinc/81/22/86/1054812286.db2.gz XQBZTGUDRFEVPV-UHFFFAOYSA-N -1 3 348.830 4.280 20 0 EIADHM O=C(c1ccccc1[O-])N1CC=C(c2cccc3ccccc32)CC1 ZINC000064056103 1054847523 /nfs/dbraw/zinc/84/75/23/1054847523.db2.gz CJYVEMVQBPHHSJ-UHFFFAOYSA-N -1 3 329.399 4.475 20 0 EIADHM [O-]c1cc(F)c(Nc2cncc(OCc3ccccc3)c2)cc1F ZINC001201626098 1054870210 /nfs/dbraw/zinc/87/02/10/1054870210.db2.gz XDKQOPDKPBGNMZ-UHFFFAOYSA-N -1 3 328.318 4.388 20 0 EIADHM Cc1c(C)c(C)c(S(=O)(=O)[N-]c2cccc([C@@H](C)O)c2)c(C)c1C ZINC001201789014 1054919592 /nfs/dbraw/zinc/91/95/92/1054919592.db2.gz AUPSLQZWYHUJQV-MRXNPFEDSA-N -1 3 347.480 4.083 20 0 EIADHM Cc1nc(-c2ccc(NC(=O)Nc3ccc(C)c(C)c3)cc2)cc(=O)[n-]1 ZINC000339034484 1055028476 /nfs/dbraw/zinc/02/84/76/1055028476.db2.gz UBDBVZKLPXATFA-UHFFFAOYSA-N -1 3 348.406 4.418 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@@H](C)c3cc(C)cc(C)c3)nc2)n1 ZINC000068703004 1055089690 /nfs/dbraw/zinc/08/96/90/1055089690.db2.gz GCPTZEAPQFEBMU-HNNXBMFYSA-N -1 3 348.450 4.184 20 0 EIADHM CC1(C)CC[C@H](NC(=O)c2cc(=O)c3ccccc3[n-]2)c2ccccc21 ZINC000069046421 1055102259 /nfs/dbraw/zinc/10/22/59/1055102259.db2.gz IAFIHLCOJIUUGE-SFHVURJKSA-N -1 3 346.430 4.071 20 0 EIADHM O=C(Nc1cccc(Cl)c1)Nc1cc(Br)ccc1[O-] ZINC001202247491 1055116075 /nfs/dbraw/zinc/11/60/75/1055116075.db2.gz KGUDOFYCRAJYES-UHFFFAOYSA-N -1 3 341.592 4.452 20 0 EIADHM [O-]c1ccccc1-c1nnc(CN(c2ccccc2)C2CCCC2)o1 ZINC000878243111 1055222609 /nfs/dbraw/zinc/22/26/09/1055222609.db2.gz UPQUQEDAVCLDMI-UHFFFAOYSA-N -1 3 335.407 4.391 20 0 EIADHM Cc1sc2[n-]c([C@@H](C)OC(=O)CCC3CCCC3)nc(=O)c2c1C ZINC000006292007 1055232111 /nfs/dbraw/zinc/23/21/11/1055232111.db2.gz FLSRMNJHFDLDPA-LLVKDONJSA-N -1 3 348.468 4.176 20 0 EIADHM CC[C@H](N[C@@H](CCO)c1ccco1)c1ccc(Cl)c(Cl)c1[O-] ZINC000186421636 1055558697 /nfs/dbraw/zinc/55/86/97/1055558697.db2.gz VZNICZABIDPZBC-STQMWFEESA-N -1 3 344.238 4.456 20 0 EIADHM [O-]c1ccc(NC(=S)Nc2ccccc2C(F)(F)F)cc1F ZINC000169246777 1056715947 /nfs/dbraw/zinc/71/59/47/1056715947.db2.gz KUGICEZGIQUNBU-UHFFFAOYSA-N -1 3 330.306 4.359 20 0 EIADHM CC(=O)c1cccc([N-]S(=O)(=O)c2c(C)c(C)c(C)c(C)c2C)c1 ZINC000007056243 1056761610 /nfs/dbraw/zinc/76/16/10/1056761610.db2.gz LIWLHGNGDSEVHN-UHFFFAOYSA-N -1 3 345.464 4.232 20 0 EIADHM CCc1c(C(=O)Nc2cc(Cl)ccc2[O-])cnn1-c1ccccc1 ZINC000111210958 1056772046 /nfs/dbraw/zinc/77/20/46/1056772046.db2.gz LUVHJCAAWYIZTN-UHFFFAOYSA-N -1 3 341.798 4.046 20 0 EIADHM CC(C)c1ccc(S(=O)(=O)[N-]c2ccc(OC(F)F)cc2)cc1 ZINC000007409104 1056794404 /nfs/dbraw/zinc/79/44/04/1056794404.db2.gz SQNMMWRFAISNCS-UHFFFAOYSA-N -1 3 341.379 4.212 20 0 EIADHM Cc1cc(=O)[n-]c(-c2cccc(OC(=O)CC3CCCCC3)c2)n1 ZINC000744217537 1059336056 /nfs/dbraw/zinc/33/60/56/1059336056.db2.gz BGZPINXUAUUHFK-UHFFFAOYSA-N -1 3 326.396 4.033 20 0 EIADHM CCOC(=O)c1ccc(NC)c(Nc2c(Cl)ccc([O-])c2F)c1 ZINC001214561240 1060248730 /nfs/dbraw/zinc/24/87/30/1060248730.db2.gz BKFUFLQTWZLHHR-UHFFFAOYSA-N -1 3 338.766 4.147 20 0 EIADHM CCCCCC[C@@](C)(CCC)C(=O)N1Cc2nc(C)[n-]c(=O)c2C1 ZINC001168938524 1060528951 /nfs/dbraw/zinc/52/89/51/1060528951.db2.gz ILWWNNHTPACRCM-LJQANCHMSA-N -1 3 333.476 4.110 20 0 EIADHM COc1ccc(Cn2nccc2Nc2ccc(Cl)c([O-])c2)cc1 ZINC001212588156 1060765307 /nfs/dbraw/zinc/76/53/07/1060765307.db2.gz HMKRWXHEVIRLHW-UHFFFAOYSA-N -1 3 329.787 4.043 20 0 EIADHM O=c1cc(CN2CCCC3(CCCC3)C2)c2cc(Cl)c([O-])cc2o1 ZINC001169395706 1060807442 /nfs/dbraw/zinc/80/74/42/1060807442.db2.gz LZGDBUZJMMAEAS-UHFFFAOYSA-N -1 3 347.842 4.308 20 0 EIADHM Cc1cc(/C=C/C(=O)[N-]OCC(F)(F)F)c(C)n1C1CCCCC1 ZINC000766775089 1060887849 /nfs/dbraw/zinc/88/78/49/1060887849.db2.gz VAFRKOUSABQTHF-CMDGGOBGSA-N -1 3 344.377 4.233 20 0 EIADHM COc1cc(Br)c(O)c(Nc2ccc(Cl)c([O-])c2)c1 ZINC001212592607 1060891304 /nfs/dbraw/zinc/89/13/04/1060891304.db2.gz YNEKLYMCXLQVKY-UHFFFAOYSA-N -1 3 344.592 4.266 20 0 EIADHM [O-]c1cc(Nc2ccc(OC[C@H]3CCCO3)c(F)c2)ccc1Cl ZINC001212592445 1060891620 /nfs/dbraw/zinc/89/16/20/1060891620.db2.gz QCCGXAURCDITFF-CYBMUJFWSA-N -1 3 337.778 4.486 20 0 EIADHM [O-]c1cc(Nc2cc(Br)cc(F)c2O)ccc1Cl ZINC001212593708 1060910045 /nfs/dbraw/zinc/91/00/45/1060910045.db2.gz GASSLCZUBVWPJV-UHFFFAOYSA-N -1 3 332.556 4.396 20 0 EIADHM COC(=O)c1cc(Nc2ccc(Cl)c([O-])c2)c(F)cc1Cl ZINC001212593920 1060914325 /nfs/dbraw/zinc/91/43/25/1060914325.db2.gz LGFXQHCLMCCEEX-UHFFFAOYSA-N -1 3 330.142 4.368 20 0 EIADHM COCCOc1c(F)cc(Nc2ccc(Cl)c([O-])c2)cc1F ZINC001212595366 1060976324 /nfs/dbraw/zinc/97/63/24/1060976324.db2.gz PXAAWNHTRLNYCK-UHFFFAOYSA-N -1 3 329.730 4.093 20 0 EIADHM [O-]c1ccc(-c2noc(-c3cc(F)ccc3Br)n2)cc1 ZINC000034956069 202282184 /nfs/dbraw/zinc/28/21/84/202282184.db2.gz WNKUKRLSEQRFKK-UHFFFAOYSA-N -1 3 335.132 4.011 20 0 EIADHM CCOc1cc(CN2CCOC[C@H]2c2ccccc2)cc(Cl)c1[O-] ZINC000459373624 1032085954 /nfs/dbraw/zinc/08/59/54/1032085954.db2.gz LCIWCSGDDREIDF-KRWDZBQOSA-N -1 3 347.842 4.018 20 0 EIADHM Cc1cc(OC(C)C)ccc1[N-]S(=O)(=O)c1ccc2c(c1)CCC2 ZINC000614863621 1032101657 /nfs/dbraw/zinc/10/16/57/1032101657.db2.gz LKYCGBCYWKWWDM-UHFFFAOYSA-N -1 3 345.464 4.072 20 0 EIADHM O=C(Cc1ccc([O-])c(F)c1)Nc1cccc(N2CCCCCC2)c1 ZINC000449924715 1032128488 /nfs/dbraw/zinc/12/84/88/1032128488.db2.gz IQKRNPHFABPURI-UHFFFAOYSA-N -1 3 342.414 4.093 20 0 EIADHM COc1cccc(SC)c1[N-]C(=O)c1ccoc1Br ZINC001129981462 1046823983 /nfs/dbraw/zinc/82/39/83/1046823983.db2.gz AHMAOFKLRGEWLQ-UHFFFAOYSA-N -1 3 342.214 4.025 20 0 EIADHM Cc1ccc([C@@H]2CCCCCN2C(=O)Cc2ccc([O-])c(F)c2)o1 ZINC000449958727 1032160295 /nfs/dbraw/zinc/16/02/95/1032160295.db2.gz IFJDYXTYJLTCKN-INIZCTEOSA-N -1 3 331.387 4.119 20 0 EIADHM CSc1ccc([O-])c(C(=O)N(Cc2cccc(F)c2)C2CC2)c1 ZINC000666052816 1032316303 /nfs/dbraw/zinc/31/63/03/1032316303.db2.gz NLABFGQSKOQFHS-UHFFFAOYSA-N -1 3 331.412 4.058 20 0 EIADHM Cc1cc(Br)ccc1C(=O)Nc1ccc(Cl)cc1[O-] ZINC000532837758 1032343133 /nfs/dbraw/zinc/34/31/33/1032343133.db2.gz MADAEHAYDIUOLA-UHFFFAOYSA-N -1 3 340.604 4.369 20 0 EIADHM CC[C@@](C)(NCc1c([O-])ccc(Cl)c1F)c1nc(C)cs1 ZINC000191196512 1032346561 /nfs/dbraw/zinc/34/65/61/1032346561.db2.gz MNNRTTFZKUJAKV-OAHLLOKOSA-N -1 3 328.840 4.365 20 0 EIADHM Cc1ccc(-c2ccc(C(=O)[N-]c3nnc(C(F)F)s3)s2)o1 ZINC000180921715 1032631970 /nfs/dbraw/zinc/63/19/70/1032631970.db2.gz UYRUTNCPRNAZNK-UHFFFAOYSA-N -1 3 341.364 4.358 20 0 EIADHM O=C(Nc1ccc(Oc2ccccc2)cc1)c1cc(=O)[n-]c(C2CC2)n1 ZINC000579745469 1018848388 /nfs/dbraw/zinc/84/83/88/1018848388.db2.gz ALXUBYJIOQHQKO-UHFFFAOYSA-N -1 3 347.374 4.104 20 0 EIADHM CCC[C@@H](C(=O)Nc1cc(Br)ccc1[O-])c1ccccn1 ZINC000339509971 1019021510 /nfs/dbraw/zinc/02/15/10/1019021510.db2.gz BWHVAPZPTNFCCZ-GFCCVEGCSA-N -1 3 349.228 4.072 20 0 EIADHM CCC[C@H](C(=O)Nc1cc(Br)ccc1[O-])c1ccccn1 ZINC000339509972 1019022147 /nfs/dbraw/zinc/02/21/47/1019022147.db2.gz BWHVAPZPTNFCCZ-LBPRGKRZSA-N -1 3 349.228 4.072 20 0 EIADHM C[C@H](C(=O)Nc1ccc(Br)cc1[O-])c1ccccc1F ZINC000108988873 1019181126 /nfs/dbraw/zinc/18/11/26/1019181126.db2.gz ZOHFFGXPWIGWAD-VIFPVBQESA-N -1 3 338.176 4.036 20 0 EIADHM CC(C)Sc1c(Cl)cccc1[N-]C(=O)c1csc(CN)n1 ZINC000236620334 1032821491 /nfs/dbraw/zinc/82/14/91/1032821491.db2.gz VNZSPJJLXZRREQ-UHFFFAOYSA-N -1 3 341.889 4.008 20 0 EIADHM CC[C@@H]1c2ccccc2CN1C(=O)CCCc1ccc([O-])c(F)c1 ZINC000890616192 1019642813 /nfs/dbraw/zinc/64/28/13/1019642813.db2.gz VANNUDLUYIEGHU-GOSISDBHSA-N -1 3 327.399 4.348 20 0 EIADHM CCOc1ccccc1[C@H](CC)NC(=O)c1cc([O-])ccc1Cl ZINC000339689759 1019811488 /nfs/dbraw/zinc/81/14/88/1019811488.db2.gz XURFFLULZVRVOQ-INIZCTEOSA-N -1 3 333.815 4.325 20 0 EIADHM O=C(CCCc1cccc(C(F)(F)F)c1)[N-]OCCC(F)(F)F ZINC000275104664 1020146233 /nfs/dbraw/zinc/14/62/33/1020146233.db2.gz UZCANSMGPKDDMW-UHFFFAOYSA-N -1 3 343.267 4.028 20 0 EIADHM Cc1ccccc1CS(=O)(=O)[N-]c1ccc(F)cc1C(F)(F)F ZINC000180817292 1020177906 /nfs/dbraw/zinc/17/79/06/1020177906.db2.gz DBEXVZWEOZEPDE-UHFFFAOYSA-N -1 3 347.333 4.095 20 0 EIADHM Cc1cccc([O-])c1C(=O)N1CCC(Cc2ccc(F)c(F)c2)CC1 ZINC001625838610 1020237874 /nfs/dbraw/zinc/23/78/74/1020237874.db2.gz KCJDEGPZZYSHKU-UHFFFAOYSA-N -1 3 345.389 4.074 20 0 EIADHM O=C(c1cc(=O)c2ccccc2[n-]1)N1CCC(c2ccsc2)CC1 ZINC000275315782 1020411160 /nfs/dbraw/zinc/41/11/60/1020411160.db2.gz SCESVCKEQNXRID-UHFFFAOYSA-N -1 3 338.432 4.022 20 0 EIADHM CSc1ccc([O-])c(C(=O)N(C)[C@H](C)Cc2ccccc2C)c1 ZINC000614077706 1032905402 /nfs/dbraw/zinc/90/54/02/1032905402.db2.gz KRBVKPPJAYGNKW-CQSZACIVSA-N -1 3 329.465 4.126 20 0 EIADHM CCc1ccc([O-])c(C(=O)N2CCC(c3c[nH]c4ccccc43)CC2)c1 ZINC000109813971 1020729339 /nfs/dbraw/zinc/72/93/39/1020729339.db2.gz RTFOHGZIKCIAJC-UHFFFAOYSA-N -1 3 348.446 4.456 20 0 EIADHM CCOc1ccc(C(=O)Nc2ccc(Cl)cc2[O-])cc1OCC ZINC000533618888 1020751626 /nfs/dbraw/zinc/75/16/26/1020751626.db2.gz NQFKUTXMILKLJH-UHFFFAOYSA-N -1 3 335.787 4.095 20 0 EIADHM O=C(Nc1ccc(Br)cc1[O-])c1ccc(C(F)F)cc1 ZINC000206379357 1020930067 /nfs/dbraw/zinc/93/00/67/1020930067.db2.gz XKWGTRJDGVOXQQ-UHFFFAOYSA-N -1 3 342.139 4.345 20 0 EIADHM Nc1ccc(Br)c(F)c1Nc1cccc(Cl)c1[O-] ZINC001210223493 1020963034 /nfs/dbraw/zinc/96/30/34/1020963034.db2.gz QSUZXDJYJBIUAF-UHFFFAOYSA-N -1 3 331.572 4.273 20 0 EIADHM CC(C)n1cc2cc(NC(=O)c3cc([O-])ccc3Cl)ccc2n1 ZINC000340427115 1021009893 /nfs/dbraw/zinc/00/98/93/1021009893.db2.gz TXOUVTVVTKIMBY-UHFFFAOYSA-N -1 3 329.787 4.229 20 0 EIADHM CC(C)c1ccc(-c2nc(CN3CC[C@@H](C(=O)[O-])[C@@H]3C)cs2)cc1 ZINC000579968016 1021039921 /nfs/dbraw/zinc/03/99/21/1021039921.db2.gz DEKNFUUPSUTQGM-SUMWQHHRSA-N -1 3 344.480 4.229 20 0 EIADHM Cc1cc(C(=O)[N-]c2cc(-c3ccc(C(C)(C)C)cc3)no2)on1 ZINC000115157035 1021305848 /nfs/dbraw/zinc/30/58/48/1021305848.db2.gz FMLUREDLKRZVJR-UHFFFAOYSA-N -1 3 325.368 4.188 20 0 EIADHM CSc1ccccc1[N-]C(=O)c1cc2sc(N(C)C)nc2s1 ZINC000053259905 1021351967 /nfs/dbraw/zinc/35/19/67/1021351967.db2.gz WCRNZNXVRJBAOB-UHFFFAOYSA-N -1 3 349.506 4.398 20 0 EIADHM CCc1cc2c(CSc3ccc(Cl)cn3)cc(=O)oc2cc1[O-] ZINC000219811972 1021472036 /nfs/dbraw/zinc/47/20/36/1021472036.db2.gz VMWXEHPOHVNOEK-UHFFFAOYSA-N -1 3 347.823 4.402 20 0 EIADHM Cc1ccc(OC2CCN([C@H](C)c3ccc(C(=O)[O-])o3)CC2)cc1C ZINC000580085616 1021628235 /nfs/dbraw/zinc/62/82/35/1021628235.db2.gz VTBNBMGTWMXMNN-OAHLLOKOSA-N -1 3 343.423 4.199 20 0 EIADHM Cc1noc(C2CC2)c1[N-]C(=O)c1cnc(CCC(F)(F)F)s1 ZINC001266577195 1021661406 /nfs/dbraw/zinc/66/14/06/1021661406.db2.gz ZSABYBWCCLRTLD-UHFFFAOYSA-N -1 3 345.346 4.064 20 0 EIADHM CCCCOc1cccc(CNC(=O)c2cc([O-])ccc2Cl)c1 ZINC000431730168 1021679564 /nfs/dbraw/zinc/67/95/64/1021679564.db2.gz UMBYSGMVCCQIGD-UHFFFAOYSA-N -1 3 333.815 4.155 20 0 EIADHM Cc1noc(C)c1[N-]C(=O)c1oc2ccccc2c1Br ZINC001125428852 1021774602 /nfs/dbraw/zinc/77/46/02/1021774602.db2.gz KVUPLJDNXOUESU-UHFFFAOYSA-N -1 3 335.157 4.052 20 0 EIADHM [O-]c1cccc(Nc2ccn3c(Br)cnc3c2)c1Cl ZINC001210855796 1021809136 /nfs/dbraw/zinc/80/91/36/1021809136.db2.gz YECVTYDCWBXLOC-UHFFFAOYSA-N -1 3 338.592 4.199 20 0 EIADHM O=C(N[C@@H]1CCC[C@H]1Cc1ccccc1)c1cc([O-])ccc1Cl ZINC000431793637 1021862524 /nfs/dbraw/zinc/86/25/24/1021862524.db2.gz ZUZPKTJVOYUPAN-KBXCAEBGSA-N -1 3 329.827 4.187 20 0 EIADHM C[C@H](Cc1ccc(Cl)cc1)N(C)C(=O)c1cc([O-])ccc1Cl ZINC000431795976 1021865437 /nfs/dbraw/zinc/86/54/37/1021865437.db2.gz RSNBOTACULXGKC-LLVKDONJSA-N -1 3 338.234 4.402 20 0 EIADHM C[C@@H](Cc1ccc(Cl)cc1)N(C)C(=O)c1cc([O-])ccc1Cl ZINC000431795978 1021865632 /nfs/dbraw/zinc/86/56/32/1021865632.db2.gz RSNBOTACULXGKC-NSHDSACASA-N -1 3 338.234 4.402 20 0 EIADHM CCC1(C[N-]S(=O)(=O)c2c(Cl)cccc2Cl)CCCC1 ZINC001210957007 1021890305 /nfs/dbraw/zinc/89/03/05/1021890305.db2.gz AGFJAJOVSORFJG-UHFFFAOYSA-N -1 3 336.284 4.242 20 0 EIADHM Cc1ccc(CN[C@H](CC(=O)[O-])c2cccc(C(F)(F)F)c2)cc1 ZINC000340677316 1021898509 /nfs/dbraw/zinc/89/85/09/1021898509.db2.gz LYHABBAFKSHCGI-MRXNPFEDSA-N -1 3 337.341 4.319 20 0 EIADHM O=C(NCc1cc(Cl)sc1Cl)c1cc([O-])ccc1Cl ZINC000312814156 1021899517 /nfs/dbraw/zinc/89/95/17/1021899517.db2.gz FWECBGVSVVRROM-UHFFFAOYSA-N -1 3 336.627 4.344 20 0 EIADHM O=C([O-])C[C@@H](NCc1cccc(F)c1)c1cccc(C(F)(F)F)c1 ZINC000340685038 1021994325 /nfs/dbraw/zinc/99/43/25/1021994325.db2.gz UTYFXDXSALBDFV-OAHLLOKOSA-N -1 3 341.304 4.150 20 0 EIADHM C[C@@H](CN(C)Cc1c(Br)cccc1C(=O)[O-])C(C)(C)C ZINC000634697266 1022037088 /nfs/dbraw/zinc/03/70/88/1022037088.db2.gz FDULQQKDVLVUQO-NSHDSACASA-N -1 3 342.277 4.261 20 0 EIADHM Cc1cc([C@@H]2CCCN2Cc2ncccc2[O-])ccc1Br ZINC000580635973 1022334128 /nfs/dbraw/zinc/33/41/28/1022334128.db2.gz DLTMAVHGUFFKRP-INIZCTEOSA-N -1 3 347.256 4.195 20 0 EIADHM CC[C@H](NCc1cc(=O)oc2cc([O-])ccc12)c1ccc(F)cc1F ZINC000179627211 1022360100 /nfs/dbraw/zinc/36/01/00/1022360100.db2.gz ZIWXQGIXRFHVSO-KRWDZBQOSA-N -1 3 345.345 4.018 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)Nc1cccc(-c2cnco2)c1 ZINC000468646304 1022435895 /nfs/dbraw/zinc/43/58/95/1022435895.db2.gz WYZUEEALSRCPIO-UHFFFAOYSA-N -1 3 340.354 4.148 20 0 EIADHM C[C@H]1CCN([C@@H](C(=O)[O-])c2cccc(Cl)c2Cl)CC1(C)C ZINC000568771917 1022538292 /nfs/dbraw/zinc/53/82/92/1022538292.db2.gz HLBSSYQLFMMTAD-IINYFYTJSA-N -1 3 330.255 4.487 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(NCC(C)(C)CC(C)C)nc2)n1 ZINC000685909663 1022551402 /nfs/dbraw/zinc/55/14/02/1022551402.db2.gz CMSDNSCNGCFWIW-UHFFFAOYSA-N -1 3 328.460 4.291 20 0 EIADHM CCSc1cccc(F)c1[N-]S(=O)(=O)Cc1cccc(C)c1 ZINC000685916285 1022658230 /nfs/dbraw/zinc/65/82/30/1022658230.db2.gz FSJLHEQHWDDYPW-UHFFFAOYSA-N -1 3 339.457 4.188 20 0 EIADHM [O-]C(=NO[C@H]1CCCCO1)Nc1cccc(COC2CCCCC2)c1 ZINC000155907249 1022672710 /nfs/dbraw/zinc/67/27/10/1022672710.db2.gz FAPJOXNEAVKXJI-SFHVURJKSA-N -1 3 348.443 4.116 20 0 EIADHM O=C([N-]O[C@H]1CCCCO1)Nc1cccc(COC2CCCCC2)c1 ZINC000155907249 1022672722 /nfs/dbraw/zinc/67/27/22/1022672722.db2.gz FAPJOXNEAVKXJI-SFHVURJKSA-N -1 3 348.443 4.116 20 0 EIADHM CCCCO[C@@H]1C[C@H](N(C)C(=O)c2cc([O-])ccc2Cl)C1(C)C ZINC001149273693 1022698616 /nfs/dbraw/zinc/69/86/16/1022698616.db2.gz JVWDIQMUYDDCMA-JKSUJKDBSA-N -1 3 339.863 4.101 20 0 EIADHM CC(C)[C@H](Cc1ccc(F)cc1)NC(=O)c1cc([O-])ccc1Cl ZINC000431864050 1022762842 /nfs/dbraw/zinc/76/28/42/1022762842.db2.gz VBMBNMAXWQJGSL-KRWDZBQOSA-N -1 3 335.806 4.182 20 0 EIADHM CC1(c2cc([N-]C(=O)c3cnc([C@H]4CCCO4)s3)no2)CCCC1 ZINC000684151176 1022847238 /nfs/dbraw/zinc/84/72/38/1022847238.db2.gz DWLWULSGABYYJU-LLVKDONJSA-N -1 3 347.440 4.067 20 0 EIADHM CC1(c2cc([N-]C(=O)c3cnc([C@@H]4CCCO4)s3)no2)CCCC1 ZINC000684151177 1022848218 /nfs/dbraw/zinc/84/82/18/1022848218.db2.gz DWLWULSGABYYJU-NSHDSACASA-N -1 3 347.440 4.067 20 0 EIADHM Cc1oc(C)c(C(=O)Nc2c([O-])ccc(Br)c2C)c1C ZINC000650946285 1022848468 /nfs/dbraw/zinc/84/84/68/1022848468.db2.gz OLBYFDAZVKDCKB-UHFFFAOYSA-N -1 3 338.201 4.234 20 0 EIADHM CCc1oc(C(=O)[O-])cc1CN1CC=C(c2cc(C)cc(C)c2)CC1 ZINC000581316254 1023007759 /nfs/dbraw/zinc/00/77/59/1023007759.db2.gz OFWFEKZWWKPHOI-UHFFFAOYSA-N -1 3 339.435 4.446 20 0 EIADHM CC(C)c1ccc(C(=O)N2CCCC[C@@H]2[C@H]2CCCC[C@H]2O)c([O-])c1 ZINC000647648034 1023097045 /nfs/dbraw/zinc/09/70/45/1023097045.db2.gz PFOLYHMZXMSXKA-BHIYHBOVSA-N -1 3 345.483 4.061 20 0 EIADHM CC(C)Cc1nnc([N-]C(=O)c2cc(Cl)sc2Cl)s1 ZINC000069526280 1023098823 /nfs/dbraw/zinc/09/88/23/1023098823.db2.gz HGWYOEHZIXCUBZ-UHFFFAOYSA-N -1 3 336.269 4.357 20 0 EIADHM COc1ccc([C@@H]2CCN(C(=O)c3ccc(C(C)C)cc3[O-])C2)cc1 ZINC000110067332 1033110652 /nfs/dbraw/zinc/11/06/52/1033110652.db2.gz AYTHHIVSAZORSE-QGZVFWFLSA-N -1 3 339.435 4.154 20 0 EIADHM COc1ccc(-c2noc(C=C([O-])c3ccccc3Cl)n2)c(C)c1 ZINC001211646866 1023206473 /nfs/dbraw/zinc/20/64/73/1023206473.db2.gz BIHLMFKCTPHGCF-UHFFFAOYSA-N -1 3 342.782 4.132 20 0 EIADHM O=C([O-])CC[C@@H](NCc1cccc(OC2CC2)c1F)c1ccccc1 ZINC000656566033 1023226725 /nfs/dbraw/zinc/22/67/25/1023226725.db2.gz BCCVAOYJCMOQNH-QGZVFWFLSA-N -1 3 343.398 4.063 20 0 EIADHM Cc1cc(C(=O)Nc2cc(Cl)ccc2[O-])c(C)n1-c1nccs1 ZINC000109091597 1023256563 /nfs/dbraw/zinc/25/65/63/1023256563.db2.gz GMYNACKYCVUPSM-UHFFFAOYSA-N -1 3 347.827 4.162 20 0 EIADHM COc1ccc([C@@H](CCC(=O)[O-])NCc2cc(Cl)cs2)cc1 ZINC000417579218 1023363512 /nfs/dbraw/zinc/36/35/12/1023363512.db2.gz PDLDNLCCYVXNCR-OAHLLOKOSA-N -1 3 339.844 4.106 20 0 EIADHM Cc1cc(CN[C@@H](CC(=O)[O-])c2cccc(C(F)(F)F)c2)cs1 ZINC000417592809 1023368079 /nfs/dbraw/zinc/36/80/79/1023368079.db2.gz UKQZSXXZTARUHJ-AWEZNQCLSA-N -1 3 343.370 4.381 20 0 EIADHM CC(C)c1ccoc1C(=O)N=c1cc(-c2ccc3ncccc3c2)o[n-]1 ZINC000377205007 1023406151 /nfs/dbraw/zinc/40/61/51/1023406151.db2.gz YHPAXOXNEQQSCF-UHFFFAOYSA-N -1 3 347.374 4.280 20 0 EIADHM O=C([O-])[C@@H]1CCN(Cc2ccc(Cl)cc2Cl)[C@@H]2CCCC[C@H]12 ZINC000656763438 1023503717 /nfs/dbraw/zinc/50/37/17/1023503717.db2.gz FSDAHIYCBJIHFH-IIAWOOMASA-N -1 3 342.266 4.459 20 0 EIADHM CC(C)CN1C(=O)c2ccccc2N[C@@H]1c1cc(Cl)ccc1[O-] ZINC000024098866 1023557104 /nfs/dbraw/zinc/55/71/04/1023557104.db2.gz DZOCMLBIUMQZGT-KRWDZBQOSA-N -1 3 330.815 4.268 20 0 EIADHM CCC(C)(C)c1ccc(NC(=O)c2c(C)[n-]c(=O)nc2SC)cc1 ZINC000468749522 1023569241 /nfs/dbraw/zinc/56/92/41/1023569241.db2.gz MVCYASBMZBIIDY-UHFFFAOYSA-N -1 3 345.468 4.152 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1cc(Oc2ccccc2)ccn1 ZINC000467216973 1023670118 /nfs/dbraw/zinc/67/01/18/1023670118.db2.gz KLNSDELQBZTVOD-UHFFFAOYSA-N -1 3 340.766 4.485 20 0 EIADHM CCCCOc1ccc([N-]S(=O)(=O)c2ccc(F)cc2)c(C)c1 ZINC000518082823 1023816440 /nfs/dbraw/zinc/81/64/40/1023816440.db2.gz YAFRXRUGGOJHTG-UHFFFAOYSA-N -1 3 337.416 4.114 20 0 EIADHM CC[C@H](C)Oc1ccc([N-]S(=O)(=O)c2ccc3c(c2)CCC3)cc1 ZINC000511680573 1023827804 /nfs/dbraw/zinc/82/78/04/1023827804.db2.gz JBUCLJSISLMKMF-AWEZNQCLSA-N -1 3 345.464 4.153 20 0 EIADHM CCOc1ccc(S(=O)(=O)[N-]c2ccc(O[C@@H](C)CC)cc2)cc1 ZINC000511695417 1023829318 /nfs/dbraw/zinc/82/93/18/1023829318.db2.gz MTPUKICEVIHZGP-AWEZNQCLSA-N -1 3 349.452 4.063 20 0 EIADHM Cc1nc(S(=O)(=O)[C@H](C)c2ccc(F)cc2)[n-]c1-c1ccccc1 ZINC000548298910 1023834382 /nfs/dbraw/zinc/83/43/82/1023834382.db2.gz JBZQMJGIDGYUOY-CYBMUJFWSA-N -1 3 344.411 4.059 20 0 EIADHM Cc1[n-]c(S(=O)(=O)[C@H](C)c2ccc(F)cc2)nc1-c1ccccc1 ZINC000548298910 1023834384 /nfs/dbraw/zinc/83/43/84/1023834384.db2.gz JBZQMJGIDGYUOY-CYBMUJFWSA-N -1 3 344.411 4.059 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)N1CCc2ccc(Cl)cc21 ZINC000468887729 1024052368 /nfs/dbraw/zinc/05/23/68/1024052368.db2.gz IOUFTZFAVZXEKV-UHFFFAOYSA-N -1 3 333.790 4.097 20 0 EIADHM CC(C)[C@@H]1C[C@@H](CC(=O)[N-]OCCC(F)(F)F)c2ccccc21 ZINC000785291219 1024394198 /nfs/dbraw/zinc/39/41/98/1024394198.db2.gz ZLGOGGWAIPVZTQ-WFASDCNBSA-N -1 3 329.362 4.304 20 0 EIADHM C[C@H](c1nc2ccccc2s1)N(C)C(=O)c1cc([O-])ccc1Cl ZINC000431021848 1024442124 /nfs/dbraw/zinc/44/21/24/1024442124.db2.gz DQVRUQXDVFDUPF-SNVBAGLBSA-N -1 3 346.839 4.489 20 0 EIADHM Cc1cccc(C(C)C)c1NCc1nc(C(F)(F)F)cc(=O)[n-]1 ZINC000341787387 1024670761 /nfs/dbraw/zinc/67/07/61/1024670761.db2.gz XRNFQMLDVAKUPF-UHFFFAOYSA-N -1 3 325.334 4.245 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-][C@H](C)c2ccccc2C(F)(F)F)s1 ZINC000511906773 1024722522 /nfs/dbraw/zinc/72/25/22/1024722522.db2.gz KMWMNYLPNRGWOD-SNVBAGLBSA-N -1 3 349.399 4.115 20 0 EIADHM Cc1cc([C@H](C)N2CCC(COc3ccccc3)CC2)oc1C(=O)[O-] ZINC000652401620 1024809622 /nfs/dbraw/zinc/80/96/22/1024809622.db2.gz RNCOGPGTBLKLQC-HNNXBMFYSA-N -1 3 343.423 4.138 20 0 EIADHM CCc1ccc(-c2nc(CN(CCC(=O)[O-])CC3CC3)cs2)cc1 ZINC000652468109 1024844958 /nfs/dbraw/zinc/84/49/58/1024844958.db2.gz XLWNBSILNJVKOU-UHFFFAOYSA-N -1 3 344.480 4.059 20 0 EIADHM O=C([O-])CC[C@@H]1CCCN(CCc2cc(Cl)ccc2Cl)C1 ZINC000652495914 1024854172 /nfs/dbraw/zinc/85/41/72/1024854172.db2.gz GBWYRKMLPRCMAR-LBPRGKRZSA-N -1 3 330.255 4.113 20 0 EIADHM O=C([O-])[C@H](NCc1ccc(Cl)c(C(F)(F)F)c1)c1ccsc1 ZINC000426820101 1024886744 /nfs/dbraw/zinc/88/67/44/1024886744.db2.gz XXHAURJJEHUARW-GFCCVEGCSA-N -1 3 349.761 4.336 20 0 EIADHM CCc1cccc(Cl)c1CNC[C@H](CCC(=O)[O-])C(F)(F)F ZINC000663261897 1024963665 /nfs/dbraw/zinc/96/36/65/1024963665.db2.gz ODHKHVLEKQTBRA-NSHDSACASA-N -1 3 337.769 4.035 20 0 EIADHM O=C([O-])CC[C@@H](CNCc1cccc(Cl)c1Cl)C(F)(F)F ZINC000663262530 1024967603 /nfs/dbraw/zinc/96/76/03/1024967603.db2.gz SWLIXZCBUIFPIC-VIFPVBQESA-N -1 3 344.160 4.126 20 0 EIADHM COCc1nc(C)c(C(=O)[N-]c2c(F)cc(Cl)c(C)c2F)s1 ZINC000342026905 1025042585 /nfs/dbraw/zinc/04/25/85/1025042585.db2.gz BVERIUFHXPZFEX-UHFFFAOYSA-N -1 3 346.786 4.090 20 0 EIADHM C[C@H]([N-]S(=O)(=O)c1ccc(C(F)F)o1)c1cc2ccccc2o1 ZINC001211530721 1025051364 /nfs/dbraw/zinc/05/13/64/1025051364.db2.gz JGUDDYQUZBGLKK-VIFPVBQESA-N -1 3 341.335 4.003 20 0 EIADHM Cc1ccc(C(=O)[N-]c2nc(-c3ccc(F)cc3)ns2)c(F)c1F ZINC001126236399 1025138098 /nfs/dbraw/zinc/13/80/98/1025138098.db2.gz FTLPDTCLINGTAC-UHFFFAOYSA-N -1 3 349.337 4.183 20 0 EIADHM CC[C@@H](C)[C@@H](NC(=O)NCc1ncccc1[O-])c1ccc(Cl)cc1 ZINC000471999161 1025290991 /nfs/dbraw/zinc/29/09/91/1025290991.db2.gz QEVVWUXJLUJMPX-SJKOYZFVSA-N -1 3 347.846 4.027 20 0 EIADHM COc1cc(/C=C2/C(=O)Nc3cc(Cl)ccc32)cc(Cl)c1[O-] ZINC000007155777 1025354320 /nfs/dbraw/zinc/35/43/20/1025354320.db2.gz FSJPJMKXUHGNOL-NYYWCZLTSA-N -1 3 336.174 4.200 20 0 EIADHM O=C(C[C@H]1CCc2ccccc21)Nc1ccc(Br)cc1[O-] ZINC000604312896 1025434532 /nfs/dbraw/zinc/43/45/32/1025434532.db2.gz KFCPEMLVTYNGLJ-GFCCVEGCSA-N -1 3 346.224 4.213 20 0 EIADHM CCOc1cc2c(cc1NC(=O)c1cc([O-])ccc1Cl)O[C@H](C)C2 ZINC000277293191 1025524122 /nfs/dbraw/zinc/52/41/22/1025524122.db2.gz AMMQJIMGFZMHBZ-SNVBAGLBSA-N -1 3 347.798 4.020 20 0 EIADHM CCOc1cc2c(cc1NC(=O)c1cc([O-])ccc1Cl)O[C@@H](C)C2 ZINC000277293184 1025526331 /nfs/dbraw/zinc/52/63/31/1025526331.db2.gz AMMQJIMGFZMHBZ-JTQLQIEISA-N -1 3 347.798 4.020 20 0 EIADHM [O-]c1cc(F)cc(CN[C@@H](CCc2ccccc2)C(F)(F)F)c1 ZINC000472065428 1025584619 /nfs/dbraw/zinc/58/46/19/1025584619.db2.gz MGTOKUVBDBFLGI-INIZCTEOSA-N -1 3 327.321 4.185 20 0 EIADHM O=C([N-]c1csnc1-c1ccccc1)c1ncnc2ccsc21 ZINC001126307171 1025835840 /nfs/dbraw/zinc/83/58/40/1025835840.db2.gz ZMWVOQWBHGPRRX-UHFFFAOYSA-N -1 3 338.417 4.067 20 0 EIADHM Cc1cc(OC(F)F)c(C(=O)Nc2cc(Cl)ccc2[O-])s1 ZINC000512096741 1025963839 /nfs/dbraw/zinc/96/38/39/1025963839.db2.gz MAJJJKYWHJLJMY-UHFFFAOYSA-N -1 3 333.743 4.269 20 0 EIADHM O=C(Nc1ccc(Oc2ccccn2)cc1)c1cc([O-])ccc1Cl ZINC000578732173 1026032738 /nfs/dbraw/zinc/03/27/38/1026032738.db2.gz RGNRQWBVNJFERB-UHFFFAOYSA-N -1 3 340.766 4.485 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1ccc(N2CCCCCC2)nc1 ZINC000303271134 1026111978 /nfs/dbraw/zinc/11/19/78/1026111978.db2.gz RFKSHHGVFZWOKT-UHFFFAOYSA-N -1 3 345.830 4.073 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)c1ccccc1Cc1ccccc1 ZINC000303762012 1026189860 /nfs/dbraw/zinc/18/98/60/1026189860.db2.gz FGWCESLGPFULKC-UHFFFAOYSA-N -1 3 335.378 4.052 20 0 EIADHM O=C([O-])c1ccc(CN2CCC(Cc3ccccc3F)CC2)cc1F ZINC000582133718 1026221042 /nfs/dbraw/zinc/22/10/42/1026221042.db2.gz JAUYICVPEMNLEA-UHFFFAOYSA-N -1 3 345.389 4.118 20 0 EIADHM CC[C@@H](C)c1ccc(S(=O)(=O)[N-]c2c(C)ccnc2Cl)cc1 ZINC000318788645 1026284447 /nfs/dbraw/zinc/28/44/47/1026284447.db2.gz YXPDJDHZCFEMCR-LLVKDONJSA-N -1 3 338.860 4.358 20 0 EIADHM O=C([O-])C[C@@H](NCc1cccc(-c2ccccn2)c1)c1ccsc1 ZINC000426672228 1026427766 /nfs/dbraw/zinc/42/77/66/1026427766.db2.gz QADRPBWBSXUKMA-GOSISDBHSA-N -1 3 338.432 4.116 20 0 EIADHM O=C([O-])C[C@H](NCc1cccc(-c2ccncc2)c1)c1ccsc1 ZINC000426693199 1026494182 /nfs/dbraw/zinc/49/41/82/1026494182.db2.gz YHXCXKPUKRQHON-SFHVURJKSA-N -1 3 338.432 4.116 20 0 EIADHM Cc1ccc([C@H](NCc2cc(F)cc(C(F)(F)F)c2)C(=O)[O-])cc1 ZINC000426715561 1026496597 /nfs/dbraw/zinc/49/65/97/1026496597.db2.gz RSVWCXGFERSMLK-HNNXBMFYSA-N -1 3 341.304 4.068 20 0 EIADHM CC(C)CCOc1ccc(CN[C@H](CC(=O)[O-])c2ccsc2)cc1 ZINC000426714183 1026509271 /nfs/dbraw/zinc/50/92/71/1026509271.db2.gz LUZBYVBLHZHLRQ-GOSISDBHSA-N -1 3 347.480 4.479 20 0 EIADHM Cc1cc([C@@H](NCc2coc3ccccc23)C(=O)[O-])ccc1Cl ZINC000426799941 1026568663 /nfs/dbraw/zinc/56/86/63/1026568663.db2.gz MMCWTFJUUNRXEO-QGZVFWFLSA-N -1 3 329.783 4.310 20 0 EIADHM CSc1ccc(CN[C@H](CC(=O)[O-])c2cccc(Cl)c2)cc1 ZINC000426798813 1026568936 /nfs/dbraw/zinc/56/89/36/1026568936.db2.gz JSWLRNUCVVVPPP-MRXNPFEDSA-N -1 3 335.856 4.368 20 0 EIADHM Cc1cc(C(F)(F)F)ccc1CN[C@H](C(=O)[O-])c1cccc(F)c1 ZINC000426809128 1026574070 /nfs/dbraw/zinc/57/40/70/1026574070.db2.gz CDPHTCQIYRPJAT-HNNXBMFYSA-N -1 3 341.304 4.068 20 0 EIADHM COc1ccc(OC)c([C@H]2CCCN2Cc2c(F)ccc([O-])c2F)c1 ZINC000507022041 1026601312 /nfs/dbraw/zinc/60/13/12/1026601312.db2.gz MRHXFWBUMXZIET-MRXNPFEDSA-N -1 3 349.377 4.025 20 0 EIADHM COC(=O)c1cnc(S[C@@H](C)c2cc(Cl)ccc2Cl)[n-]1 ZINC000432657048 1026678815 /nfs/dbraw/zinc/67/88/15/1026678815.db2.gz JLXUDLGSYNFKJT-ZETCQYMHSA-N -1 3 331.224 4.356 20 0 EIADHM COC(=O)c1cnc(S[C@@H](C)c2ccc(Cl)cc2Cl)[n-]1 ZINC000432669837 1026697825 /nfs/dbraw/zinc/69/78/25/1026697825.db2.gz REKKAHSOYFQISC-ZETCQYMHSA-N -1 3 331.224 4.356 20 0 EIADHM CC(C)[C@H]1C[C@H](NC(=O)c2cc(=O)c3ccccc3[n-]2)c2ccccc21 ZINC000344983574 1026735343 /nfs/dbraw/zinc/73/53/43/1026735343.db2.gz QRJFLTHGIVHZLT-MJGOQNOKSA-N -1 3 346.430 4.143 20 0 EIADHM CC(C)C1(C)CCN([C@@H](C(=O)[O-])c2c(F)cccc2Cl)CC1 ZINC000582552189 1026786572 /nfs/dbraw/zinc/78/65/72/1026786572.db2.gz ZDSYQPVCFXHZGZ-OAHLLOKOSA-N -1 3 327.827 4.363 20 0 EIADHM CC1CCC(N(C)Cc2coc(-c3ccc(C(=O)[O-])cc3)n2)CC1 ZINC000582612201 1026858595 /nfs/dbraw/zinc/85/85/95/1026858595.db2.gz QTMNRUUYAMAMFU-UHFFFAOYSA-N -1 3 328.412 4.050 20 0 EIADHM O=C([O-])c1ccoc1CN1CCCCC[C@H]1/C=C/c1cccs1 ZINC000582671554 1026924382 /nfs/dbraw/zinc/92/43/82/1026924382.db2.gz QRIRXFKGQVUKOM-NPQIQWPPSA-N -1 3 331.437 4.497 20 0 EIADHM O=C(Nc1ccc([O-])c(C(F)(F)F)c1)c1cc2c(s1)CCC2 ZINC000440608142 1026970517 /nfs/dbraw/zinc/97/05/17/1026970517.db2.gz FFOYJPQZSOMHBD-UHFFFAOYSA-N -1 3 327.327 4.214 20 0 EIADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)C3(CC(C)C)CC3)c2)n1 ZINC000440749392 1027035328 /nfs/dbraw/zinc/03/53/28/1027035328.db2.gz RERGAQLMIGBFQR-UHFFFAOYSA-N -1 3 339.439 4.176 20 0 EIADHM CCc1nc(C)c([C@H](C)N(C)C(=O)c2ccc(CC)cc2[O-])s1 ZINC000191758745 1027098182 /nfs/dbraw/zinc/09/81/82/1027098182.db2.gz JWKNPGDIFBFPMG-LBPRGKRZSA-N -1 3 332.469 4.115 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@H]3CCC[C@@H](C)CC3)nc2)n1 ZINC000302702022 1027365135 /nfs/dbraw/zinc/36/51/35/1027365135.db2.gz XRLHMQLSGALGQY-CJNGLKHVSA-N -1 3 326.444 4.187 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@H]3CCC[C@H](C)CC3)nc2)n1 ZINC000302702021 1027365843 /nfs/dbraw/zinc/36/58/43/1027365843.db2.gz XRLHMQLSGALGQY-BBRMVZONSA-N -1 3 326.444 4.187 20 0 EIADHM CC(=O)c1cccc(NC(=O)C[C@@H](c2ccccc2)C(C)C)c1[O-] ZINC000582867588 1027539407 /nfs/dbraw/zinc/53/94/07/1027539407.db2.gz SCIYRMTYGCMJPH-QGZVFWFLSA-N -1 3 325.408 4.363 20 0 EIADHM CC(=O)c1cccc(NC(=O)C[C@H](c2ccccc2)C(C)C)c1[O-] ZINC000582867587 1027541421 /nfs/dbraw/zinc/54/14/21/1027541421.db2.gz SCIYRMTYGCMJPH-KRWDZBQOSA-N -1 3 325.408 4.363 20 0 EIADHM C[C@H](c1ccc(C(=O)[O-])o1)N(C)Cc1cccc(C(F)(F)F)c1 ZINC000520416423 1027543022 /nfs/dbraw/zinc/54/30/22/1027543022.db2.gz BTXWTMOGORVIIC-SNVBAGLBSA-N -1 3 327.302 4.190 20 0 EIADHM CSc1ccc([O-])c(C(=O)N(Cc2ccccc2F)C2CC2)c1 ZINC000665775163 1027576411 /nfs/dbraw/zinc/57/64/11/1027576411.db2.gz GGNYRSXUQGLXTK-UHFFFAOYSA-N -1 3 331.412 4.058 20 0 EIADHM C[C@H](CC(=O)[N-]OCc1ccccc1)c1cccc(C(F)(F)F)c1 ZINC000303816177 1027666752 /nfs/dbraw/zinc/66/67/52/1027666752.db2.gz ZZDJOZFMVCYEKG-CYBMUJFWSA-N -1 3 337.341 4.447 20 0 EIADHM COc1cc(/C=C2/C(=O)Nc3ccc(Cl)cc32)cc(Cl)c1[O-] ZINC000003570241 1027736238 /nfs/dbraw/zinc/73/62/38/1027736238.db2.gz DOLQYDUVKWKDAE-NYYWCZLTSA-N -1 3 336.174 4.200 20 0 EIADHM O=C([N-]c1nc(-c2ccccc2)ns1)c1cc(Cl)ccc1F ZINC000042090681 1027951117 /nfs/dbraw/zinc/95/11/17/1027951117.db2.gz DRIYGEWTOKDLCW-UHFFFAOYSA-N -1 3 333.775 4.250 20 0 EIADHM COc1csc(C(=O)[N-]c2c(F)cc(Br)cc2F)c1 ZINC000093294898 1027988564 /nfs/dbraw/zinc/98/85/64/1027988564.db2.gz ALOZANORJAMMIL-UHFFFAOYSA-N -1 3 348.168 4.050 20 0 EIADHM Cc1oc(-c2ccccc2)c(C(=O)NCc2ccc([O-])c(F)c2)c1C ZINC000188780435 1028019962 /nfs/dbraw/zinc/01/99/62/1028019962.db2.gz HEYYAQYDSRHUAM-UHFFFAOYSA-N -1 3 339.366 4.338 20 0 EIADHM CC(C)c1scnc1C(=O)[N-]c1nnc(-c2ccccc2)s1 ZINC000583113077 1028023126 /nfs/dbraw/zinc/02/31/26/1028023126.db2.gz VEXVNJYUQFWNBU-UHFFFAOYSA-N -1 3 330.438 4.037 20 0 EIADHM O=C(Nc1ccc(-c2nnn[n-]2)cc1)c1ccc(C2CCCCC2)cc1 ZINC000523392096 1028065204 /nfs/dbraw/zinc/06/52/04/1028065204.db2.gz SXXNLOUWMNTFFL-UHFFFAOYSA-N -1 3 347.422 4.167 20 0 EIADHM O=C(Nc1ccc(-c2nn[n-]n2)cc1)c1ccc(C2CCCCC2)cc1 ZINC000523392096 1028065226 /nfs/dbraw/zinc/06/52/26/1028065226.db2.gz SXXNLOUWMNTFFL-UHFFFAOYSA-N -1 3 347.422 4.167 20 0 EIADHM C[C@H](c1ccc(Br)cc1)[S@](=O)c1ccc([O-])cc1 ZINC000427469418 1028184053 /nfs/dbraw/zinc/18/40/53/1028184053.db2.gz BDQYMLAQOXAMQV-MGNBDDOMSA-N -1 3 325.227 4.024 20 0 EIADHM CN(C(=O)NCc1ccc([O-])c(F)c1)[C@H]1CCC[C@@H]1c1ccccc1 ZINC000458426858 1028236528 /nfs/dbraw/zinc/23/65/28/1028236528.db2.gz UBGUFYSVYVDMLU-AEFFLSMTSA-N -1 3 342.414 4.009 20 0 EIADHM COc1cccc(NC2CCN(Cc3cccc([O-])c3Cl)CC2)c1 ZINC000508519921 1028331901 /nfs/dbraw/zinc/33/19/01/1028331901.db2.gz XHLPGGUYWOWGBB-UHFFFAOYSA-N -1 3 346.858 4.131 20 0 EIADHM [O-]c1cc2ccccc2cc1-c1nc([C@@H]2COc3ccccc3O2)no1 ZINC000445468195 1028593906 /nfs/dbraw/zinc/59/39/06/1028593906.db2.gz DIBQKVSHUCRHOZ-SFHVURJKSA-N -1 3 346.342 4.108 20 0 EIADHM Cc1cc([C@@H](C)NC(=O)CCCc2ccc([O-])c(F)c2)c(C)s1 ZINC000468315168 1028726678 /nfs/dbraw/zinc/72/66/78/1028726678.db2.gz AALOXLICUMWGSP-GFCCVEGCSA-N -1 3 335.444 4.410 20 0 EIADHM O=S(=O)([N-]c1ccc(F)cc1Cl)c1ccc(Cl)cc1F ZINC000016129585 1028789160 /nfs/dbraw/zinc/78/91/60/1028789160.db2.gz JZURBVYAEHXLMV-UHFFFAOYSA-N -1 3 338.162 4.072 20 0 EIADHM CC[C@@H](Oc1cccc([O-])c1I)C(C)(C)C ZINC001227379714 1028936868 /nfs/dbraw/zinc/93/68/68/1028936868.db2.gz HMSXPBLLKYJELA-LLVKDONJSA-N -1 3 334.197 4.200 20 0 EIADHM CCN(CCOc1ccccc1C)[C@@H](C)c1cc(C(=O)[O-])c(C)o1 ZINC000583705179 1029064034 /nfs/dbraw/zinc/06/40/34/1029064034.db2.gz JNYOJMWMIPTBKX-AWEZNQCLSA-N -1 3 331.412 4.057 20 0 EIADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)C[C@@H](CC)C(C)C)c2)n1 ZINC000104273631 1029270493 /nfs/dbraw/zinc/27/04/93/1029270493.db2.gz MMFUALRUQQQNBS-CQSZACIVSA-N -1 3 341.455 4.010 20 0 EIADHM Cc1cc(F)ccc1S(=O)(=O)[N-]c1ccc(OC(C)(C)C)cc1 ZINC000525006912 1029379424 /nfs/dbraw/zinc/37/94/24/1029379424.db2.gz HYHBJPLYYHKKOI-UHFFFAOYSA-N -1 3 337.416 4.112 20 0 EIADHM Cc1cc(=O)[n-]c([C@H](C)N[C@@H](c2ccc(Cl)cc2F)C(C)C)n1 ZINC000192774974 1029387535 /nfs/dbraw/zinc/38/75/35/1029387535.db2.gz LMMBKRCIOSDFBG-MEDUHNTESA-N -1 3 337.826 4.331 20 0 EIADHM C[C@H](Oc1cccc(Cl)c1)C(=O)Nc1cc(Cl)ccc1[O-] ZINC000104862992 1029482650 /nfs/dbraw/zinc/48/26/50/1029482650.db2.gz LNOABAZSJNUCLO-VIFPVBQESA-N -1 3 326.179 4.105 20 0 EIADHM CC1(C2CC2)CCN([C@@H](C(=O)[O-])c2c(F)cccc2Cl)CC1 ZINC000584064856 1029586022 /nfs/dbraw/zinc/58/60/22/1029586022.db2.gz PJDHFDQPZAPAOR-OAHLLOKOSA-N -1 3 325.811 4.117 20 0 EIADHM C[C@H](c1ccc(Cl)cc1)N(C(=O)c1ccc(O)cc1[O-])C1CC1 ZINC000193233208 1029590381 /nfs/dbraw/zinc/59/03/81/1029590381.db2.gz AMFLULGMLZSYAP-LLVKDONJSA-N -1 3 331.799 4.117 20 0 EIADHM COc1cccc([C@H](C)CCCC(=O)Nc2cccc([O-])c2F)c1 ZINC000562590917 1029680522 /nfs/dbraw/zinc/68/05/22/1029680522.db2.gz PBBPAEOAOOWKKY-CYBMUJFWSA-N -1 3 331.387 4.452 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@@H](C)CCc3ccccc3)nc2)n1 ZINC000301189068 1029684177 /nfs/dbraw/zinc/68/41/77/1029684177.db2.gz VFIKNUCFXZMPAD-HNNXBMFYSA-N -1 3 348.450 4.240 20 0 EIADHM Cc1ccc(Cl)cc1N(C)C(=O)CCCc1ccc([O-])c(F)c1 ZINC000584251370 1029694007 /nfs/dbraw/zinc/69/40/07/1029694007.db2.gz MTQNWXDRHIBICB-UHFFFAOYSA-N -1 3 335.806 4.479 20 0 EIADHM Cc1ccc(C(=O)Nc2ccc(Cl)cc2[O-])c(Br)c1 ZINC000151824171 1029741803 /nfs/dbraw/zinc/74/18/03/1029741803.db2.gz JNCGPRPRSMITTE-UHFFFAOYSA-N -1 3 340.604 4.369 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N3CCC[C@@H](CC(C)C)C3)nc2)n1 ZINC000301661015 1029783401 /nfs/dbraw/zinc/78/34/01/1029783401.db2.gz XMFUXOFPXZFSBQ-HNNXBMFYSA-N -1 3 340.471 4.069 20 0 EIADHM CC[C@@H](c1ccncc1)N(C)Cc1nc2c3ccccc3oc2c(=O)[n-]1 ZINC000092225191 1029892433 /nfs/dbraw/zinc/89/24/33/1029892433.db2.gz QCWOXMPQQZYWKP-HNNXBMFYSA-N -1 3 348.406 4.060 20 0 EIADHM CCOc1cccc2cc([C@@H](C)NCc3cccc(C(=O)[O-])c3)oc21 ZINC000262946082 1029908230 /nfs/dbraw/zinc/90/82/30/1029908230.db2.gz AGDBCUAHYMBECC-CYBMUJFWSA-N -1 3 339.391 4.381 20 0 EIADHM [O-]c1cc(Cl)c(CN2CCC[C@H]2c2nccs2)c(Cl)c1 ZINC001142114772 1029974622 /nfs/dbraw/zinc/97/46/22/1029974622.db2.gz OAEOSAMLYTXURF-ZDUSSCGKSA-N -1 3 329.252 4.493 20 0 EIADHM CCCc1ncc(C(=O)[N-]c2c(C)noc2-c2ccccc2)s1 ZINC000183392569 1030006059 /nfs/dbraw/zinc/00/60/59/1030006059.db2.gz KIMMRFZEEOOQEE-UHFFFAOYSA-N -1 3 327.409 4.311 20 0 EIADHM Cc1cc(=O)[n-]c([C@H](C)Sc2nc(C(C)C)nc3ccccc32)n1 ZINC000447329129 1030012720 /nfs/dbraw/zinc/01/27/20/1030012720.db2.gz HMXWTTNWWSABOJ-LBPRGKRZSA-N -1 3 340.452 4.411 20 0 EIADHM O=C([O-])c1ccccc1OCCN1CCC[C@H]1c1ccccc1Cl ZINC000183914305 1030043445 /nfs/dbraw/zinc/04/34/45/1030043445.db2.gz OQAOYUACJVQPAE-KRWDZBQOSA-N -1 3 345.826 4.254 20 0 EIADHM CN(Cc1cccc2c1OCO2)Cc1c(Cl)cc([O-])cc1Cl ZINC001142122244 1030095620 /nfs/dbraw/zinc/09/56/20/1030095620.db2.gz QZTNHXIRXUUHDA-UHFFFAOYSA-N -1 3 340.206 4.060 20 0 EIADHM Cc1ccc(-c2nc(NC(=O)c3ccccc3SC(C)C)n[n-]2)o1 ZINC000185423767 1030153667 /nfs/dbraw/zinc/15/36/67/1030153667.db2.gz CVJDJSHRSIBMKO-UHFFFAOYSA-N -1 3 342.424 4.126 20 0 EIADHM C[C@@H]1CC(C(=O)[O-])C[C@@H](C)N1Cc1coc(-c2cccc(Cl)c2)n1 ZINC000530178217 1030202437 /nfs/dbraw/zinc/20/24/37/1030202437.db2.gz HNQVOAZOPULLKO-VXGBXAGGSA-N -1 3 348.830 4.069 20 0 EIADHM CCc1ccc([O-])c(C(=O)N2CCC(F)(c3ccccc3)CC2)c1 ZINC000447613116 1030213306 /nfs/dbraw/zinc/21/33/06/1030213306.db2.gz XVVQCHISDFNKOD-UHFFFAOYSA-N -1 3 327.399 4.056 20 0 EIADHM CN(C(=O)CCCc1ccc([O-])c(F)c1)[C@@H]1CCCc2ccccc21 ZINC000527038308 1030422087 /nfs/dbraw/zinc/42/20/87/1030422087.db2.gz FLWKTDNASIBHGE-LJQANCHMSA-N -1 3 341.426 4.390 20 0 EIADHM C[C@H](CCC1CCCCC1)NC(=O)c1c[n-]c2ccccc2c1=O ZINC000115445489 1030679582 /nfs/dbraw/zinc/67/95/82/1030679582.db2.gz AINQEHLWYPVIDG-CQSZACIVSA-N -1 3 326.440 4.007 20 0 EIADHM Cc1nc(CC2CC2)oc1C(=O)[N-]c1c(F)cc(Cl)cc1F ZINC000475822007 1030698886 /nfs/dbraw/zinc/69/88/86/1030698886.db2.gz QKXCTJCRAJZVTN-UHFFFAOYSA-N -1 3 326.730 4.119 20 0 EIADHM COc1ccc2oc([C@H](C)NCc3cccc(C(=O)[O-])c3)c(C)c2c1 ZINC000263446254 1030872867 /nfs/dbraw/zinc/87/28/67/1030872867.db2.gz XXWGNJJELBFTSD-ZDUSSCGKSA-N -1 3 339.391 4.299 20 0 EIADHM CCCOc1ccc([C@H](C)NCc2ccc(C(=O)[O-])cc2)cc1OC ZINC000263479457 1030886291 /nfs/dbraw/zinc/88/62/91/1030886291.db2.gz NNYJQFKGBMJCDP-AWEZNQCLSA-N -1 3 343.423 4.033 20 0 EIADHM O=C(Nc1cc(F)ccc1[O-])c1ccccc1COc1ccccc1 ZINC000531133774 1030893275 /nfs/dbraw/zinc/89/32/75/1030893275.db2.gz WLLHMBCLYFWPTB-UHFFFAOYSA-N -1 3 337.350 4.363 20 0 EIADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)[C@]3(C)CCC[C@@H]3C)c2)n1 ZINC000448724383 1030989423 /nfs/dbraw/zinc/98/94/23/1030989423.db2.gz KZTBWRVIZDBOLZ-RNODOKPDSA-N -1 3 339.439 4.176 20 0 EIADHM Cc1ccccc1[C@H](C(C)C)N(C)C(=O)Cc1ccc([O-])c(F)c1 ZINC000448962202 1031326754 /nfs/dbraw/zinc/32/67/54/1031326754.db2.gz PSMNUDMNHIIDLR-FQEVSTJZSA-N -1 3 329.415 4.238 20 0 EIADHM CCCC[C@@H](CC)CN1CCC12CN(C(=O)c1ccc([S-])cc1)C2 ZINC001272017411 1031383075 /nfs/dbraw/zinc/38/30/75/1031383075.db2.gz VCDCOSFJZFSALB-MRXNPFEDSA-N -1 3 346.540 4.092 20 0 EIADHM Cc1ccc(C(=O)CCCC(=O)Nc2cc(Cl)ccc2[O-])cc1 ZINC000487531878 1031498184 /nfs/dbraw/zinc/49/81/84/1031498184.db2.gz FCTJDIXJNDCIEA-UHFFFAOYSA-N -1 3 331.799 4.346 20 0 EIADHM CCSCc1cccc(NC(=O)c2c[n-]c3ccccc3c2=O)c1 ZINC000129665193 1031809135 /nfs/dbraw/zinc/80/91/35/1031809135.db2.gz MOOIZWNMUWONHK-UHFFFAOYSA-N -1 3 338.432 4.034 20 0 EIADHM C[C@@H](c1cccc(Br)c1)[S@](=O)c1ccc([O-])cc1 ZINC000129808851 1031813682 /nfs/dbraw/zinc/81/36/82/1031813682.db2.gz JADDSIKKSNIGPW-XTZNXHDOSA-N -1 3 325.227 4.024 20 0 EIADHM C[C@H](NCc1cc(=O)[n-]c(C2CC2)n1)c1ccc(Cl)cc1Cl ZINC000459352880 1031893576 /nfs/dbraw/zinc/89/35/76/1031893576.db2.gz SJOHQLOSDTUPJP-VIFPVBQESA-N -1 3 338.238 4.217 20 0 EIADHM CC(C)Sc1ccccc1[N-]C(=O)c1scc2c1OCCO2 ZINC000653697258 1032010617 /nfs/dbraw/zinc/01/06/17/1032010617.db2.gz GVEIITHCLBMLKU-UHFFFAOYSA-N -1 3 335.450 4.272 20 0 EIADHM Cc1ccc(C(=O)Nc2ccc(C)c(NC(=O)C(C)(C)C)c2)c([O-])c1 ZINC000110462840 1033323693 /nfs/dbraw/zinc/32/36/93/1033323693.db2.gz FSCWWLAHJUKUPR-UHFFFAOYSA-N -1 3 340.423 4.246 20 0 EIADHM [O-]c1cccc(CNCc2ccc(Br)c(F)c2)c1Cl ZINC000645151874 1033860551 /nfs/dbraw/zinc/86/05/51/1033860551.db2.gz YPFLWGBZLQAHBZ-UHFFFAOYSA-N -1 3 344.611 4.237 20 0 EIADHM C[C@@H](NCc1cccc([O-])c1Cl)c1ccc(-n2cccn2)cc1 ZINC000645159728 1033897707 /nfs/dbraw/zinc/89/77/07/1033897707.db2.gz HWEKZJLYCTXNST-CYBMUJFWSA-N -1 3 327.815 4.082 20 0 EIADHM CN(C)Cc1cc(NCc2cccc([O-])c2Cl)ccc1Cl ZINC000645178073 1033989624 /nfs/dbraw/zinc/98/96/24/1033989624.db2.gz RZTHDHKUTMQJDX-UHFFFAOYSA-N -1 3 325.239 4.373 20 0 EIADHM C[C@H](Oc1ccc(F)cc1Cl)C(=O)Nc1cc(Cl)ccc1[O-] ZINC000500950689 1034399659 /nfs/dbraw/zinc/39/96/59/1034399659.db2.gz OLOAJXOAJFPXMX-QMMMGPOBSA-N -1 3 344.169 4.244 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2ccc(C)c(OC(F)F)c2)c(C)c1 ZINC000513389601 1034908070 /nfs/dbraw/zinc/90/80/70/1034908070.db2.gz JWNJETAUASVSBQ-UHFFFAOYSA-N -1 3 341.379 4.014 20 0 EIADHM CCCOc1ccc(-c2nc3cc(C(F)(F)F)ccc3c(=O)[n-]2)cc1 ZINC000501067655 1035367387 /nfs/dbraw/zinc/36/73/87/1035367387.db2.gz IJXXMXFCRDCOCN-UHFFFAOYSA-N -1 3 348.324 4.398 20 0 EIADHM CCc1ccc(-c2nc(-c3ccc(Br)cc3)no2)c([O-])c1 ZINC000904712981 1035538423 /nfs/dbraw/zinc/53/84/23/1035538423.db2.gz DWLJZLWDLUNDMX-UHFFFAOYSA-N -1 3 345.196 4.434 20 0 EIADHM O=C(Nc1cc(Br)ccc1[O-])c1cc(F)ccc1Cl ZINC000490666705 1035586030 /nfs/dbraw/zinc/58/60/30/1035586030.db2.gz AXWJUVSNJMQAEK-UHFFFAOYSA-N -1 3 344.567 4.200 20 0 EIADHM CC(C)c1ccc([C@@H](CC(=O)[O-])NCc2cnc(C3CC3)s2)cc1 ZINC000575025956 1035656219 /nfs/dbraw/zinc/65/62/19/1035656219.db2.gz HAPKKJDHLIGSKJ-QGZVFWFLSA-N -1 3 344.480 4.450 20 0 EIADHM Cc1cccc(NC(=O)c2c[n-]c(=NC(=O)OC(C)(C)C)s2)c1C ZINC000905026642 1035717440 /nfs/dbraw/zinc/71/74/40/1035717440.db2.gz ZXNYCXPUGWORJT-UHFFFAOYSA-N -1 3 347.440 4.359 20 0 EIADHM COC(=O)c1ccc(-c2nc3cc(Cl)c(Cl)cc3c(=O)[n-]2)cc1 ZINC000485364760 1035842756 /nfs/dbraw/zinc/84/27/56/1035842756.db2.gz ZRXIURJHDICWLI-UHFFFAOYSA-N -1 3 349.173 4.096 20 0 EIADHM COc1ccc([C@@H](C)NCc2ccc(C(=O)[O-])c(Cl)c2)cc1C ZINC000905769126 1035891529 /nfs/dbraw/zinc/89/15/29/1035891529.db2.gz CJIRPRQQAAJIBV-GFCCVEGCSA-N -1 3 333.815 4.206 20 0 EIADHM CC(C)Oc1ccc([C@@H](C)NC(=O)c2cc([O-])ccc2Cl)cc1 ZINC000571212399 1036016886 /nfs/dbraw/zinc/01/68/86/1036016886.db2.gz WVFFSVVQXVLBLK-GFCCVEGCSA-N -1 3 333.815 4.324 20 0 EIADHM COc1cccc(C=Cc2cc(=O)[n-]c(C3CC3)n2)c1OC(C)C ZINC000485980369 1036404052 /nfs/dbraw/zinc/40/40/52/1036404052.db2.gz GPGRYNKQTSICSU-KTKRTIGZSA-N -1 3 326.396 4.026 20 0 EIADHM O=c1cc(C=Cc2csc(-c3ccsc3)n2)nc(C2CC2)[n-]1 ZINC000485977061 1036405544 /nfs/dbraw/zinc/40/55/44/1036405544.db2.gz MMSQHNJQBSVVTL-ONEGZZNKSA-N -1 3 327.434 4.415 20 0 EIADHM C[C@@H]1CC[C@H](C(=O)[O-])[C@H](C)N1CCc1cc(Cl)cc(Cl)c1 ZINC000572379851 1036499970 /nfs/dbraw/zinc/49/99/70/1036499970.db2.gz RWOGKDCAHAVLTN-ZETOZRRWSA-N -1 3 330.255 4.110 20 0 EIADHM CO[C@H](C)c1cccc([N-]S(=O)(=O)c2c(C)cc(C)cc2C)c1 ZINC000588833390 1036563880 /nfs/dbraw/zinc/56/38/80/1036563880.db2.gz LSUZPZVSGRFRED-OAHLLOKOSA-N -1 3 333.453 4.120 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1cc(F)ccc1Br ZINC000588925565 1036604317 /nfs/dbraw/zinc/60/43/17/1036604317.db2.gz HDYCLALYWUWTIT-UHFFFAOYSA-N -1 3 344.567 4.200 20 0 EIADHM c1sc([N-]c2ncnc3ccncc32)nc1-c1ccc2c(c1)CCC2 ZINC000502742773 1036607589 /nfs/dbraw/zinc/60/75/89/1036607589.db2.gz YWYPVEXMZKFRNB-UHFFFAOYSA-N -1 3 345.431 4.381 20 0 EIADHM CCCCOc1ccc([N-]S(=O)(=O)c2ccccc2C)c(C)c1 ZINC000589434027 1036799439 /nfs/dbraw/zinc/79/94/39/1036799439.db2.gz YOVJRTVYKFWGGF-UHFFFAOYSA-N -1 3 333.453 4.283 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)N1CCC[C@@H](CC(F)(F)F)C1 ZINC000421955397 1036868829 /nfs/dbraw/zinc/86/88/29/1036868829.db2.gz HLWCMZTZZSOZAV-ZDUSSCGKSA-N -1 3 347.352 4.045 20 0 EIADHM O=C([O-])C[C@@H](NCc1ccc(Cl)c(Cl)c1)c1cccs1 ZINC000037087855 1036971085 /nfs/dbraw/zinc/97/10/85/1036971085.db2.gz QILQLVAUGMGVJC-GFCCVEGCSA-N -1 3 330.236 4.361 20 0 EIADHM CSc1ccc([O-])c(C(=O)N(CCc2cccc(F)c2)C2CC2)c1 ZINC000668752357 1037034185 /nfs/dbraw/zinc/03/41/85/1037034185.db2.gz JSTLVKSZQSTSGR-UHFFFAOYSA-N -1 3 345.439 4.101 20 0 EIADHM CC[C@@H](CSc1ccccc1)NC(=O)c1cc([O-])ccc1Cl ZINC000487974788 1037316514 /nfs/dbraw/zinc/31/65/14/1037316514.db2.gz BXDUZQJRJYHMNZ-LBPRGKRZSA-N -1 3 335.856 4.346 20 0 EIADHM CC(C)(C(=O)[O-])[C@@H]1CCCN(Cc2ccc(Cl)cc2Cl)C1 ZINC000157989801 1037351935 /nfs/dbraw/zinc/35/19/35/1037351935.db2.gz DKDATFFPVOVKLS-GFCCVEGCSA-N -1 3 330.255 4.316 20 0 EIADHM O=c1cc(Nc2cccc(OCC(F)(F)F)c2)[n-]n1-c1ccccc1 ZINC001212167460 1037365337 /nfs/dbraw/zinc/36/53/37/1037365337.db2.gz XUYDJXOAUQWYIX-UHFFFAOYSA-N -1 3 349.312 4.263 20 0 EIADHM O=C(CCCCCc1ccc(O)cc1)Nc1cc(Cl)ccc1[O-] ZINC000591442143 1037432537 /nfs/dbraw/zinc/43/25/37/1037432537.db2.gz ZAABPKHKZZVPPT-UHFFFAOYSA-N -1 3 333.815 4.493 20 0 EIADHM Cc1ccc2oc(C(=O)[N-]c3cc([N+](=O)[O-])c(F)cc3F)cc2c1 ZINC000058087451 1037483960 /nfs/dbraw/zinc/48/39/60/1037483960.db2.gz VZFMHMNDVVYMGY-UHFFFAOYSA-N -1 3 332.262 4.180 20 0 EIADHM O=C(CCCC1CCCC1)NCc1ccc([O-])c(Br)c1 ZINC000488678170 1037713685 /nfs/dbraw/zinc/71/36/85/1037713685.db2.gz NPCJYEMIRISFCP-UHFFFAOYSA-N -1 3 340.261 4.131 20 0 EIADHM CCc1cccc(CC)c1S(=O)(=O)[N-]c1cc(F)c(F)cc1F ZINC000605495879 1037823994 /nfs/dbraw/zinc/82/39/94/1037823994.db2.gz SCMBYZUPZISQHG-UHFFFAOYSA-N -1 3 343.370 4.030 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)c1cccc(Nc2ccccc2)c1 ZINC000606536719 1038150059 /nfs/dbraw/zinc/15/00/59/1038150059.db2.gz VSLCJYXFBPTBKN-UHFFFAOYSA-N -1 3 336.366 4.205 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)c1cc2c(ccc3ccccc23)[nH]1 ZINC000606536920 1038151593 /nfs/dbraw/zinc/15/15/93/1038151593.db2.gz BVJAAGGVRCTASI-UHFFFAOYSA-N -1 3 334.350 4.096 20 0 EIADHM CC[C@@H](Oc1ccccc1C(C)C)C(=O)NCc1ccc([O-])c(F)c1 ZINC000606536910 1038154148 /nfs/dbraw/zinc/15/41/48/1038154148.db2.gz ZHNYIFGRRITRJO-GOSISDBHSA-N -1 3 345.414 4.129 20 0 EIADHM Cc1ccc(-c2ccsc2C(=O)NCc2ccc([O-])c(F)c2)cc1 ZINC000606536753 1038155467 /nfs/dbraw/zinc/15/54/67/1038155467.db2.gz AMGDFOUGBIDZBF-UHFFFAOYSA-N -1 3 341.407 4.498 20 0 EIADHM O=C(Nc1cc(F)ccc1[O-])c1cc2ccc(Br)cc2[nH]1 ZINC000533971336 1038768897 /nfs/dbraw/zinc/76/88/97/1038768897.db2.gz UNCNXXFQPWVHIT-UHFFFAOYSA-N -1 3 349.159 4.027 20 0 EIADHM O=C([O-])CC[C@@H]1CCCCN1Cc1ccc(F)cc1C(F)(F)F ZINC000322707457 1038825064 /nfs/dbraw/zinc/82/50/64/1038825064.db2.gz PZAMCIUPNAUKGZ-ZDUSSCGKSA-N -1 3 333.325 4.064 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2ccc(-c3ccccn3)cc2)c(C)c1 ZINC000555143296 1038891920 /nfs/dbraw/zinc/89/19/20/1038891920.db2.gz ZWCDXJOAPIINBD-UHFFFAOYSA-N -1 3 338.432 4.166 20 0 EIADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)[C@@H]3CCCC[C@@H]3C)c2)n1 ZINC000424597211 1038923057 /nfs/dbraw/zinc/92/30/57/1038923057.db2.gz HJRVDYJIKASBFU-SUMWQHHRSA-N -1 3 339.439 4.176 20 0 EIADHM Cn1c2ccccc2c(Cl)c1C(=O)Nc1cc(Cl)ccc1[O-] ZINC000533985299 1038944978 /nfs/dbraw/zinc/94/49/78/1038944978.db2.gz GBBPTOIFPLTAHC-UHFFFAOYSA-N -1 3 335.190 4.443 20 0 EIADHM Cc1cc(C(F)(F)F)ccc1CNC(=O)c1cc([O-])ccc1Cl ZINC000505097979 1038999300 /nfs/dbraw/zinc/99/93/00/1038999300.db2.gz HYRKDTIGNUSERD-UHFFFAOYSA-N -1 3 343.732 4.303 20 0 EIADHM CSc1ccc([O-])c(C(=O)N2CCC[C@@H]2Cc2ccc(F)cc2)c1 ZINC000666931287 1039042035 /nfs/dbraw/zinc/04/20/35/1039042035.db2.gz SVMGYVGSJJBTHI-OAHLLOKOSA-N -1 3 345.439 4.101 20 0 EIADHM CC(=O)c1cccc(NC(=O)[C@H]2C[C@H]2c2cccc3ccccc32)c1[O-] ZINC000552069843 1039091818 /nfs/dbraw/zinc/09/18/18/1039091818.db2.gz MFZPNVHAMXJGSM-OALUTQOASA-N -1 3 345.398 4.490 20 0 EIADHM CSc1ccc(S(=O)(=O)[N-]c2ccc(Cl)cc2F)cc1 ZINC000064467841 1039346934 /nfs/dbraw/zinc/34/69/34/1039346934.db2.gz LMRVOHNPTLAYBT-UHFFFAOYSA-N -1 3 331.821 4.002 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)N1CC2(CCC2)[C@@H]1c1ccco1 ZINC000456564678 1039461294 /nfs/dbraw/zinc/46/12/94/1039461294.db2.gz JWPSFBFUXVCEAA-IBGZPJMESA-N -1 3 343.398 4.201 20 0 EIADHM O=C(CCSc1ccc(F)cc1)Nc1ccc(Cl)cc1[O-] ZINC000534704430 1039713978 /nfs/dbraw/zinc/71/39/78/1039713978.db2.gz JPGDZNDZIPGCSH-UHFFFAOYSA-N -1 3 325.792 4.306 20 0 EIADHM COc1ccc2cccc(CC(=O)Nc3c([O-])cccc3Cl)c2c1 ZINC000552781594 1039817542 /nfs/dbraw/zinc/81/75/42/1039817542.db2.gz NLDRMPMZNOVANG-UHFFFAOYSA-N -1 3 341.794 4.389 20 0 EIADHM O=c1[n-]c(CSC[C@@H]2C[C@H]3C[C@H]3C2)nc2c3ccccc3oc21 ZINC000600577626 1039848223 /nfs/dbraw/zinc/84/82/23/1039848223.db2.gz HOOSJTNUHQCMCV-ZSBIGDGJSA-N -1 3 326.421 4.361 20 0 EIADHM O=C(CCOc1ccc(Cl)cc1Cl)Nc1cccc([O-])c1F ZINC000534945002 1039865663 /nfs/dbraw/zinc/86/56/63/1039865663.db2.gz RYCXGTCQSHRDTC-UHFFFAOYSA-N -1 3 344.169 4.246 20 0 EIADHM CCCCCOc1ccc(S(=O)(=O)[N-]c2ccc(OC)cc2)cc1 ZINC000063146546 1039907310 /nfs/dbraw/zinc/90/73/10/1039907310.db2.gz PEOXTNYAPGOTQP-UHFFFAOYSA-N -1 3 349.452 4.065 20 0 EIADHM CCc1cc(=O)[n-]c(CSCc2ncc(-c3ccccc3C)o2)n1 ZINC000535264835 1040113737 /nfs/dbraw/zinc/11/37/37/1040113737.db2.gz OUZNPPVHISXTKA-UHFFFAOYSA-N -1 3 341.436 4.141 20 0 EIADHM Cc1ccc([O-])c(C(=O)Nc2ccc(F)cc2OCC(F)(F)F)c1 ZINC000535321217 1040177831 /nfs/dbraw/zinc/17/78/31/1040177831.db2.gz KBYYSAIFTWYHRB-UHFFFAOYSA-N -1 3 343.276 4.033 20 0 EIADHM CCCc1cc(=O)[n-]c(C(=Cc2cn3cc(Cl)ccc3n2)CC)n1 ZINC000435338681 1040291773 /nfs/dbraw/zinc/29/17/73/1040291773.db2.gz IAKUMXYWCUWXLX-XYOKQWHBSA-N -1 3 342.830 4.386 20 0 EIADHM CCCc1cc(=O)[n-]c(C(=Cc2cccc(OC(F)F)c2)CC)n1 ZINC000435338207 1040292546 /nfs/dbraw/zinc/29/25/46/1040292546.db2.gz BCOMTYPWBSEXOE-LCYFTJDESA-N -1 3 334.366 4.274 20 0 EIADHM CCCc1cc(=O)[n-]c(C(=Cc2ccc(OCC)c(OC)c2)CC)n1 ZINC000435340754 1040294256 /nfs/dbraw/zinc/29/42/56/1040294256.db2.gz MSMKLHZYQLXRCP-PTNGSMBKSA-N -1 3 342.439 4.080 20 0 EIADHM Cc1ccc2cc(CN3CCC(C(=O)c4ccc([O-])cc4)CC3)[nH]c2c1 ZINC000667492934 1040373791 /nfs/dbraw/zinc/37/37/91/1040373791.db2.gz AUEFVPFCKGAWIZ-UHFFFAOYSA-N -1 3 348.446 4.277 20 0 EIADHM Cc1cccc2[nH]c(CN3CCC(C(=O)c4ccc([O-])cc4)CC3)cc21 ZINC000667493619 1040379623 /nfs/dbraw/zinc/37/96/23/1040379623.db2.gz YRQSLLPIGSXCMH-UHFFFAOYSA-N -1 3 348.446 4.277 20 0 EIADHM CCc1cc(=O)[n-]c(CSCc2csc(Br)c2)n1 ZINC000477352805 1040429300 /nfs/dbraw/zinc/42/93/00/1040429300.db2.gz REFZDQLDVJVDJQ-UHFFFAOYSA-N -1 3 345.287 4.002 20 0 EIADHM O=C(CO[C@H]1CCCc2ccccc21)Nc1cc(Cl)ccc1[O-] ZINC000435760536 1040602705 /nfs/dbraw/zinc/60/27/05/1040602705.db2.gz KTOIYIULUFEWOP-KRWDZBQOSA-N -1 3 331.799 4.078 20 0 EIADHM O=C(CO[C@H]1CCCc2ccccc21)Nc1ccc(Cl)cc1[O-] ZINC000435796358 1040617522 /nfs/dbraw/zinc/61/75/22/1040617522.db2.gz IKLNYNSUOWSGMP-KRWDZBQOSA-N -1 3 331.799 4.078 20 0 EIADHM Cc1cc(S(=O)(=O)[N-]c2ccc(OCC3CC3)cc2)cc(C)c1F ZINC000460822329 1040956992 /nfs/dbraw/zinc/95/69/92/1040956992.db2.gz LDYYDDIACCGXFG-UHFFFAOYSA-N -1 3 349.427 4.032 20 0 EIADHM CC(C)(C)c1ccccc1S(=O)(=O)[N-]c1ccc2c(c1)CCCO2 ZINC000460826134 1040961559 /nfs/dbraw/zinc/96/15/59/1040961559.db2.gz DCWPKNRKGHRMTO-UHFFFAOYSA-N -1 3 345.464 4.110 20 0 EIADHM CC(C)c1ccc([C@H](CC(=O)[O-])NCc2cc3cccnc3o2)cc1 ZINC000904001946 1041246595 /nfs/dbraw/zinc/24/65/95/1041246595.db2.gz KMDKWPZMGAGCML-SFHVURJKSA-N -1 3 338.407 4.257 20 0 EIADHM CC(F)(F)CC(=O)[N-][C@H](c1ccc(F)c(Cl)c1)C(F)(F)F ZINC000436468980 1041267679 /nfs/dbraw/zinc/26/76/79/1041267679.db2.gz KNAPFDYONFGKCL-SNVBAGLBSA-N -1 3 333.659 4.244 20 0 EIADHM O=C([O-])[C@@H]1CC=C[C@@H](NCc2ccc(-c3ccc(Cl)cc3)o2)C1 ZINC000904037429 1041284944 /nfs/dbraw/zinc/28/49/44/1041284944.db2.gz ZIEAWOYPRJZIJE-UKRRQHHQSA-N -1 3 331.799 4.109 20 0 EIADHM O=C(NN=c1[n-]c(Cl)c(Cl)cc1Cl)Nc1ccccc1 ZINC000048389041 1041290389 /nfs/dbraw/zinc/29/03/89/1041290389.db2.gz CYBPAAYTQKWIRL-UHFFFAOYSA-N -1 3 331.590 4.190 20 0 EIADHM CC(C)(C)c1cnc(CN[C@H](CCc2ccccc2)CC(=O)[O-])s1 ZINC000904039765 1041293807 /nfs/dbraw/zinc/29/38/07/1041293807.db2.gz CBLHXZVQVPKNQA-OAHLLOKOSA-N -1 3 346.496 4.006 20 0 EIADHM Cc1cccc([C@@H](CC(=O)[O-])NCc2cnc(C3CCCC3)s2)c1 ZINC000904046201 1041300593 /nfs/dbraw/zinc/30/05/93/1041300593.db2.gz XGAFFFMLJMYBBE-QGZVFWFLSA-N -1 3 344.480 4.415 20 0 EIADHM O=C([O-])Cc1ccc(CCNCc2cc(Cl)sc2Cl)cc1 ZINC000904057454 1041311331 /nfs/dbraw/zinc/31/13/31/1041311331.db2.gz RFYXXTXQKLXQFU-UHFFFAOYSA-N -1 3 344.263 4.014 20 0 EIADHM COc1ccc(C(=O)N(C)[C@H](c2ccccc2C)C(C)C)c([O-])c1 ZINC000436549195 1041326159 /nfs/dbraw/zinc/32/61/59/1041326159.db2.gz UDUSNXWTHBSRML-IBGZPJMESA-N -1 3 327.424 4.179 20 0 EIADHM CC(C)N(Cc1cccc(Br)c1)C(=O)c1ccccc1[O-] ZINC000436554364 1041329403 /nfs/dbraw/zinc/32/94/03/1041329403.db2.gz KRKBJZKKFGJNBL-UHFFFAOYSA-N -1 3 348.240 4.206 20 0 EIADHM COc1ccc(N(C(=O)c2ccc(C)c(C)c2[O-])[C@@H](C)C2CC2)cc1 ZINC000436539393 1041333622 /nfs/dbraw/zinc/33/36/22/1041333622.db2.gz YDMXIUPQXVPYKR-HNNXBMFYSA-N -1 3 339.435 4.463 20 0 EIADHM Cc1cccc(CN(C)C(=O)c2cc(Oc3ccccc3)ccc2[O-])n1 ZINC000436560319 1041340835 /nfs/dbraw/zinc/34/08/35/1041340835.db2.gz AYZHIIJZRLDAMN-UHFFFAOYSA-N -1 3 348.402 4.160 20 0 EIADHM O=C(CCCc1ccc2ccccc2c1)Nc1n[n-]c(-c2ccco2)n1 ZINC000538425408 1041347830 /nfs/dbraw/zinc/34/78/30/1041347830.db2.gz ZJPQMFCYSFXDKF-UHFFFAOYSA-N -1 3 346.390 4.179 20 0 EIADHM Cc1ccc(CN(C)C(=O)c2cc(CCc3ccccc3)ccc2[O-])o1 ZINC000436593407 1041351333 /nfs/dbraw/zinc/35/13/33/1041351333.db2.gz BKRVWGJKFKZOBK-UHFFFAOYSA-N -1 3 349.430 4.351 20 0 EIADHM COc1ccc(C(=O)N(C)[C@H]2CCC[C@@H]2c2ccc(C)cc2)c([O-])c1 ZINC000436591720 1041352281 /nfs/dbraw/zinc/35/22/81/1041352281.db2.gz RDQARSDKHGXNDB-MJGOQNOKSA-N -1 3 339.435 4.118 20 0 EIADHM CN(Cc1ccoc1)C(=O)c1cc(CCc2ccccc2)ccc1[O-] ZINC000436611560 1041373103 /nfs/dbraw/zinc/37/31/03/1041373103.db2.gz OSXXNHKHPHFYAN-UHFFFAOYSA-N -1 3 335.403 4.043 20 0 EIADHM Cc1ccc(C(=O)N2CC[C@](F)(c3cccc(Cl)c3)C2)c([O-])c1 ZINC000436627660 1041379780 /nfs/dbraw/zinc/37/97/80/1041379780.db2.gz URSPMLGPIOYWQT-GOSISDBHSA-N -1 3 333.790 4.065 20 0 EIADHM C[C@@H]1CSCCN(C(=O)c2cc(Oc3ccccc3)ccc2[O-])C1 ZINC000436727890 1041451864 /nfs/dbraw/zinc/45/18/64/1041451864.db2.gz DVRAHBUDYOCHCZ-AWEZNQCLSA-N -1 3 343.448 4.010 20 0 EIADHM COC[C@@H](C)Oc1ccc(Cl)cc1NC(=O)c1cc(C)ccc1[O-] ZINC000436822963 1041500895 /nfs/dbraw/zinc/50/08/95/1041500895.db2.gz YTPINXKGGQIDBG-GFCCVEGCSA-N -1 3 349.814 4.020 20 0 EIADHM O=C(c1ccccc1[O-])N1CC[C@H](c2cccc(C(F)(F)F)c2)C1 ZINC000436854698 1041507739 /nfs/dbraw/zinc/50/77/39/1041507739.db2.gz TWFUWNRELPLHSI-ZDUSSCGKSA-N -1 3 335.325 4.041 20 0 EIADHM CCc1ccc(-c2nc(Cc3ccccc3OC(F)F)no2)c([O-])c1 ZINC000436841885 1041508962 /nfs/dbraw/zinc/50/89/62/1041508962.db2.gz BNLPLFRRGDYLDX-UHFFFAOYSA-N -1 3 346.333 4.197 20 0 EIADHM O=C([O-])[C@H]1CCCN(Cc2ccc(Oc3ccccc3F)c(F)c2)C1 ZINC000463334625 1041510348 /nfs/dbraw/zinc/51/03/48/1041510348.db2.gz JJCKLNDVLSZGSN-AWEZNQCLSA-N -1 3 347.361 4.054 20 0 EIADHM CCc1ccc(-c2nc(-c3ccc(Cl)cc3OC)no2)c([O-])c1 ZINC000436880294 1041537551 /nfs/dbraw/zinc/53/75/51/1041537551.db2.gz NBNNAGGKZVAXLP-UHFFFAOYSA-N -1 3 330.771 4.334 20 0 EIADHM COc1cc(-c2nc(-c3ccc4ccccc4c3)no2)cc(OC)c1[O-] ZINC000436883793 1041541018 /nfs/dbraw/zinc/54/10/18/1041541018.db2.gz HSEURJIBUDLBJS-UHFFFAOYSA-N -1 3 348.358 4.280 20 0 EIADHM [O-]c1ccccc1-c1nc(Cc2nc3cc(Cl)ccc3s2)no1 ZINC000436885707 1041542221 /nfs/dbraw/zinc/54/22/21/1041542221.db2.gz DOGRPUCICMRYIT-UHFFFAOYSA-N -1 3 343.795 4.296 20 0 EIADHM COC(=O)c1cccc(-c2noc(-c3cc4ccccc4cc3[O-])n2)c1 ZINC000436886844 1041542597 /nfs/dbraw/zinc/54/25/97/1041542597.db2.gz LZXKQCDWRGIDNO-UHFFFAOYSA-N -1 3 346.342 4.049 20 0 EIADHM COc1ccc(OCc2noc(-c3cc4ccccc4cc3[O-])n2)cc1 ZINC000436890949 1041543608 /nfs/dbraw/zinc/54/36/08/1041543608.db2.gz DRVQIPDBZZKYHF-UHFFFAOYSA-N -1 3 348.358 4.183 20 0 EIADHM COc1ccc([O-])c(-c2nc(COc3ccc4ccccc4c3)no2)c1 ZINC000436912166 1041550030 /nfs/dbraw/zinc/55/00/30/1041550030.db2.gz WRRNRPDSNNGDKG-UHFFFAOYSA-N -1 3 348.358 4.183 20 0 EIADHM [O-]c1ccc(Cc2ccccc2)cc1-c1nc(Cc2ccccn2)no1 ZINC000436898608 1041551619 /nfs/dbraw/zinc/55/16/19/1041551619.db2.gz ZAFNERGVVNXBEI-UHFFFAOYSA-N -1 3 343.386 4.019 20 0 EIADHM Cc1ccccc1OCc1noc(-c2cc3ccccc3cc2[O-])n1 ZINC000436936284 1041565745 /nfs/dbraw/zinc/56/57/45/1041565745.db2.gz AOBBUIZGAUMFGO-UHFFFAOYSA-N -1 3 332.359 4.483 20 0 EIADHM CCOc1cccc2cc([C@H](C)NC(=O)c3ccccc3[O-])oc21 ZINC000436998768 1041594287 /nfs/dbraw/zinc/59/42/87/1041594287.db2.gz YZAXRGATUIWQMD-LBPRGKRZSA-N -1 3 325.364 4.028 20 0 EIADHM C[C@@H](CC(=O)NCc1ccc([O-])c(F)c1)Cc1ccc(Cl)cc1 ZINC000539023432 1041612369 /nfs/dbraw/zinc/61/23/69/1041612369.db2.gz DEKQAEYEQJHOBW-GFCCVEGCSA-N -1 3 335.806 4.070 20 0 EIADHM C[C@@H](NC(=O)c1cc([O-])ccc1Cl)c1cc2cccc(F)c2o1 ZINC000505985879 1041681750 /nfs/dbraw/zinc/68/17/50/1041681750.db2.gz DAUDVZMRZIZLKY-SECBINFHSA-N -1 3 333.746 4.422 20 0 EIADHM O=S(=O)([N-][C@H](c1ccccc1)C1CCC1)c1ccc(Cl)s1 ZINC000517086320 1041863229 /nfs/dbraw/zinc/86/32/29/1041863229.db2.gz BZIBPHNBZMEXRP-OAHLLOKOSA-N -1 3 341.885 4.221 20 0 EIADHM Cc1cccc([N-]S(=O)(=O)c2ccccc2-c2ccno2)c1Cl ZINC000542005730 1042227420 /nfs/dbraw/zinc/22/74/20/1042227420.db2.gz NVQLKJBWLPSYSG-UHFFFAOYSA-N -1 3 348.811 4.104 20 0 EIADHM CC(=O)c1ccc([O-])c(O[C@@H](C)c2ccc(Br)cc2)c1 ZINC001225994889 1042319222 /nfs/dbraw/zinc/31/92/22/1042319222.db2.gz OVBUTKXNZLVSAM-NSHDSACASA-N -1 3 335.197 4.497 20 0 EIADHM Cc1cccc(C)c1NCC(=O)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000473595356 1042402300 /nfs/dbraw/zinc/40/23/00/1042402300.db2.gz YXJRFOATBVMLCQ-UHFFFAOYSA-N -1 3 338.329 4.078 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])[C@H]1C[C@@]12CCCc1ccccc12 ZINC000439093542 1042495988 /nfs/dbraw/zinc/49/59/88/1042495988.db2.gz HNIBXRLQRXYHFE-DNVCBOLYSA-N -1 3 327.811 4.278 20 0 EIADHM O=C(Nc1ccc([O-])c(-c2nc3ccccc3s2)c1)c1cccnc1 ZINC000000266858 1042565230 /nfs/dbraw/zinc/56/52/30/1042565230.db2.gz URZSKEXAKNFHTP-UHFFFAOYSA-N -1 3 347.399 4.316 20 0 EIADHM COc1ccc2cc([C@H](C)[S@@](=O)c3ccc([O-])cc3)ccc2c1 ZINC000439432903 1042622279 /nfs/dbraw/zinc/62/22/79/1042622279.db2.gz XAAIBOCGRKIXCW-ZAMGYDSWSA-N -1 3 326.417 4.423 20 0 EIADHM COc1ccc2cc([C@@H](C)[S@@](=O)c3ccc([O-])cc3)ccc2c1 ZINC000439432901 1042622459 /nfs/dbraw/zinc/62/24/59/1042622459.db2.gz XAAIBOCGRKIXCW-JCQPUDPBSA-N -1 3 326.417 4.423 20 0 EIADHM C[C@H](Oc1c(Cl)ccc([O-])c1F)c1ccc(Br)nc1 ZINC001234264754 1042882804 /nfs/dbraw/zinc/88/28/04/1042882804.db2.gz RTMPKGJETNCYMY-ZETCQYMHSA-N -1 3 346.583 4.482 20 0 EIADHM O=C([N-]c1cc(Cl)cc(F)c1F)c1noc2c1CCCCC2 ZINC000441577390 1042893981 /nfs/dbraw/zinc/89/39/81/1042893981.db2.gz UNELUNVZWZSTDB-UHFFFAOYSA-N -1 3 326.730 4.127 20 0 EIADHM CCc1ccc([O-])c(C(=O)Nc2cccc(-c3nc(C)c(C)[nH]3)c2)c1 ZINC000729526334 1043055358 /nfs/dbraw/zinc/05/53/58/1043055358.db2.gz YUQDMQCBJGEEFH-UHFFFAOYSA-N -1 3 335.407 4.214 20 0 EIADHM Cc1cc(=O)[n-]c([C@@H](C)N2CC[C@@H](Sc3cccc(Cl)c3)C2)n1 ZINC000429140701 1043078320 /nfs/dbraw/zinc/07/83/20/1043078320.db2.gz ZWECZSGEEWUALB-IUODEOHRSA-N -1 3 349.887 4.072 20 0 EIADHM Cc1ccc(NCc2cc([O-])cc(F)c2)cc1OCC1CCOCC1 ZINC000185551517 1043197581 /nfs/dbraw/zinc/19/75/81/1043197581.db2.gz IHIJWIDVHCUYMZ-UHFFFAOYSA-N -1 3 345.414 4.257 20 0 EIADHM O=S(=O)([N-]c1cc(-c2ccccc2)ccc1Cl)c1ccoc1 ZINC000507967880 1043210830 /nfs/dbraw/zinc/21/08/30/1043210830.db2.gz IHDKNIFJLDFZER-UHFFFAOYSA-N -1 3 333.796 4.401 20 0 EIADHM CC(C)[C@@H](CNC(=O)c1cc([O-])c2ccccc2c1)c1cccnc1 ZINC000525925551 1043234818 /nfs/dbraw/zinc/23/48/18/1043234818.db2.gz ACMYEBRKJNPHKV-LJQANCHMSA-N -1 3 334.419 4.110 20 0 EIADHM Cc1cccc(Cl)c1[N-]S(=O)(=O)c1ccccc1OC(F)F ZINC000185950971 1043235557 /nfs/dbraw/zinc/23/55/57/1043235557.db2.gz LBZTUFYNSWPICP-UHFFFAOYSA-N -1 3 347.770 4.051 20 0 EIADHM COc1ccc(Cl)c(NC(=O)c2cc([O-])c3ccccc3c2)c1 ZINC000526884888 1043243543 /nfs/dbraw/zinc/24/35/43/1043243543.db2.gz ABLSAHKIVVLHFL-UHFFFAOYSA-N -1 3 327.767 4.460 20 0 EIADHM COc1ccccc1C1(CNC(=O)c2cc([O-])c3ccccc3c2)CC1 ZINC000527163152 1043251845 /nfs/dbraw/zinc/25/18/45/1043251845.db2.gz YFRWJSDXLIUNDA-UHFFFAOYSA-N -1 3 347.414 4.016 20 0 EIADHM O=C(NC[C@H]1SCCc2ccccc21)c1cc([O-])c2ccccc2c1 ZINC000527166878 1043253314 /nfs/dbraw/zinc/25/33/14/1043253314.db2.gz UMYXMPIQJSBAKM-HXUWFJFHSA-N -1 3 349.455 4.306 20 0 EIADHM COc1ccc(CN(C)C(=O)c2cc([O-])c3ccccc3c2)cc1C ZINC000527449801 1043261474 /nfs/dbraw/zinc/26/14/74/1043261474.db2.gz FOULLNPGNPPGKZ-UHFFFAOYSA-N -1 3 335.403 4.135 20 0 EIADHM Cn1nc(-c2ccsc2)cc1NC(=O)c1cc([O-])c2ccccc2c1 ZINC000527474982 1043262251 /nfs/dbraw/zinc/26/22/51/1043262251.db2.gz UGKJKNXUYBTIDX-UHFFFAOYSA-N -1 3 349.415 4.260 20 0 EIADHM C[C@@H]1CN(C(=O)c2cc([O-])c3ccccc3c2)[C@H](c2ccccc2)CO1 ZINC000527467087 1043263397 /nfs/dbraw/zinc/26/33/97/1043263397.db2.gz CLGBJWCFUCWNSZ-QRWLVFNGSA-N -1 3 347.414 4.148 20 0 EIADHM Cc1cc2nc([N-]C(=O)c3cc(-c4ccccc4)no3)oc2c(C)c1 ZINC000674050846 1043353029 /nfs/dbraw/zinc/35/30/29/1043353029.db2.gz RWZDFJJZCNAGNJ-UHFFFAOYSA-N -1 3 333.347 4.352 20 0 EIADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)[C@H](C)C3CCCC3)c2)n1 ZINC000674082508 1043396356 /nfs/dbraw/zinc/39/63/56/1043396356.db2.gz HHONAIKJCQJTLO-CYBMUJFWSA-N -1 3 339.439 4.176 20 0 EIADHM CSc1ccncc1[N-]C(=O)c1csc(-c2ccccc2C)n1 ZINC000674258193 1043507230 /nfs/dbraw/zinc/50/72/30/1043507230.db2.gz GOBUGHSUKFSWMM-UHFFFAOYSA-N -1 3 341.461 4.488 20 0 EIADHM CS[C@H]1CCCCN([C@H](C(=O)[O-])c2ccc(Cl)c(Cl)c2)C1 ZINC000521257583 1043671264 /nfs/dbraw/zinc/67/12/64/1043671264.db2.gz MORSJIKHDANULL-FZMZJTMJSA-N -1 3 348.295 4.337 20 0 EIADHM CCOc1cc(CN2CCc3ccc(F)cc3C2)cc(Cl)c1[O-] ZINC000521415029 1043756789 /nfs/dbraw/zinc/75/67/89/1043756789.db2.gz XXRLSHSNZCXSBO-UHFFFAOYSA-N -1 3 335.806 4.142 20 0 EIADHM CCc1ccc([C@@H](NC(=O)c2nnc3ccccc3c2[O-])C(C)C)cc1 ZINC000731894149 1043842147 /nfs/dbraw/zinc/84/21/47/1043842147.db2.gz JOLCHGDJKIXYND-SFHVURJKSA-N -1 3 349.434 4.025 20 0 EIADHM C[C@H](c1ccc(Br)cc1)N1CCC[C@@H](CCC(=O)[O-])C1 ZINC000226454728 1044212464 /nfs/dbraw/zinc/21/24/64/1044212464.db2.gz WOKPHXNLUKKFIN-OLZOCXBDSA-N -1 3 340.261 4.087 20 0 EIADHM CCc1ccc([O-])c(C(=O)N(C)Cc2csc3ccccc23)c1 ZINC000499694611 1044227369 /nfs/dbraw/zinc/22/73/69/1044227369.db2.gz QHUCXJLZHPWVDS-UHFFFAOYSA-N -1 3 325.433 4.442 20 0 EIADHM O=[S@@](c1ccc([O-])cc1)[C@H]1CCc2c1cc(Cl)cc2Cl ZINC000443392008 1044244608 /nfs/dbraw/zinc/24/46/08/1044244608.db2.gz IZWDRRSLAYAVER-YWZLYKJASA-N -1 3 327.232 4.494 20 0 EIADHM CC(=O)c1cc(F)c(Br)cc1Nc1cccc([O-])c1F ZINC001212552222 1044290300 /nfs/dbraw/zinc/29/03/00/1044290300.db2.gz GUZTVWVZPBGBFS-UHFFFAOYSA-N -1 3 342.139 4.379 20 0 EIADHM Cc1cccc(CN(CC(C)C)C(=O)c2cc(=O)c3ccccc3[n-]2)c1 ZINC000346056633 1044310839 /nfs/dbraw/zinc/31/08/39/1044310839.db2.gz HAUCMTQVYYFDFF-UHFFFAOYSA-N -1 3 348.446 4.135 20 0 EIADHM Cc1nonc1C(=O)[N-]c1nc(-c2ccc(C(C)(C)C)cc2)cs1 ZINC000733872966 1044322597 /nfs/dbraw/zinc/32/25/97/1044322597.db2.gz BCUVEHOJICKMDM-UHFFFAOYSA-N -1 3 342.424 4.051 20 0 EIADHM CSc1cccc(F)c1C[N-]C(=O)C(F)(F)c1ccc(F)cc1 ZINC000804141234 1044725371 /nfs/dbraw/zinc/72/53/71/1044725371.db2.gz NLPSJZVUBYSRFU-UHFFFAOYSA-N -1 3 343.345 4.095 20 0 EIADHM CSc1cccc(F)c1CNC(=O)c1cc2sccc2c([O-])c1 ZINC000804141524 1044726562 /nfs/dbraw/zinc/72/65/62/1044726562.db2.gz CDQLUFXHSYNZHM-UHFFFAOYSA-N -1 3 347.436 4.398 20 0 EIADHM O=C(c1cc2sccc2c([O-])c1)N1CCC=C(c2ccco2)C1 ZINC000804184423 1044814136 /nfs/dbraw/zinc/81/41/36/1044814136.db2.gz BMJLYWWJPQQDGT-UHFFFAOYSA-N -1 3 325.389 4.129 20 0 EIADHM CN(C(=O)CCCc1ccc([O-])c(F)c1)c1ccc(F)c(Cl)c1 ZINC000469808834 1044850224 /nfs/dbraw/zinc/85/02/24/1044850224.db2.gz RVCITWIYHKBKKU-UHFFFAOYSA-N -1 3 339.769 4.310 20 0 EIADHM C[C@@H](OC(=O)c1cc2ccsc2[n-]1)C(=O)c1ccc2c(c1)CCC2 ZINC000914891500 1044853184 /nfs/dbraw/zinc/85/31/84/1044853184.db2.gz QVXIDNHFMOYIOI-LLVKDONJSA-N -1 3 339.416 4.146 20 0 EIADHM Cc1cc(Br)ccc1-c1noc(-c2ccccc2[O-])n1 ZINC000231698507 1044860137 /nfs/dbraw/zinc/86/01/37/1044860137.db2.gz KPTANFABPQKEDB-UHFFFAOYSA-N -1 3 331.169 4.180 20 0 EIADHM CC(C)(C)C[C@@H](NC(=O)c1cc(=O)c2ccccc2[n-]1)c1ccccc1 ZINC000053510527 1044900711 /nfs/dbraw/zinc/90/07/11/1044900711.db2.gz ZRCLIEWYIYUVOO-LJQANCHMSA-N -1 3 348.446 4.435 20 0 EIADHM CCCCCN(C(=O)c1cc(=O)c2ccccc2[n-]1)[C@H](C)CCC ZINC000509324002 1044964084 /nfs/dbraw/zinc/96/40/84/1044964084.db2.gz VFPUJPZWUDJQMC-OAHLLOKOSA-N -1 3 328.456 4.349 20 0 EIADHM Cc1noc2nc(C(C)C)cc(C(=O)Nc3cc(Cl)ccc3[O-])c12 ZINC000303441510 1045005473 /nfs/dbraw/zinc/00/54/73/1045005473.db2.gz YUZWQNYEUQTCLB-UHFFFAOYSA-N -1 3 345.786 4.266 20 0 EIADHM O=C([O-])[C@H](NCc1cccc(Oc2ccccc2)c1)c1ccccc1 ZINC000327498496 1045013186 /nfs/dbraw/zinc/01/31/86/1045013186.db2.gz OUEQUQWAGUEIAG-HXUWFJFHSA-N -1 3 333.387 4.394 20 0 EIADHM Cc1sc2[n-]c([C@@H](C)OC(=O)CCC(C)(C)C)nc(=O)c2c1C ZINC000738800221 1045092542 /nfs/dbraw/zinc/09/25/42/1045092542.db2.gz SJUYLPTTWQLPLW-SNVBAGLBSA-N -1 3 336.457 4.444 20 0 EIADHM CC(C)(C(=O)[O-])[C@H]1CCCN(Cc2c(Cl)cccc2Cl)C1 ZINC000135034049 1045195491 /nfs/dbraw/zinc/19/54/91/1045195491.db2.gz KMADWJXMFKCVLK-NSHDSACASA-N -1 3 330.255 4.316 20 0 EIADHM Cc1c(Cl)c(CN2CCCC[C@H]2CC(=O)[O-])nc2ccccc12 ZINC000390901338 1045201852 /nfs/dbraw/zinc/20/18/52/1045201852.db2.gz QRYXTVAHYCHGIE-ZDUSSCGKSA-N -1 3 332.831 4.026 20 0 EIADHM O=c1ccnc(C=Cc2cn(-c3ccccc3)nc2-c2cccs2)[n-]1 ZINC000742219625 1045638954 /nfs/dbraw/zinc/63/89/54/1045638954.db2.gz CZLOQENQWUEFEL-CMDGGOBGSA-N -1 3 346.415 4.267 20 0 EIADHM COc1ccc([C@@H](C)N(C)C(=O)c2cc3sccc3c([O-])c2)cc1 ZINC000791309766 1045725077 /nfs/dbraw/zinc/72/50/77/1045725077.db2.gz AOMZLTVNJRGQGA-GFCCVEGCSA-N -1 3 341.432 4.449 20 0 EIADHM O=C(c1cc2sccc2c([O-])c1)N1CCc2ccc(Cl)cc21 ZINC000791377959 1045726886 /nfs/dbraw/zinc/72/68/86/1045726886.db2.gz GPONNCQYPCKCLR-UHFFFAOYSA-N -1 3 329.808 4.463 20 0 EIADHM CC(=O)c1c(C)cc(C)c(CSCc2nc(C)cc(=O)[n-]2)c1C ZINC000763210730 1045749381 /nfs/dbraw/zinc/74/93/81/1045749381.db2.gz NLIQIWAPIAGFOY-UHFFFAOYSA-N -1 3 330.453 4.052 20 0 EIADHM Cc1cc(=O)[n-]c(CS[C@H](C)c2ccc(OC(F)F)cc2)n1 ZINC000763209442 1045749655 /nfs/dbraw/zinc/74/96/55/1045749655.db2.gz QKSTXEDHEMNYNS-SNVBAGLBSA-N -1 3 326.368 4.086 20 0 EIADHM Cc1cc(=O)[n-]c(CSCc2ncc(-c3cccc(Cl)c3)o2)n1 ZINC000763210106 1045751312 /nfs/dbraw/zinc/75/13/12/1045751312.db2.gz VIWQNTSNOZFSHU-UHFFFAOYSA-N -1 3 347.827 4.232 20 0 EIADHM CC(C)(C)c1nnc([N-]C(=O)c2cc(Cl)sc2Cl)s1 ZINC000055975626 1045770487 /nfs/dbraw/zinc/77/04/87/1045770487.db2.gz JRQLOWBQFCVFNG-UHFFFAOYSA-N -1 3 336.269 4.456 20 0 EIADHM O=C(N[C@@H](c1ccccc1)C1CCCC1)c1cc(=O)c2ccccc2[n-]1 ZINC000056095277 1045785149 /nfs/dbraw/zinc/78/51/49/1045785149.db2.gz ZNNXFKWNRKWHKL-NRFANRHFSA-N -1 3 346.430 4.189 20 0 EIADHM CCC(CC)c1nnc([N-]C(=O)c2cc(F)c(F)c(F)c2)s1 ZINC000075470276 1045825315 /nfs/dbraw/zinc/82/53/15/1045825315.db2.gz SLRRLVACTUYCEF-UHFFFAOYSA-N -1 3 329.347 4.111 20 0 EIADHM [O-]c1ccc(Nc2ccc(OC3CCOCC3)c(F)c2)c(F)c1F ZINC001212014031 1045835027 /nfs/dbraw/zinc/83/50/27/1045835027.db2.gz WCCPPABBACPLEF-UHFFFAOYSA-N -1 3 339.313 4.111 20 0 EIADHM CCc1ccc(O)c([N-]S(=O)(=O)/C=C/c2cccc(Cl)c2)c1 ZINC000768886152 1045853004 /nfs/dbraw/zinc/85/30/04/1045853004.db2.gz BINFNHRLWPXUSY-CMDGGOBGSA-N -1 3 337.828 4.021 20 0 EIADHM CCOc1ccc([C@@H](C)NC(=O)c2cc([O-])c3ccccc3c2)cc1 ZINC000792035788 1045854207 /nfs/dbraw/zinc/85/42/07/1045854207.db2.gz NJRKYCOEKFESGR-CQSZACIVSA-N -1 3 335.403 4.435 20 0 EIADHM CC(=O)Nc1ccc(NC(=O)c2cc([O-])c3ccccc3c2)cc1C ZINC000792052523 1045856803 /nfs/dbraw/zinc/85/68/03/1045856803.db2.gz TUGUIHNMOMXNOY-UHFFFAOYSA-N -1 3 334.375 4.065 20 0 EIADHM CN1CCCc2cc(NC(=O)c3cc([O-])c4ccccc4c3)ccc21 ZINC000792160173 1045869331 /nfs/dbraw/zinc/86/93/31/1045869331.db2.gz VNECGLMCYUFBOR-UHFFFAOYSA-N -1 3 332.403 4.180 20 0 EIADHM CCCOc1ccc([N-]S(=O)(=O)c2ccc(C)c(C)c2)c(C)c1 ZINC000614885260 1045921777 /nfs/dbraw/zinc/92/17/77/1045921777.db2.gz PSBWRTGLSNVYHJ-UHFFFAOYSA-N -1 3 333.453 4.201 20 0 EIADHM CCC[C@@H](NC(=O)c1cc([O-])c2ccccc2c1)[C@H](O)c1ccccc1 ZINC000792560781 1045934938 /nfs/dbraw/zinc/93/49/38/1045934938.db2.gz MVBMTQIWFVWWQK-TZIWHRDSSA-N -1 3 349.430 4.178 20 0 EIADHM CSc1ccc([O-])c(C(=O)N2CCC[C@@H]2CCc2ccccc2)c1 ZINC001626112990 1045984646 /nfs/dbraw/zinc/98/46/46/1045984646.db2.gz IDGRDXDRVWDWEG-MRXNPFEDSA-N -1 3 341.476 4.352 20 0 EIADHM O=C(c1ccccc1[O-])N1CCC[C@H]1c1ccccc1C(F)(F)F ZINC000769750553 1046069182 /nfs/dbraw/zinc/06/91/82/1046069182.db2.gz DCDJLZRZNXRYMX-HNNXBMFYSA-N -1 3 335.325 4.388 20 0 EIADHM CN(C(=O)c1cc2c(cc1[O-])OCO2)c1ccc(-c2ccccc2)cc1 ZINC000769928822 1046114954 /nfs/dbraw/zinc/11/49/54/1046114954.db2.gz QGQCLFDHDDCZMB-UHFFFAOYSA-N -1 3 347.370 4.065 20 0 EIADHM O=C([N-]c1nc(-c2ccccc2)co1)c1cc(-c2ccc(F)cc2)no1 ZINC001272113242 1046165746 /nfs/dbraw/zinc/16/57/46/1046165746.db2.gz FHVMBIMABCQHMF-UHFFFAOYSA-N -1 3 349.321 4.388 20 0 EIADHM CCOc1cccc2cc([C@H](C)NCc3ccc(C(=O)[O-])cc3)oc21 ZINC000263447480 1046288616 /nfs/dbraw/zinc/28/86/16/1046288616.db2.gz GGQQMARJKPZWCR-ZDUSSCGKSA-N -1 3 339.391 4.381 20 0 EIADHM Cc1cc(=O)[n-]c(-c2ccc(NC(=O)CCC3CCCCC3)cc2)n1 ZINC000064342861 1046289706 /nfs/dbraw/zinc/28/97/06/1046289706.db2.gz LDTLALWXAVCZMR-UHFFFAOYSA-N -1 3 339.439 4.044 20 0 EIADHM COc1ccc(Cl)c([N-]S(=O)(=O)c2ccc(C)cc2Cl)c1 ZINC000064374591 1046294387 /nfs/dbraw/zinc/29/43/87/1046294387.db2.gz UCXNTNRCBODLNR-UHFFFAOYSA-N -1 3 346.235 4.111 20 0 EIADHM CCOc1cc(CNc2ccc(NC(C)=O)c(C)c2)cc(Cl)c1[O-] ZINC000916840911 1046385389 /nfs/dbraw/zinc/38/53/89/1046385389.db2.gz LKGGJRDZTUGBOQ-UHFFFAOYSA-N -1 3 348.830 4.323 20 0 EIADHM O=C(Nc1ccc(Br)cc1[O-])c1c(F)cccc1Cl ZINC000126022976 1046421414 /nfs/dbraw/zinc/42/14/14/1046421414.db2.gz AVJXKUAYQZJJTH-UHFFFAOYSA-N -1 3 344.567 4.200 20 0 EIADHM CC(NCc1cc(=O)[n-]c(C2CC2)n1)(c1ccccc1)c1ccccc1 ZINC000459401866 1046600813 /nfs/dbraw/zinc/60/08/13/1046600813.db2.gz YPRBUFYFTIJANX-UHFFFAOYSA-N -1 3 345.446 4.113 20 0 EIADHM [O-]c1cccc(CN[C@H]2CCc3cc(F)ccc32)c1Br ZINC000459392090 1046608225 /nfs/dbraw/zinc/60/82/25/1046608225.db2.gz KZTYBSGURBPVIY-AWEZNQCLSA-N -1 3 336.204 4.071 20 0 EIADHM CCCCn1ncc(NCc2cccc([O-])c2Br)c1C ZINC000459467646 1046704721 /nfs/dbraw/zinc/70/47/21/1046704721.db2.gz QTVXBUWREFVZFO-UHFFFAOYSA-N -1 3 338.249 4.072 20 0 EIADHM CC[C@@H](c1ccncc1)N(C)Cc1cccc([O-])c1Br ZINC000459551300 1046771844 /nfs/dbraw/zinc/77/18/44/1046771844.db2.gz NEZLYHCZQNNQAX-AWEZNQCLSA-N -1 3 335.245 4.133 20 0 EIADHM O=C(OCc1cc2ccccc2nc1Cl)c1cc2occc2[n-]1 ZINC000786027396 1046799834 /nfs/dbraw/zinc/79/98/34/1046799834.db2.gz DIULUVSCNVPDCN-UHFFFAOYSA-N -1 3 326.739 4.320 20 0 EIADHM O=C(OCc1ccc(OCC(F)(F)F)cc1)c1cc2occc2[n-]1 ZINC000786032193 1046804148 /nfs/dbraw/zinc/80/41/48/1046804148.db2.gz UBRQSVCZEOXPMN-UHFFFAOYSA-N -1 3 339.269 4.059 20 0 EIADHM CO[C@@H](C)c1nc(COC(=O)c2cc3sccc3c([O-])c2)cs1 ZINC000786135518 1046815496 /nfs/dbraw/zinc/81/54/96/1046815496.db2.gz BXZUHZYQFHAWOO-VIFPVBQESA-N -1 3 349.433 4.128 20 0 EIADHM CC(C)(Cc1ccc(C(F)(F)F)cc1)C(=O)[N-]OC1CCCC1 ZINC000786203649 1046816560 /nfs/dbraw/zinc/81/65/60/1046816560.db2.gz WXRGGRBSLHWTAF-UHFFFAOYSA-N -1 3 329.362 4.265 20 0 EIADHM O=C(CCc1cc(Cl)cc(Cl)c1)Nc1cccc([O-])c1F ZINC000128337690 1046827254 /nfs/dbraw/zinc/82/72/54/1046827254.db2.gz NIVCGGZTLZABBA-UHFFFAOYSA-N -1 3 328.170 4.409 20 0 EIADHM Cc1cc2cc(CNC(=O)c3cc4sccc4c([O-])c3)ccc2[nH]1 ZINC000804889131 1046828812 /nfs/dbraw/zinc/82/88/12/1046828812.db2.gz FNZXATHUDJVODD-UHFFFAOYSA-N -1 3 336.416 4.327 20 0 EIADHM CC1(C)CN(Cc2cc(=O)oc3cc([O-])ccc23)[C@H]1c1cccs1 ZINC000805838442 1047028014 /nfs/dbraw/zinc/02/80/14/1047028014.db2.gz AVNREODEUSBRDS-SFHVURJKSA-N -1 3 341.432 4.143 20 0 EIADHM O=C(Nc1cccc(-c2cc[nH]n2)c1)c1cc2sccc2c([O-])c1 ZINC000788281129 1047156781 /nfs/dbraw/zinc/15/67/81/1047156781.db2.gz OGAZREMBGKELPO-UHFFFAOYSA-N -1 3 335.388 4.249 20 0 EIADHM CC[C@H](Oc1ccccc1C(C)C)C(=O)Nc1cccc([O-])c1F ZINC000129135531 1047313151 /nfs/dbraw/zinc/31/31/51/1047313151.db2.gz XLPHMEUWHALDFU-INIZCTEOSA-N -1 3 331.387 4.451 20 0 EIADHM C[C@H](COc1ccccc1)C(=O)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000476152464 1047390037 /nfs/dbraw/zinc/39/00/37/1047390037.db2.gz LIXHORDIKOKUQT-LLVKDONJSA-N -1 3 339.313 4.065 20 0 EIADHM Cn1cc(C(=O)Nc2ccc([O-])c(C(F)(F)F)c2)c2ccccc21 ZINC000476170949 1047397731 /nfs/dbraw/zinc/39/77/31/1047397731.db2.gz SFPBKHFPWYBANR-UHFFFAOYSA-N -1 3 334.297 4.155 20 0 EIADHM O=C(C[C@H](c1ccccc1)C(F)(F)F)Nc1cccc([O-])c1F ZINC000129551524 1047425439 /nfs/dbraw/zinc/42/54/39/1047425439.db2.gz KOZLGGQUPATFLK-LLVKDONJSA-N -1 3 327.277 4.206 20 0 EIADHM CCSc1ccc(Cl)cc1[N-]C(=O)c1cncc(Cl)n1 ZINC000789977222 1047496854 /nfs/dbraw/zinc/49/68/54/1047496854.db2.gz XIJHMMKHPLMRPV-UHFFFAOYSA-N -1 3 328.224 4.148 20 0 EIADHM O=C([N-]c1nc(Cc2ccccc2)ns1)c1c(F)cccc1Cl ZINC000107198654 1047714857 /nfs/dbraw/zinc/71/48/57/1047714857.db2.gz AGSDZTYBVNMVED-UHFFFAOYSA-N -1 3 347.802 4.174 20 0 EIADHM Cc1sc2[nH]c(-c3ccc([O-])cc3)nc(=O)c2c1-c1ccccc1 ZINC000046703324 1047806574 /nfs/dbraw/zinc/80/65/74/1047806574.db2.gz DIWNILBEEXMQLH-UHFFFAOYSA-N -1 3 334.400 4.333 20 0 EIADHM O=C([N-]c1nc(-c2cccs2)ns1)c1cscc1Cl ZINC001127495572 1047845832 /nfs/dbraw/zinc/84/58/32/1047845832.db2.gz QSZLHJIQRKSJKK-UHFFFAOYSA-N -1 3 327.843 4.234 20 0 EIADHM CC(C)c1ccc(C(=O)N[C@H](C)c2cccc(-n3cccn3)c2)c([O-])c1 ZINC001137006959 1048056551 /nfs/dbraw/zinc/05/65/51/1048056551.db2.gz IBLBAMRLGYWQGE-OAHLLOKOSA-N -1 3 349.434 4.192 20 0 EIADHM CCCCCC[C@@H](CC)C(=O)NCc1cc(=O)[n-]c(C2CCC2)n1 ZINC000825304578 1048065829 /nfs/dbraw/zinc/06/58/29/1048065829.db2.gz CFZYGPDLMWTPKQ-CQSZACIVSA-N -1 3 333.476 4.063 20 0 EIADHM Cc1noc(-c2ccccc2)c1[N-]C(=O)c1cnc(Cl)c(F)c1 ZINC000808732910 1048096130 /nfs/dbraw/zinc/09/61/30/1048096130.db2.gz OXXKZDYRLZLCHD-UHFFFAOYSA-N -1 3 331.734 4.090 20 0 EIADHM Nc1ccc(Nc2c(Cl)ccc([O-])c2F)cc1Br ZINC001160377029 1048114266 /nfs/dbraw/zinc/11/42/66/1048114266.db2.gz HPIYZYHSAOHPPM-UHFFFAOYSA-N -1 3 331.572 4.273 20 0 EIADHM Cc1cc(C)c([N-]c2nnc(Sc3ncccn3)s2)c(Cl)c1 ZINC000844161893 1048224314 /nfs/dbraw/zinc/22/43/14/1048224314.db2.gz QEFRHQDSNSFGLY-UHFFFAOYSA-N -1 3 349.872 4.493 20 0 EIADHM COc1ccc2cc(CNCc3cccc([O-])c3Cl)ccc2c1 ZINC000815113092 1048326345 /nfs/dbraw/zinc/32/63/45/1048326345.db2.gz NWVKOGIJBJVURV-UHFFFAOYSA-N -1 3 327.811 4.497 20 0 EIADHM CCCC[C@@H](NC(=O)Cc1ccc([O-])c(F)c1)c1ccc(OC)cc1 ZINC001144144317 1048449955 /nfs/dbraw/zinc/44/99/55/1048449955.db2.gz UQLYIUNVNYXQOU-GOSISDBHSA-N -1 3 345.414 4.130 20 0 EIADHM C[C@@H]1CO[C@@H](c2ccccc2)[C@H](C)N1C(=O)c1cc([O-])ccc1Cl ZINC000815553562 1048506539 /nfs/dbraw/zinc/50/65/39/1048506539.db2.gz CYZFXESYNWPMNL-FHSNZYRGSA-N -1 3 345.826 4.036 20 0 EIADHM C[C@H]1CC(=O)c2c1c(F)ccc2OC(=O)c1cc2ccsc2[n-]1 ZINC000920153634 1048530957 /nfs/dbraw/zinc/53/09/57/1048530957.db2.gz ADIYXCFPRBFQST-QMMMGPOBSA-N -1 3 329.352 4.278 20 0 EIADHM [O-]c1cc(F)c(CN2CCC3(CCc4ccccc4O3)CC2)c(F)c1 ZINC001144561432 1048727585 /nfs/dbraw/zinc/72/75/85/1048727585.db2.gz ISCOEEUGNSJAPS-UHFFFAOYSA-N -1 3 345.389 4.030 20 0 EIADHM [O-]c1cc(F)c(CN2CC[C@H](Sc3ccc(F)cc3)C2)cc1F ZINC001144659908 1048793966 /nfs/dbraw/zinc/79/39/66/1048793966.db2.gz QNNMVMAPCSGJAH-AWEZNQCLSA-N -1 3 339.382 4.176 20 0 EIADHM CN(Cc1c(F)ccc([O-])c1F)C[C@@H]1CCCO[C@@H]1c1ccccc1 ZINC000816499314 1048820361 /nfs/dbraw/zinc/82/03/61/1048820361.db2.gz LHIREFRZRGKKQA-MGPUTAFESA-N -1 3 347.405 4.270 20 0 EIADHM O=C(OCc1ccc(Cl)nc1)c1cc2cc(Cl)sc2[n-]1 ZINC000810589192 1048824941 /nfs/dbraw/zinc/82/49/41/1048824941.db2.gz DKZDPHQTGZSAOY-UHFFFAOYSA-N -1 3 327.192 4.288 20 0 EIADHM O=S(=O)(/C=C\c1ccc(F)cc1)[N-]c1ccccc1OCC1CC1 ZINC000747617348 1048831342 /nfs/dbraw/zinc/83/13/42/1048831342.db2.gz VSYUDMWIUDTAAT-QXMHVHEDSA-N -1 3 347.411 4.027 20 0 EIADHM CC(C)c1ccc(NC(=O)c2c[n-]c3cc(F)c(F)cc3c2=O)cc1 ZINC001135653691 1048847403 /nfs/dbraw/zinc/84/74/03/1048847403.db2.gz DVSNPBCRMADESU-UHFFFAOYSA-N -1 3 342.345 4.182 20 0 EIADHM O=C([O-])CC[C@H]1CCCCN1Cc1ncc(-c2ccccc2)s1 ZINC000846280411 1048853276 /nfs/dbraw/zinc/85/32/76/1048853276.db2.gz DPTJDJNVGTWWCD-OAHLLOKOSA-N -1 3 330.453 4.029 20 0 EIADHM Cc1ccc(-c2csc([N-]C(=O)c3c(F)ccnc3F)n2)cc1C ZINC000816832261 1048865528 /nfs/dbraw/zinc/86/55/28/1048865528.db2.gz VKKNEWUDTWNAPI-UHFFFAOYSA-N -1 3 345.374 4.352 20 0 EIADHM CCCC[C@](CC)(Nc1[n-]c(=O)c(Cl)cc1Cl)C(=O)OCC ZINC001171228952 1048867546 /nfs/dbraw/zinc/86/75/46/1048867546.db2.gz VSUOIBMANHZPGG-HNNXBMFYSA-N -1 3 349.258 4.408 20 0 EIADHM O=C(OCCCc1cscn1)c1cc2cc(Cl)sc2[n-]1 ZINC000810836955 1048878211 /nfs/dbraw/zinc/87/82/11/1048878211.db2.gz JFVNQAVRIARKRW-UHFFFAOYSA-N -1 3 326.830 4.129 20 0 EIADHM COc1cccc([C@@H](C)C(=O)Nc2ccc([O-])c(C(F)(F)F)c2)c1 ZINC000134154869 1048889032 /nfs/dbraw/zinc/88/90/32/1048889032.db2.gz DBUDILBWGOOARS-SNVBAGLBSA-N -1 3 339.313 4.162 20 0 EIADHM C[C@@H]1CN(C(=O)c2cc3sccc3c([O-])c2)Cc2ccccc2O1 ZINC000817049039 1048889565 /nfs/dbraw/zinc/88/95/65/1048889565.db2.gz MXPVRKKQSPLIGK-GFCCVEGCSA-N -1 3 339.416 4.030 20 0 EIADHM COc1ccc([C@H](C)C(=O)Nc2ccc([O-])c(C(F)(F)F)c2)cc1 ZINC000134218581 1048899898 /nfs/dbraw/zinc/89/98/98/1048899898.db2.gz RYEMDUBZWZWFBP-JTQLQIEISA-N -1 3 339.313 4.162 20 0 EIADHM CC(C)c1ccc2c(Cl)c(C(=O)[N-]c3ncn(C)n3)sc2c1 ZINC000817153045 1048904281 /nfs/dbraw/zinc/90/42/81/1048904281.db2.gz HDELHDKTTQLZTJ-UHFFFAOYSA-N -1 3 334.832 4.059 20 0 EIADHM CSc1ccc([O-])c(C(=O)NCCSCc2ccc(C)cc2)c1 ZINC001135825154 1048905544 /nfs/dbraw/zinc/90/55/44/1048905544.db2.gz HQNCBKIJJIPEMU-UHFFFAOYSA-N -1 3 347.505 4.086 20 0 EIADHM CC1(C)CN(C(=O)c2cc3sccc3c([O-])c2)[C@@H]1c1ccncc1 ZINC000817179610 1048907996 /nfs/dbraw/zinc/90/79/96/1048907996.db2.gz AOVFESLPWCSEJM-QGZVFWFLSA-N -1 3 338.432 4.225 20 0 EIADHM Cc1c([N-]C(=O)c2csc(-c3ccccn3)n2)noc1C(C)(C)C ZINC001132676064 1048982424 /nfs/dbraw/zinc/98/24/24/1048982424.db2.gz VJXHVLQTTMRQEZ-UHFFFAOYSA-N -1 3 342.424 4.051 20 0 EIADHM O=C(c1cc2sccc2c([O-])c1)N1CCC[C@@H](CC(F)(F)F)C1 ZINC000817633760 1049022961 /nfs/dbraw/zinc/02/29/61/1049022961.db2.gz SRIIGTQIERGLBB-JTQLQIEISA-N -1 3 343.370 4.412 20 0 EIADHM C[C@H](OC(=O)c1cc2ccsc2[n-]1)C(=O)c1cccc(Cl)c1 ZINC000817704461 1049028778 /nfs/dbraw/zinc/02/87/78/1049028778.db2.gz CKGXKNLZFONGRS-VIFPVBQESA-N -1 3 333.796 4.311 20 0 EIADHM CCc1cccc(C(=O)N[C@H](c2ccc(OC)cc2)C(C)C)c1[O-] ZINC001135978238 1049030393 /nfs/dbraw/zinc/03/03/93/1049030393.db2.gz KSFQJEDZXLELGH-SFHVURJKSA-N -1 3 327.424 4.090 20 0 EIADHM CCCCC[C@H](NC(=O)c1cc(NC(C)=O)ccc1[O-])C(C)(C)C ZINC001146536977 1049033410 /nfs/dbraw/zinc/03/34/10/1049033410.db2.gz AXDSEAGYYLMOGU-KRWDZBQOSA-N -1 3 334.460 4.075 20 0 EIADHM CC(=O)Oc1ccc(COC(=O)c2cc3cc(Cl)sc3[n-]2)cc1 ZINC000811393954 1049050794 /nfs/dbraw/zinc/05/07/94/1049050794.db2.gz VAVMCHXWDZIBJA-UHFFFAOYSA-N -1 3 349.795 4.165 20 0 EIADHM O=C(OC[C@@H]1OCCc2ccccc21)c1cc2cc(Cl)sc2[n-]1 ZINC000811394893 1049051649 /nfs/dbraw/zinc/05/16/49/1049051649.db2.gz LWQDRSVBKYUGHO-AWEZNQCLSA-N -1 3 347.823 4.354 20 0 EIADHM CC[C@H](C)Sc1ccc(NC(=O)c2ccc(N)cc2[O-])c(C)c1 ZINC000817929290 1049053856 /nfs/dbraw/zinc/05/38/56/1049053856.db2.gz MJCFSMOZBOVGJR-LBPRGKRZSA-N -1 3 330.453 4.426 20 0 EIADHM COc1cc(C(=O)[N-]c2cc(OC(C)C)c(Cl)cc2Cl)on1 ZINC001146940690 1049074255 /nfs/dbraw/zinc/07/42/55/1049074255.db2.gz HFZFACYUVAXTMB-UHFFFAOYSA-N -1 3 345.182 4.030 20 0 EIADHM O=C(CCC1CCCCC1)[N-]OCc1ccc(-c2ccccn2)nc1 ZINC000818077824 1049087036 /nfs/dbraw/zinc/08/70/36/1049087036.db2.gz SZMVPPJHZTVADG-UHFFFAOYSA-N -1 3 339.439 4.052 20 0 EIADHM O=C(c1cc(Oc2ccccc2)ccc1[O-])N1CC(Cc2ccco2)C1 ZINC001147318756 1049133409 /nfs/dbraw/zinc/13/34/09/1049133409.db2.gz RUAUCWCKYABHRH-UHFFFAOYSA-N -1 3 349.386 4.092 20 0 EIADHM Cc1cccc([C@@H](C)CNC(=O)c2cc3sccc3c([O-])c2)c1 ZINC001147573279 1049182627 /nfs/dbraw/zinc/18/26/27/1049182627.db2.gz VSKNSLKAOTWAMA-ZDUSSCGKSA-N -1 3 325.433 4.449 20 0 EIADHM CCCn1ccc2ccc(NC(=O)c3ccc(C(C)=O)c([O-])c3)cc21 ZINC001147903347 1049238817 /nfs/dbraw/zinc/23/88/17/1049238817.db2.gz TXUDAPOAPWYFDX-UHFFFAOYSA-N -1 3 336.391 4.212 20 0 EIADHM CCc1ccc(C(=O)Nc2cccnc2Oc2ccccc2)c([O-])c1 ZINC001136212640 1049300255 /nfs/dbraw/zinc/30/02/55/1049300255.db2.gz ICFALWVBEKMXEP-UHFFFAOYSA-N -1 3 334.375 4.394 20 0 EIADHM CCc1cccc(C(=O)Nc2cccc3c2OC(C)(C)CC3)c1[O-] ZINC001148406370 1049311947 /nfs/dbraw/zinc/31/19/47/1049311947.db2.gz QJQLMWIVNNUXHZ-UHFFFAOYSA-N -1 3 325.408 4.311 20 0 EIADHM CCC[C@@H](C(=O)Nc1ccc(Br)cc1[O-])c1ccccn1 ZINC001136219445 1049322772 /nfs/dbraw/zinc/32/27/72/1049322772.db2.gz TXZVYVIZVLBJJZ-GFCCVEGCSA-N -1 3 349.228 4.072 20 0 EIADHM CCO[C@@H]1C[C@@H](NC(=O)c2cc([O-])c3ccccc3c2)C12CCCC2 ZINC001148553450 1049332298 /nfs/dbraw/zinc/33/22/98/1049332298.db2.gz QFPIATYCZMHFHA-RTBURBONSA-N -1 3 339.435 4.013 20 0 EIADHM Cc1cccc([O-])c1C(=O)NCc1ccc(COc2ccccc2)cc1 ZINC001136244606 1049350344 /nfs/dbraw/zinc/35/03/44/1049350344.db2.gz IIQQEZCTUNOHBY-UHFFFAOYSA-N -1 3 347.414 4.210 20 0 EIADHM CC(=O)c1cc(C(=O)Nc2cccc3c(Cl)ccnc23)ccc1[O-] ZINC001148664619 1049356067 /nfs/dbraw/zinc/35/60/67/1049356067.db2.gz QNTWVFCXNJMFNN-UHFFFAOYSA-N -1 3 340.766 4.049 20 0 EIADHM O=C(NCCOc1cccc(Cl)c1)c1cc2sccc2c([O-])c1 ZINC001136251973 1049358177 /nfs/dbraw/zinc/35/81/77/1049358177.db2.gz WMLNCUHMGOFBJB-UHFFFAOYSA-N -1 3 347.823 4.069 20 0 EIADHM O=C(CCC(=O)c1ccc(-c2ccccc2)cc1)[N-]Oc1ccccc1 ZINC000820048914 1049421546 /nfs/dbraw/zinc/42/15/46/1049421546.db2.gz LCNYRUSYORSBAI-UHFFFAOYSA-N -1 3 345.398 4.427 20 0 EIADHM CSc1ccc([O-])c(C(=O)N2CCC[C@H](c3ccccc3)C2)c1 ZINC000615236138 1049566847 /nfs/dbraw/zinc/56/68/47/1049566847.db2.gz RGEVQSATFJVQPJ-HNNXBMFYSA-N -1 3 327.449 4.134 20 0 EIADHM Cc1sc2[n-]c([C@@H](C)OC(=O)C(F)=C3CCC3)nc(=O)c2c1C ZINC000821380364 1049625359 /nfs/dbraw/zinc/62/53/59/1049625359.db2.gz PJMTUNVFXCPHPK-MRVPVSSYSA-N -1 3 336.388 4.025 20 0 EIADHM Cc1cc(F)ccc1[C@H](C)[N-]C(=O)C(F)(F)c1ccccc1F ZINC001133537894 1049644689 /nfs/dbraw/zinc/64/46/89/1049644689.db2.gz VXHQWTKEAAUYRS-NSHDSACASA-N -1 3 325.305 4.242 20 0 EIADHM CCc1ccc([O-])c(C(=O)Nc2ccc3[nH]c(C(C)(C)C)nc3c2)c1 ZINC001136483953 1049677992 /nfs/dbraw/zinc/67/79/92/1049677992.db2.gz IDUKRRQGBALIHJ-UHFFFAOYSA-N -1 3 337.423 4.381 20 0 EIADHM CCc1ccc(C(=O)NCC2(c3ccc(Cl)cc3)CCC2)c([O-])c1 ZINC001136571537 1049753280 /nfs/dbraw/zinc/75/32/80/1049753280.db2.gz UPLCTLJSOZXFQA-UHFFFAOYSA-N -1 3 343.854 4.460 20 0 EIADHM Cc1cc(F)c(C(=O)[N-]c2nnc(C3CCCCC3)s2)c(F)c1 ZINC000823121858 1049825693 /nfs/dbraw/zinc/82/56/93/1049825693.db2.gz ZWOOPPAGGRUPPS-UHFFFAOYSA-N -1 3 337.395 4.425 20 0 EIADHM C[C@H]1C[C@H]1N(Cc1cc(=O)[n-]c(-c2ccccc2)n1)c1ccccc1 ZINC001171047564 1049901644 /nfs/dbraw/zinc/90/16/44/1049901644.db2.gz GBOWTSLRTWZIIW-HNAYVOBHSA-N -1 3 331.419 4.264 20 0 EIADHM Cc1nc([C@H](C)N2CC[C@](C)(C(=O)[O-])C2)oc1-c1ccc(Cl)cc1 ZINC000263571522 1049995155 /nfs/dbraw/zinc/99/51/55/1049995155.db2.gz JMOUNCCPEQSCDO-SGTLLEGYSA-N -1 3 348.830 4.161 20 0 EIADHM CC(C)c1oncc1[N-]C(=O)c1csc(-c2ccc(F)c(F)c2)n1 ZINC001177847407 1050315817 /nfs/dbraw/zinc/31/58/17/1050315817.db2.gz JWZYPJXABNRPSG-UHFFFAOYSA-N -1 3 349.362 4.452 20 0 EIADHM C=Cc1ccc(C(=O)Nc2ccc(C(=O)OC(C)(C)C)cc2[O-])cc1 ZINC001186527421 1050354115 /nfs/dbraw/zinc/35/41/15/1050354115.db2.gz SNUVNPAXPHRPPR-UHFFFAOYSA-N -1 3 339.391 4.243 20 0 EIADHM O=C(N[C@@H]1CCc2c1cccc2F)c1cc2sccc2c([O-])c1 ZINC001178109841 1050376315 /nfs/dbraw/zinc/37/63/15/1050376315.db2.gz NNUWOJGOHQUUCJ-OAHLLOKOSA-N -1 3 327.380 4.163 20 0 EIADHM Cc1csc(Nc2cccc(NC(=O)c3c(C)cccc3[O-])c2)n1 ZINC001178509884 1050484716 /nfs/dbraw/zinc/48/47/16/1050484716.db2.gz DXYMDHOMGUYBFE-UHFFFAOYSA-N -1 3 339.420 4.461 20 0 EIADHM COc1cccc(SCc2nc3c4ccccc4oc3c(=O)[n-]2)c1 ZINC000253613589 1050496766 /nfs/dbraw/zinc/49/67/66/1050496766.db2.gz GQHSPUKTPIQADM-UHFFFAOYSA-N -1 3 338.388 4.383 20 0 EIADHM O=C(Nc1ccc(C2CC2)c2ccccc12)c1[n-]nnc1C(F)(F)F ZINC001187766259 1050622360 /nfs/dbraw/zinc/62/23/60/1050622360.db2.gz MUVOUQPHQPRUHJ-UHFFFAOYSA-N -1 3 346.312 4.106 20 0 EIADHM O=C(Nc1ccc(C2CC2)c2ccccc12)c1nn[n-]c1C(F)(F)F ZINC001187766259 1050622365 /nfs/dbraw/zinc/62/23/65/1050622365.db2.gz MUVOUQPHQPRUHJ-UHFFFAOYSA-N -1 3 346.312 4.106 20 0 EIADHM CCc1ccc([O-])c(C(=O)N2CCC[C@]3(C=Cc4ccccc4O3)C2)c1 ZINC001179422977 1050698114 /nfs/dbraw/zinc/69/81/14/1050698114.db2.gz MNCLHFSRZVOWPV-QFIPXVFZSA-N -1 3 349.430 4.035 20 0 EIADHM O=c1cc(COc2ccc(F)cc2Cl)nc(-c2ccccc2)[n-]1 ZINC001188191985 1050719296 /nfs/dbraw/zinc/71/92/96/1050719296.db2.gz HVTUDRZKYHMNMV-UHFFFAOYSA-N -1 3 330.746 4.221 20 0 EIADHM CCCC[C@@H]([N-]S(=O)(=O)c1cc(F)ccc1Cl)C1CCC1 ZINC001188239107 1050722460 /nfs/dbraw/zinc/72/24/60/1050722460.db2.gz NLKHHNGWBCOYGF-CQSZACIVSA-N -1 3 333.856 4.116 20 0 EIADHM O=C([N-]c1cc(C2CCCC2)no1)c1ncsc1C(F)(F)F ZINC001188206822 1050727398 /nfs/dbraw/zinc/72/73/98/1050727398.db2.gz KBHZPPIPDBTJCO-UHFFFAOYSA-N -1 3 331.319 4.060 20 0 EIADHM CCc1cc(C(=O)[N-]c2c(SC)cc(C)nc2SC)cc(C)n1 ZINC001188333507 1050746637 /nfs/dbraw/zinc/74/66/37/1050746637.db2.gz BPWWNTOXDZWELY-UHFFFAOYSA-N -1 3 347.509 4.352 20 0 EIADHM CC(C)(C)NC(=O)c1ccc(Nc2nc3c(cccc3[O-])s2)cc1 ZINC001174124371 1050765859 /nfs/dbraw/zinc/76/58/59/1050765859.db2.gz OJVKKCGNEOPNOC-UHFFFAOYSA-N -1 3 341.436 4.274 20 0 EIADHM [O-]c1cccc(Nc2cnn(Cc3ccccc3)c2)c1Br ZINC001174134198 1050778534 /nfs/dbraw/zinc/77/85/34/1050778534.db2.gz IDWTZPSWGIZIHF-UHFFFAOYSA-N -1 3 344.212 4.143 20 0 EIADHM CCc1cccc(C(=O)Nc2nc3c(s2)CCC[C@@H]3CC)c1[O-] ZINC001179841411 1050791081 /nfs/dbraw/zinc/79/10/81/1050791081.db2.gz NFVXRNJRQGHWPL-NSHDSACASA-N -1 3 330.453 4.493 20 0 EIADHM CCN(CC)C(=O)c1cccc(Nc2nc3c(cccc3[O-])s2)c1 ZINC001174164608 1050805263 /nfs/dbraw/zinc/80/52/63/1050805263.db2.gz LVQYFDFMPWRFQA-UHFFFAOYSA-N -1 3 341.436 4.228 20 0 EIADHM O=C(NC1CCCC1)c1cccc(Nc2c(F)cc([O-])cc2F)c1 ZINC001174198212 1050833947 /nfs/dbraw/zinc/83/39/47/1050833947.db2.gz YDBSKRXKVOMNLG-UHFFFAOYSA-N -1 3 332.350 4.086 20 0 EIADHM Cc1cc(NCc2ccc([O-])c(F)c2)cnc1N1CCCC[C@@H]1C ZINC001180301163 1050944957 /nfs/dbraw/zinc/94/49/57/1050944957.db2.gz JXHFHFQRFXBEBS-AWEZNQCLSA-N -1 3 329.419 4.226 20 0 EIADHM Cc1cc(C(=O)Nc2cc([O-])cc(Cl)c2)c(-n2cccc2)s1 ZINC001189304073 1050957261 /nfs/dbraw/zinc/95/72/61/1050957261.db2.gz LRMGEYICVSDSFI-UHFFFAOYSA-N -1 3 332.812 4.459 20 0 EIADHM CC(=O)c1cccc([O-])c1NC(=O)c1cc(C)sc1-n1cccc1 ZINC001189304377 1050957367 /nfs/dbraw/zinc/95/73/67/1050957367.db2.gz PIKJSQBNDMNIPE-UHFFFAOYSA-N -1 3 340.404 4.008 20 0 EIADHM COc1ccc(Cn2cc(Nc3cccc([O-])c3Cl)cn2)cc1 ZINC001174437326 1050966933 /nfs/dbraw/zinc/96/69/33/1050966933.db2.gz JLGBOPOXOIONPU-UHFFFAOYSA-N -1 3 329.787 4.043 20 0 EIADHM O=S(=O)([N-]c1ccnc(C2CC2)c1)c1ccc(F)c2ccccc21 ZINC001189362818 1050982620 /nfs/dbraw/zinc/98/26/20/1050982620.db2.gz DHNNUPNKCQQSBQ-UHFFFAOYSA-N -1 3 342.395 4.052 20 0 EIADHM O=S(=O)(Cc1cccc(F)c1F)[N-]c1csc2ccccc12 ZINC001189417381 1050988431 /nfs/dbraw/zinc/98/84/31/1050988431.db2.gz VICNWAYNJMLIDW-UHFFFAOYSA-N -1 3 339.388 4.121 20 0 EIADHM COC(=O)c1ccc(NC(=O)Nc2ccccc2C(C)(C)C)c([O-])c1 ZINC001189591843 1051017374 /nfs/dbraw/zinc/01/73/74/1051017374.db2.gz XAJCSPUBBHQPES-UHFFFAOYSA-N -1 3 342.395 4.120 20 0 EIADHM Cc1ccc2[nH]cc(CCNC(=O)c3cc([O-])c4ccccc4c3)c2c1 ZINC001180616773 1051042254 /nfs/dbraw/zinc/04/22/54/1051042254.db2.gz JQVPOXXMGGOQNB-UHFFFAOYSA-N -1 3 344.414 4.308 20 0 EIADHM O=C(Nc1ccc2[nH]ccc2c1)c1cccc(OC(F)(F)F)c1[O-] ZINC001189749782 1051050828 /nfs/dbraw/zinc/05/08/28/1051050828.db2.gz WGLKLSXXONEWBY-UHFFFAOYSA-N -1 3 336.269 4.024 20 0 EIADHM COc1ccc(Cn2cc(Nc3cccc([O-])c3Cl)c(C)n2)cc1 ZINC001174578306 1051064443 /nfs/dbraw/zinc/06/44/43/1051064443.db2.gz PVTJVPANCAVUOC-UHFFFAOYSA-N -1 3 343.814 4.351 20 0 EIADHM Cc1cc(S(=O)(=O)[N-]C[C@@H]2CCC[C@@H](C)[C@@H]2C)sc1Cl ZINC001189793722 1051066244 /nfs/dbraw/zinc/06/62/44/1051066244.db2.gz LSHYNRZLWLYPHK-USWWRNFRSA-N -1 3 335.922 4.061 20 0 EIADHM CC[C@H](CC(=O)Nc1n[n-]c(SCc2ccc(C)cc2)n1)C(C)C ZINC001180832372 1051084109 /nfs/dbraw/zinc/08/41/09/1051084109.db2.gz IFIDMEJGHZHSAL-OAHLLOKOSA-N -1 3 346.500 4.416 20 0 EIADHM Cc1nc(C(F)(F)F)c(C(=O)[N-]c2cc(C3CCCC3)no2)s1 ZINC001190487764 1051186877 /nfs/dbraw/zinc/18/68/77/1051186877.db2.gz CSULDPCNEDNXSX-UHFFFAOYSA-N -1 3 345.346 4.368 20 0 EIADHM Cc1nc(C(F)(F)F)c(C(=O)[N-]c2nc3ccc(F)cc3o2)s1 ZINC001190489342 1051187682 /nfs/dbraw/zinc/18/76/82/1051187682.db2.gz VIBOMTVVNIENLT-UHFFFAOYSA-N -1 3 345.277 4.003 20 0 EIADHM O=S(=O)([N-]c1cc(Cl)cnc1Cl)c1ccc(C2CC2)cc1 ZINC001190468198 1051193439 /nfs/dbraw/zinc/19/34/39/1051193439.db2.gz PPENDULEDMHOEM-UHFFFAOYSA-N -1 3 343.235 4.067 20 0 EIADHM COc1cc(F)c(Nc2cccc([O-])c2Br)cc1F ZINC001174929892 1051229472 /nfs/dbraw/zinc/22/94/72/1051229472.db2.gz MBCPSQNCCQDSKA-UHFFFAOYSA-N -1 3 330.128 4.185 20 0 EIADHM CCOc1ccc(C(=O)Nc2ccc(F)c([O-])c2)cc1C(F)(F)F ZINC001190649416 1051242763 /nfs/dbraw/zinc/24/27/63/1051242763.db2.gz QLADJEQLYOEXCZ-UHFFFAOYSA-N -1 3 343.276 4.201 20 0 EIADHM COc1ccc(Nc2cccc([O-])c2Br)c(F)c1F ZINC001175025217 1051302925 /nfs/dbraw/zinc/30/29/25/1051302925.db2.gz CKDNYQKEOZVSDJ-UHFFFAOYSA-N -1 3 330.128 4.185 20 0 EIADHM O=C(N[C@@H](c1ccccc1)C1CCCC1)c1ccc(=O)[n-]c1Cl ZINC001190918454 1051310758 /nfs/dbraw/zinc/31/07/58/1051310758.db2.gz RJGLJLQIBGFEOM-INIZCTEOSA-N -1 3 330.815 4.102 20 0 EIADHM COc1ccc(Br)c(Nc2c(F)cc([O-])cc2F)c1 ZINC001175100548 1051347198 /nfs/dbraw/zinc/34/71/98/1051347198.db2.gz QGONVDLFBAOFHV-UHFFFAOYSA-N -1 3 330.128 4.185 20 0 EIADHM COc1cc(Nc2c(F)cc([O-])cc2F)c(Br)cc1F ZINC001175103718 1051352522 /nfs/dbraw/zinc/35/25/22/1051352522.db2.gz XCMAGQOHWXBAKB-UHFFFAOYSA-N -1 3 348.118 4.324 20 0 EIADHM O=C(CCc1ncc(-c2ccccc2Cl)o1)[N-]Oc1ccccc1 ZINC000773465646 1051381062 /nfs/dbraw/zinc/38/10/62/1051381062.db2.gz HRBVCHACXVLNRN-UHFFFAOYSA-N -1 3 342.782 4.038 20 0 EIADHM O=C(NCCCc1ccccc1)Nc1c([O-])cccc1C(F)(F)F ZINC001191210879 1051386627 /nfs/dbraw/zinc/38/66/27/1051386627.db2.gz LWVYREIIQMXBMH-UHFFFAOYSA-N -1 3 338.329 4.165 20 0 EIADHM COc1ccc(F)c(Nc2cccc([O-])c2Br)c1F ZINC001175122311 1051392708 /nfs/dbraw/zinc/39/27/08/1051392708.db2.gz UTFSBHVWUFBREW-UHFFFAOYSA-N -1 3 330.128 4.185 20 0 EIADHM CCCCc1ccc(S(=O)(=O)[N-]c2ncc(C)cc2Cl)cc1 ZINC001191232728 1051405226 /nfs/dbraw/zinc/40/52/26/1051405226.db2.gz FGYHQLBIGVDLSV-UHFFFAOYSA-N -1 3 338.860 4.187 20 0 EIADHM COc1ccc([O-])c(C(=O)Nc2ccccc2CCC(F)(F)F)c1 ZINC000155336139 1051407018 /nfs/dbraw/zinc/40/70/18/1051407018.db2.gz RZWUCJPCZANYPZ-UHFFFAOYSA-N -1 3 339.313 4.148 20 0 EIADHM CSc1ccc(Cl)cc1[N-]C(=O)c1cnc(C(F)(F)F)nc1 ZINC000155408383 1051414520 /nfs/dbraw/zinc/41/45/20/1051414520.db2.gz GPZYQDBSULJHKF-UHFFFAOYSA-N -1 3 347.749 4.123 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(NC[C@H]3CCCC3(C)C)nc2)n1 ZINC000572583885 1051419686 /nfs/dbraw/zinc/41/96/86/1051419686.db2.gz WHFASHUTTVZIFZ-CQSZACIVSA-N -1 3 326.444 4.045 20 0 EIADHM C[C@H](Oc1ccccc1NCc1ccc([O-])c(F)c1)C(F)(F)F ZINC001182196376 1051423716 /nfs/dbraw/zinc/42/37/16/1051423716.db2.gz PHGRAWRTJUHIDQ-JTQLQIEISA-N -1 3 329.293 4.473 20 0 EIADHM Cc1ccc(Oc2ccccc2NC([O-])=NO[C@H]2CCCCO2)cc1 ZINC000775450162 1051431480 /nfs/dbraw/zinc/43/14/80/1051431480.db2.gz LSGQAGQFUKVUCN-SFHVURJKSA-N -1 3 342.395 4.367 20 0 EIADHM Cc1ccc(Oc2ccccc2NC(=O)[N-]O[C@H]2CCCCO2)cc1 ZINC000775450162 1051431485 /nfs/dbraw/zinc/43/14/85/1051431485.db2.gz LSGQAGQFUKVUCN-SFHVURJKSA-N -1 3 342.395 4.367 20 0 EIADHM CC(C)c1ccc(C(=O)N[C@@H]2CC=CC[C@H]2C(F)(F)F)c([O-])c1 ZINC001175276302 1051477483 /nfs/dbraw/zinc/47/74/83/1051477483.db2.gz BKHWBBQHOCCILT-ZIAGYGMSSA-N -1 3 327.346 4.143 20 0 EIADHM [O-]c1ccc(F)c(Nc2ncc(Cl)cc2Br)c1F ZINC001175262064 1051500535 /nfs/dbraw/zinc/50/05/35/1051500535.db2.gz ZXEOECGISFLBNB-UHFFFAOYSA-N -1 3 335.535 4.225 20 0 EIADHM [O-]c1ccc(F)c(Nc2cn3cc(C(F)(F)F)ccc3n2)c1F ZINC001175265165 1051501215 /nfs/dbraw/zinc/50/12/15/1051501215.db2.gz CTVYQKPZTXQXLC-UHFFFAOYSA-N -1 3 329.228 4.081 20 0 EIADHM [O-]c1ccc(F)c(Nc2ccc3c(cnn3[C@@H]3CCCCO3)c2)c1F ZINC001175267861 1051503045 /nfs/dbraw/zinc/50/30/45/1051503045.db2.gz AVXNAWYOSUDJSG-INIZCTEOSA-N -1 3 345.349 4.463 20 0 EIADHM CCOC(=O)c1cc2cc(Nc3c(F)ccc([O-])c3F)ccc2o1 ZINC001175268135 1051503185 /nfs/dbraw/zinc/50/31/85/1051503185.db2.gz IOJKRYWQDYWTDC-UHFFFAOYSA-N -1 3 333.290 4.337 20 0 EIADHM O=C(NC1CCCC1)c1ccc(Nc2c(F)ccc([O-])c2F)cc1 ZINC001175268369 1051503545 /nfs/dbraw/zinc/50/35/45/1051503545.db2.gz LKGZNNBIUCDPIE-UHFFFAOYSA-N -1 3 332.350 4.086 20 0 EIADHM CCOC(=O)Cc1ccc(Nc2c(F)ccc([O-])c2F)c(Cl)c1 ZINC001175269157 1051507971 /nfs/dbraw/zinc/50/79/71/1051507971.db2.gz FHGKIYNTHXJOJV-UHFFFAOYSA-N -1 3 341.741 4.173 20 0 EIADHM [O-]c1ccc(F)c(Nc2c(Br)ccc(F)c2F)c1F ZINC001175270713 1051510188 /nfs/dbraw/zinc/51/01/88/1051510188.db2.gz IARREYDYRWHAAH-UHFFFAOYSA-N -1 3 336.082 4.455 20 0 EIADHM Fc1cccc(OC2CCCC2)c1Nc1ccc(-c2nn[n-]n2)cc1 ZINC001175432083 1051586236 /nfs/dbraw/zinc/58/62/36/1051586236.db2.gz TUVUBJSMKZLNDT-UHFFFAOYSA-N -1 3 339.374 4.071 20 0 EIADHM COc1ccc(-c2ccccc2)c(Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC001175429938 1051588085 /nfs/dbraw/zinc/58/80/85/1051588085.db2.gz WTLDCHIDHHMLRR-UHFFFAOYSA-N -1 3 343.390 4.286 20 0 EIADHM CCC(C)(C)[C@@H](C)[N-]S(=O)(=O)c1c2ncsc2ccc1Cl ZINC001192450899 1051736595 /nfs/dbraw/zinc/73/65/95/1051736595.db2.gz YVOQMXWNVCRBBP-SECBINFHSA-N -1 3 346.905 4.053 20 0 EIADHM [O-]c1cc(Br)cnc1Nc1ccc(-c2cccnc2)cc1 ZINC001175889059 1051817335 /nfs/dbraw/zinc/81/73/35/1051817335.db2.gz VNETZKGLWRIRQW-UHFFFAOYSA-N -1 3 342.196 4.355 20 0 EIADHM CCN(CC)C(=O)c1ccc(F)c(Nc2cccc([O-])c2Cl)c1 ZINC001176070483 1051884895 /nfs/dbraw/zinc/88/48/95/1051884895.db2.gz ZNMDRKVRILRWCG-UHFFFAOYSA-N -1 3 336.794 4.410 20 0 EIADHM CC[C@@]1(C(=O)[O-])CCCN(Cc2csc(-c3ccc(C)cc3)n2)C1 ZINC000324975841 1051985215 /nfs/dbraw/zinc/98/52/15/1051985215.db2.gz PPEQCQAQIWSZSM-LJQANCHMSA-N -1 3 344.480 4.195 20 0 EIADHM CCN(CC)C(=O)c1cc(F)cc(Nc2c(F)cc([O-])cc2F)c1 ZINC001176304517 1052008409 /nfs/dbraw/zinc/00/84/09/1052008409.db2.gz YMWZIEDHHROUMJ-UHFFFAOYSA-N -1 3 338.329 4.035 20 0 EIADHM [O-]c1ccc(Nc2cccc3c2cnn3[C@@H]2CCCCO2)c(F)c1F ZINC001176314794 1052019369 /nfs/dbraw/zinc/01/93/69/1052019369.db2.gz CYBSLTACXCEZOB-INIZCTEOSA-N -1 3 345.349 4.463 20 0 EIADHM CC(C)[C@@H](CC(F)(F)F)NC(=O)c1cc([O-])cc(C(F)(F)F)c1 ZINC000621966826 1052041793 /nfs/dbraw/zinc/04/17/93/1052041793.db2.gz NENBOILYNMXIMR-LLVKDONJSA-N -1 3 343.267 4.118 20 0 EIADHM O=C(Nc1cc(Br)ccc1[O-])Oc1ccc(Cl)cc1 ZINC001194055965 1052064875 /nfs/dbraw/zinc/06/48/75/1052064875.db2.gz QCOIEHAKBKGBGB-UHFFFAOYSA-N -1 3 342.576 4.419 20 0 EIADHM NC(=O)c1ccc(Nc2cc(Cl)c(Cl)c(Cl)c2)cc1[O-] ZINC001176628244 1052146054 /nfs/dbraw/zinc/14/60/54/1052146054.db2.gz XSKDKOKNYJRPNR-UHFFFAOYSA-N -1 3 331.586 4.195 20 0 EIADHM [O-]c1cc(Br)cnc1Nc1ccc(-c2ccncc2)cc1 ZINC001176694162 1052166101 /nfs/dbraw/zinc/16/61/01/1052166101.db2.gz KHCMJZNMTXEFEQ-UHFFFAOYSA-N -1 3 342.196 4.355 20 0 EIADHM CC(C)Oc1ccc(NC(=O)Cc2ccc([O-])c(F)c2)cc1Cl ZINC000622302474 1052197277 /nfs/dbraw/zinc/19/72/77/1052197277.db2.gz KTQNAUPKUHZERV-UHFFFAOYSA-N -1 3 337.778 4.153 20 0 EIADHM [O-]c1c(Cl)cccc1CNCc1nc2ccccc2n1C1CC1 ZINC000184776837 1052202452 /nfs/dbraw/zinc/20/24/52/1052202452.db2.gz QTBODZYWSFPPND-UHFFFAOYSA-N -1 3 327.815 4.020 20 0 EIADHM COc1ccc(Cl)c(NC(=O)c2cc3c(cc2[O-])CCCC3)c1 ZINC000622330433 1052211776 /nfs/dbraw/zinc/21/17/76/1052211776.db2.gz ZIVOXCLJHNGBSA-UHFFFAOYSA-N -1 3 331.799 4.185 20 0 EIADHM Cc1ccsc1/C=C/C(=O)Nc1cc(Br)ccc1[O-] ZINC001177075548 1052225333 /nfs/dbraw/zinc/22/53/33/1052225333.db2.gz GYIWPJBVJUPPDE-SNAWJCMRSA-N -1 3 338.226 4.177 20 0 EIADHM O=C(Nc1cc(F)c(F)cc1F)c1cc([O-])cc(C(F)(F)F)c1 ZINC000622355992 1052226156 /nfs/dbraw/zinc/22/61/56/1052226156.db2.gz WQZUDQGEGSYOML-UHFFFAOYSA-N -1 3 335.203 4.081 20 0 EIADHM O=S(=O)([N-]c1c(Cl)cccc1C(F)(F)F)c1ccsc1 ZINC001185391790 1052227456 /nfs/dbraw/zinc/22/74/56/1052227456.db2.gz QRBVXJAERHLYAY-UHFFFAOYSA-N -1 3 341.763 4.221 20 0 EIADHM O=C(CC1(CSc2ccccc2)CC1)[N-]Oc1ccccc1F ZINC001177109962 1052232681 /nfs/dbraw/zinc/23/26/81/1052232681.db2.gz YFJSSPKFCUQULR-UHFFFAOYSA-N -1 3 331.412 4.198 20 0 EIADHM CCc1ccc(C(=O)N(C)[C@H](Cc2ccc(F)cc2)C(C)C)c([O-])c1 ZINC000622402427 1052246941 /nfs/dbraw/zinc/24/69/41/1052246941.db2.gz WOUKUQBGKBHXHU-LJQANCHMSA-N -1 3 343.442 4.433 20 0 EIADHM CC(C)Oc1ccc(N(C)C(=O)c2cc3c(cc2[O-])CCCC3)cc1 ZINC000622557131 1052331446 /nfs/dbraw/zinc/33/14/46/1052331446.db2.gz YKWRKAWSYHOIBI-UHFFFAOYSA-N -1 3 339.435 4.335 20 0 EIADHM Cc1cccc(Nc2ccccc2C(=O)NCc2ncccc2[O-])c1C ZINC000622570894 1052340570 /nfs/dbraw/zinc/34/05/70/1052340570.db2.gz XHJAYRFOIAJAJO-UHFFFAOYSA-N -1 3 347.418 4.078 20 0 EIADHM CC(C)(C)[C@@H]1CCCN(C(=O)c2cc([O-])cc(C(F)(F)F)c2)C1 ZINC000622574341 1052341612 /nfs/dbraw/zinc/34/16/12/1052341612.db2.gz LQRJUNDUOJJVPT-GFCCVEGCSA-N -1 3 329.362 4.309 20 0 EIADHM C[C@@H](NC(=O)c1cc([O-])cc(C(F)(F)F)c1)C1CCC(F)CC1 ZINC000622752394 1052429291 /nfs/dbraw/zinc/42/92/91/1052429291.db2.gz BDDJWEWPQMSVCA-TTXORMCVSA-N -1 3 333.325 4.058 20 0 EIADHM COCc1c(C(=O)Nc2cc(F)ccc2[O-])sc2cccc(F)c21 ZINC000174890660 1052577325 /nfs/dbraw/zinc/57/73/25/1052577325.db2.gz KRRHHCJKJKYYLH-UHFFFAOYSA-N -1 3 349.358 4.284 20 0 EIADHM O=C(Nc1cccc([O-])c1F)c1cccc(Br)c1Cl ZINC000182949493 1052956525 /nfs/dbraw/zinc/95/65/25/1052956525.db2.gz IOGKPUCADKMEBA-UHFFFAOYSA-N -1 3 344.567 4.200 20 0 EIADHM O=C([O-])c1cccc(CN2CCC(Cc3ccccc3)CC2)c1Cl ZINC000381530487 1053081257 /nfs/dbraw/zinc/08/12/57/1053081257.db2.gz PGKKZRKUWUVGGD-UHFFFAOYSA-N -1 3 343.854 4.493 20 0 EIADHM O=C([O-])C[C@H](CNCc1csc(C2CC2)n1)C1CCCCCC1 ZINC000864523482 1053304469 /nfs/dbraw/zinc/30/44/69/1053304469.db2.gz XXCIOIKWCDFOQF-OAHLLOKOSA-N -1 3 336.501 4.171 20 0 EIADHM Cc1cc(=O)[n-]c(-c2cccc(OC(=O)[C@]3(C)CC=C(C)CC3)c2)n1 ZINC000850860514 1053375491 /nfs/dbraw/zinc/37/54/91/1053375491.db2.gz KGICKPWNTHDVBB-HXUWFJFHSA-N -1 3 338.407 4.200 20 0 EIADHM Cc1sc(Br)cc1C(=O)Nc1cc([O-])cc(Cl)c1 ZINC001195962371 1053534584 /nfs/dbraw/zinc/53/45/84/1053534584.db2.gz REOBOLJUWIOADD-UHFFFAOYSA-N -1 3 346.633 4.430 20 0 EIADHM O=C([N-]c1nc(C(F)(F)F)cs1)c1snc(Cl)c1Cl ZINC001196334084 1053642688 /nfs/dbraw/zinc/64/26/88/1053642688.db2.gz NSKUZMFPHDFVIH-UHFFFAOYSA-N -1 3 348.158 4.178 20 0 EIADHM COc1ccc(CN(C(=O)c2cc([O-])c3ccccc3c2)C2CC2)cc1 ZINC000471648363 1053684389 /nfs/dbraw/zinc/68/43/89/1053684389.db2.gz ULZIVYXUFUDNIC-UHFFFAOYSA-N -1 3 347.414 4.359 20 0 EIADHM CN(CCCOc1ccccc1)C(=O)c1cc([O-])c2ccccc2c1 ZINC000471734481 1053695121 /nfs/dbraw/zinc/69/51/21/1053695121.db2.gz GBOGQUUMHPWOQB-UHFFFAOYSA-N -1 3 335.403 4.087 20 0 EIADHM O=C1CCC(CSc2nnc([N-]c3ccccc3F)s2)CC1 ZINC000671653928 1053916454 /nfs/dbraw/zinc/91/64/54/1053916454.db2.gz KKSZOKDKAPRFOU-UHFFFAOYSA-N -1 3 337.445 4.272 20 0 EIADHM Cc1cc(NC([O-])=NO[C@H]2CCCCO2)ccc1-c1ccccc1 ZINC000775776135 1053917462 /nfs/dbraw/zinc/91/74/62/1053917462.db2.gz CYOFYVGRJAAJHS-SFHVURJKSA-N -1 3 326.396 4.242 20 0 EIADHM Cc1cc(NC(=O)[N-]O[C@H]2CCCCO2)ccc1-c1ccccc1 ZINC000775776135 1053917481 /nfs/dbraw/zinc/91/74/81/1053917481.db2.gz CYOFYVGRJAAJHS-SFHVURJKSA-N -1 3 326.396 4.242 20 0 EIADHM [O-]c1cc(NC(=S)Nc2ccc(OC(F)(F)F)cc2)ccc1F ZINC001197515875 1053922679 /nfs/dbraw/zinc/92/26/79/1053922679.db2.gz KNJFZTXEJFTSIC-UHFFFAOYSA-N -1 3 346.305 4.239 20 0 EIADHM O=S(=O)(Cc1cc(Cl)ccc1Cl)[N-]c1ccccc1F ZINC001197496186 1053926664 /nfs/dbraw/zinc/92/66/64/1053926664.db2.gz WFXIMOWUNCUQAE-UHFFFAOYSA-N -1 3 334.199 4.074 20 0 EIADHM O=C([N-]c1nnc(-c2ccco2)s1)c1ccc(C(F)(F)F)s1 ZINC000671664977 1053961991 /nfs/dbraw/zinc/96/19/91/1053961991.db2.gz BMUBUQLURGHSQX-UHFFFAOYSA-N -1 3 345.327 4.131 20 0 EIADHM C[C@]1(C[N-]C(=O)C(F)(F)c2cccc(Cl)c2Cl)CC1(F)F ZINC000855796443 1053977322 /nfs/dbraw/zinc/97/73/22/1053977322.db2.gz STIGPCREGPPMID-LLVKDONJSA-N -1 3 344.135 4.247 20 0 EIADHM Cc1cccc(F)c1[N-]S(=O)(=O)Cc1cccc(Cl)c1Cl ZINC001197749402 1053991221 /nfs/dbraw/zinc/99/12/21/1053991221.db2.gz JMRPLDIDDCAEME-UHFFFAOYSA-N -1 3 348.226 4.383 20 0 EIADHM Cc1nc(-c2ccc([C@@H](C)NC(=O)c3ccccc3[O-])cc2)cs1 ZINC000030694312 1054045433 /nfs/dbraw/zinc/04/54/33/1054045433.db2.gz DJUFHPQFPAPCRH-GFCCVEGCSA-N -1 3 338.432 4.315 20 0 EIADHM CC(C)Oc1nccnc1C(=O)[N-]c1ccccc1SC(C)(C)C ZINC001198057652 1054055282 /nfs/dbraw/zinc/05/52/82/1054055282.db2.gz ZXLUGZBQZXYGPE-UHFFFAOYSA-N -1 3 345.468 4.407 20 0 EIADHM Cc1c2cc(F)ccc2oc1C(=O)[N-]c1nnc(C(F)(F)F)s1 ZINC000031564941 1054069882 /nfs/dbraw/zinc/06/98/82/1054069882.db2.gz JRVYKBKUWCDIBB-UHFFFAOYSA-N -1 3 345.277 4.003 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N1CC2(CCC2)[C@H]1c1ccncc1 ZINC000856496280 1054079392 /nfs/dbraw/zinc/07/93/92/1054079392.db2.gz WBBLLKUQZBNIAA-HXUWFJFHSA-N -1 3 344.414 4.308 20 0 EIADHM C[C@H]1CN(C(=O)c2cc([O-])c3ccccc3c2)C[C@H](c2ccccc2)O1 ZINC000471878101 1054193601 /nfs/dbraw/zinc/19/36/01/1054193601.db2.gz WMPDCRGIXVGIDI-YCRPNKLZSA-N -1 3 347.414 4.148 20 0 EIADHM CC(C)c1ncsc1NC(=O)c1cc([O-])cc(C(F)(F)F)c1 ZINC000857279695 1054210332 /nfs/dbraw/zinc/21/03/32/1054210332.db2.gz AXJPWNIPFJBGCS-UHFFFAOYSA-N -1 3 330.331 4.243 20 0 EIADHM O=C(Nc1ccc(-c2cncnc2)cc1)c1cc([O-])c2ccccc2c1 ZINC000472161916 1054233820 /nfs/dbraw/zinc/23/38/20/1054233820.db2.gz XZPJZBUUQBMOOX-UHFFFAOYSA-N -1 3 341.370 4.255 20 0 EIADHM O=C(N[C@@H](C1CCCC1)C(F)(F)F)c1cc([O-])c2ccccc2c1 ZINC000472247527 1054253171 /nfs/dbraw/zinc/25/31/71/1054253171.db2.gz QUFLEBWNBGPEQL-INIZCTEOSA-N -1 3 337.341 4.396 20 0 EIADHM C[C@@H]1CN(C)c2ccccc2N(C(=O)c2cc([O-])c3ccccc3c2)C1 ZINC000472215311 1054254331 /nfs/dbraw/zinc/25/43/31/1054254331.db2.gz PTOBJPUKSIKKBG-OAHLLOKOSA-N -1 3 346.430 4.278 20 0 EIADHM CCc1ccccc1CC(=O)[N-]OCc1ccc(C(F)(F)F)cc1 ZINC000857474296 1054266567 /nfs/dbraw/zinc/26/65/67/1054266567.db2.gz ZSNZMDFYKXQXRB-UHFFFAOYSA-N -1 3 337.341 4.058 20 0 EIADHM O=C(C[C@H]1CCCN1C(=O)c1cc([O-])c2ccccc2c1)c1ccco1 ZINC000472332293 1054285683 /nfs/dbraw/zinc/28/56/83/1054285683.db2.gz ZOWPZXIYXUTLAS-MRXNPFEDSA-N -1 3 349.386 4.016 20 0 EIADHM Cc1ccncc1C[N-]C(=O)C(F)(F)c1cc(Cl)ccc1Cl ZINC000857526187 1054296784 /nfs/dbraw/zinc/29/67/84/1054296784.db2.gz HUWBGDQBGDJURE-UHFFFAOYSA-N -1 3 345.176 4.105 20 0 EIADHM C[C@H](NCc1ccc(N2CCCCCC2)nc1)c1cccc([O-])c1F ZINC000872025482 1054340835 /nfs/dbraw/zinc/34/08/35/1054340835.db2.gz NOJLDMCWCFSHCN-HNNXBMFYSA-N -1 3 343.446 4.158 20 0 EIADHM CC(C)c1nc(C(=O)[N-]c2c3nsnc3ccc2Cl)cs1 ZINC000776961543 1054353662 /nfs/dbraw/zinc/35/36/62/1054353662.db2.gz AVCXSMPICGOOLT-UHFFFAOYSA-N -1 3 338.845 4.177 20 0 EIADHM CC[C@H](C)C(=O)Nc1cccc(CN[C@@H](C)c2cccc([O-])c2F)c1 ZINC000872046644 1054358618 /nfs/dbraw/zinc/35/86/18/1054358618.db2.gz KBNUICLKLJPUEH-KBPBESRZSA-N -1 3 344.430 4.367 20 0 EIADHM CCn1c2ccccc2nc1[C@H](C)N[C@H](C)c1cccc([O-])c1F ZINC000872045217 1054358704 /nfs/dbraw/zinc/35/87/04/1054358704.db2.gz KAMBYJLDTMYXSJ-OLZOCXBDSA-N -1 3 327.403 4.313 20 0 EIADHM COc1cc(N[C@H](C)c2cccc([O-])c2F)ccc1OC(F)F ZINC000872088410 1054384747 /nfs/dbraw/zinc/38/47/47/1054384747.db2.gz OAWVNXDSAGNTIH-SECBINFHSA-N -1 3 327.302 4.314 20 0 EIADHM Cc1oc(C(=O)[O-])cc1CN1CCC(Cc2ccccc2Cl)CC1 ZINC000872163573 1054416281 /nfs/dbraw/zinc/41/62/81/1054416281.db2.gz JMDAJJRNHDLXQM-UHFFFAOYSA-N -1 3 347.842 4.394 20 0 EIADHM O=C([O-])c1ccoc1CN1CCC(Cc2ccc(Cl)cc2)CC1 ZINC000872164295 1054416441 /nfs/dbraw/zinc/41/64/41/1054416441.db2.gz RRVGDEBKONYUMN-UHFFFAOYSA-N -1 3 333.815 4.086 20 0 EIADHM CC[C@@H](C)c1ccccc1NC(=O)[C@H](C)OC(=O)c1ccc([O-])cc1 ZINC000005061038 1054482882 /nfs/dbraw/zinc/48/28/82/1054482882.db2.gz AJQYFFYTMUZIRV-KGLIPLIRSA-N -1 3 341.407 4.090 20 0 EIADHM [O-]c1cccc2sc(NC(=S)Nc3cccc(Cl)c3)nc21 ZINC001201093748 1054655129 /nfs/dbraw/zinc/65/51/29/1054655129.db2.gz MOCVGSVYVXDUDN-UHFFFAOYSA-N -1 3 335.841 4.464 20 0 EIADHM O=C(NCCSCCC(F)(F)F)c1cc2sccc2c([O-])c1 ZINC000825730858 1054660823 /nfs/dbraw/zinc/66/08/23/1054660823.db2.gz XGARKFHXBJJJGR-UHFFFAOYSA-N -1 3 349.399 4.022 20 0 EIADHM C[C@H]([N-]C(=O)C(F)(F)c1ccccc1)c1ccc(C(F)(F)F)nc1 ZINC000874646208 1054714642 /nfs/dbraw/zinc/71/46/42/1054714642.db2.gz SATABKQTSTWJGX-JTQLQIEISA-N -1 3 344.283 4.070 20 0 EIADHM CC(C)Sc1ccccc1[N-]C(=O)c1c(Cl)nn(C)c1Cl ZINC000875448173 1054791249 /nfs/dbraw/zinc/79/12/49/1054791249.db2.gz NMHHKEBSRMRTMG-UHFFFAOYSA-N -1 3 344.267 4.480 20 0 EIADHM O=C([N-]c1cc(Cl)cc(Cl)c1F)c1snnc1C1CC1 ZINC000876461226 1054907989 /nfs/dbraw/zinc/90/79/89/1054907989.db2.gz OQLNFVFFWOKAGG-UHFFFAOYSA-N -1 3 332.187 4.114 20 0 EIADHM O=C([N-]c1n[nH]c(-c2cccc3ccccc32)n1)c1ccc(Cl)o1 ZINC000065514772 1054932934 /nfs/dbraw/zinc/93/29/34/1054932934.db2.gz FHJZDFDENCXINZ-UHFFFAOYSA-N -1 3 338.754 4.124 20 0 EIADHM CCC(C)(C)C1CCC(NC(=O)c2cc(NC(C)=O)ccc2[O-])CC1 ZINC000065624268 1054944983 /nfs/dbraw/zinc/94/49/83/1054944983.db2.gz FCFGCMPFTCUKIB-UHFFFAOYSA-N -1 3 346.471 4.075 20 0 EIADHM CCC1CCC(N(C(=O)c2cc(=O)c3ccccc3[n-]2)C2CC2)CC1 ZINC000065893857 1054977196 /nfs/dbraw/zinc/97/71/96/1054977196.db2.gz SNZYZCHXIDMDSK-UHFFFAOYSA-N -1 3 338.451 4.102 20 0 EIADHM CC[C@@H](C)[C@@H](NC(=O)c1cc([O-])c2ccccc2c1)C(F)(F)F ZINC000473229204 1055012637 /nfs/dbraw/zinc/01/26/37/1055012637.db2.gz IERJHJZCMZWPLI-MEBBXXQBSA-N -1 3 325.330 4.252 20 0 EIADHM O=C(Nc1c([O-])cccc1Br)Nc1c(F)cccc1F ZINC001202041882 1055017113 /nfs/dbraw/zinc/01/71/13/1055017113.db2.gz JQAHDFXOFUCFFD-UHFFFAOYSA-N -1 3 343.127 4.077 20 0 EIADHM Cc1oc(-c2ccccc2)nc1CC(=O)Nc1cc(Cl)ccc1[O-] ZINC000067139053 1055028318 /nfs/dbraw/zinc/02/83/18/1055028318.db2.gz QPRCCOZYQWEUMJ-UHFFFAOYSA-N -1 3 342.782 4.190 20 0 EIADHM Cc1ccc([C@H]2CCCN2Cc2nnc(-c3ccccc3[O-])o2)cc1 ZINC000877891793 1055146329 /nfs/dbraw/zinc/14/63/29/1055146329.db2.gz FPQDREONSQDGBP-QGZVFWFLSA-N -1 3 335.407 4.088 20 0 EIADHM CC(C)[C@H](NCc1nnc(-c2ccccc2[O-])o1)c1ccc(F)cc1 ZINC000878205829 1055207298 /nfs/dbraw/zinc/20/72/98/1055207298.db2.gz ROBAVBXTSGMJPB-SFHVURJKSA-N -1 3 341.386 4.068 20 0 EIADHM CC[C@@H](C)c1nc(C)c(CC(=O)Nc2c([O-])cccc2Cl)c(C)n1 ZINC000655110429 1055478342 /nfs/dbraw/zinc/47/83/42/1055478342.db2.gz VTGXVPPJYAPVBO-SNVBAGLBSA-N -1 3 347.846 4.147 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)c1ccc(-c2ccccc2Cl)o1 ZINC000303860339 1056329321 /nfs/dbraw/zinc/32/93/21/1056329321.db2.gz WKUSUIFVUXXYRQ-UHFFFAOYSA-N -1 3 345.757 4.375 20 0 EIADHM C[C@@H]1C[C@H](C)N(Cc2cc(Cl)cc(Cl)c2)[C@@H](C)[C@@H]1C(=O)[O-] ZINC000903953326 1056592992 /nfs/dbraw/zinc/59/29/92/1056592992.db2.gz QUMAYCBQPUULIO-DZHLUBAWSA-N -1 3 330.255 4.313 20 0 EIADHM CCc1cccc(C)c1[N-]S(=O)(=O)c1ccc2c(c1)CCCC2 ZINC000007053464 1056762128 /nfs/dbraw/zinc/76/21/28/1056762128.db2.gz IAATYPMDZRJANN-UHFFFAOYSA-N -1 3 329.465 4.237 20 0 EIADHM [O-]c1ccc(CNC(=S)Nc2ccc(Cl)cc2Cl)cc1F ZINC000737461889 1058563367 /nfs/dbraw/zinc/56/33/67/1058563367.db2.gz RRIXCGZKMBMTFA-UHFFFAOYSA-N -1 3 345.226 4.325 20 0 EIADHM CCCC[C@@H](CC)C(=O)Oc1cccc(-c2nc(C)cc(=O)[n-]2)c1 ZINC000744218554 1059334087 /nfs/dbraw/zinc/33/40/87/1059334087.db2.gz MYCRSNASEGNYKO-CQSZACIVSA-N -1 3 328.412 4.279 20 0 EIADHM Cc1cc(=O)[n-]c(-c2cccc(OC(=O)[C@@H](C)CC3CCCC3)c2)n1 ZINC000744219992 1059336995 /nfs/dbraw/zinc/33/69/95/1059336995.db2.gz ZNEVTJGQJRGZRY-ZDUSSCGKSA-N -1 3 340.423 4.279 20 0 EIADHM Cc1sc(NC(=O)COC(=O)c2cc3ccsc3[n-]2)c(C)c1C ZINC000744543250 1059573483 /nfs/dbraw/zinc/57/34/83/1059573483.db2.gz WAMJLOKFRDPVGA-UHFFFAOYSA-N -1 3 348.449 4.012 20 0 EIADHM C[C@@H](OC(=O)c1cc2ccsc2[n-]1)c1nc(-c2ccccc2)no1 ZINC000744542177 1059574582 /nfs/dbraw/zinc/57/45/82/1059574582.db2.gz KVZYYQKJVDTXKJ-SNVBAGLBSA-N -1 3 339.376 4.197 20 0 EIADHM Cc1sc2[n-]c([C@H](C)OC(=O)[C@H]3CCC[C@@H](C)C3)nc(=O)c2c1C ZINC000745157867 1059760428 /nfs/dbraw/zinc/76/04/28/1059760428.db2.gz LAGDXQHAZKKHFH-CDMKHQONSA-N -1 3 348.468 4.444 20 0 EIADHM C[C@@H]1CCC[C@H](OCCCCCC(=O)[N-]OCc2ccccc2)C1 ZINC000766329480 1059820949 /nfs/dbraw/zinc/82/09/49/1059820949.db2.gz MVNKYJJQCWHXQS-MJGOQNOKSA-N -1 3 333.472 4.390 20 0 EIADHM Cc1csc(C(=O)[N-]c2c(C)noc2C2CC2)c1Br ZINC000191004222 1060183786 /nfs/dbraw/zinc/18/37/86/1060183786.db2.gz WTHNKUDOJIQMBU-UHFFFAOYSA-N -1 3 341.230 4.245 20 0 EIADHM Nc1cc(Br)cc(F)c1Nc1c(Cl)ccc([O-])c1F ZINC001214561403 1060355535 /nfs/dbraw/zinc/35/55/35/1060355535.db2.gz KNPFURDEERRBQQ-UHFFFAOYSA-N -1 3 349.562 4.412 20 0 EIADHM CC[C@H](NCc1nc(=O)c2sccc2[n-]1)c1ccc(C)c(F)c1 ZINC001168838074 1060450173 /nfs/dbraw/zinc/45/01/73/1060450173.db2.gz LSSKBXCHZSGJMI-ZDUSSCGKSA-N -1 3 331.416 4.085 20 0 EIADHM Cc1cc(CNc2ccc3c(c2)[N-]C(=S)C3)ncc1Br ZINC001169203228 1060685854 /nfs/dbraw/zinc/68/58/54/1060685854.db2.gz UKQNCVRNVXAHKE-UHFFFAOYSA-N -1 3 348.269 4.060 20 0 EIADHM COC(=O)c1cccc2nc(Nc3ccc(Cl)c([O-])c3)sc21 ZINC001212588641 1060758449 /nfs/dbraw/zinc/75/84/49/1060758449.db2.gz WNSJXJKXUFOGRJ-UHFFFAOYSA-N -1 3 334.784 4.186 20 0 EIADHM COc1cccc(C2(NC(=O)c3cc4sccc4c([O-])c3)CC2)c1 ZINC000804322549 1060814361 /nfs/dbraw/zinc/81/43/61/1060814361.db2.gz IZMWYCPADSUMEA-UHFFFAOYSA-N -1 3 339.416 4.035 20 0 EIADHM [O-]c1cc(Nc2ccc3nnc(-c4ccccc4)n3c2)ccc1Cl ZINC001212590320 1060818559 /nfs/dbraw/zinc/81/85/59/1060818559.db2.gz GTKNPPGWDWSXGN-UHFFFAOYSA-N -1 3 336.782 4.499 20 0 EIADHM Cc1cnn(Cc2ccccc2F)c1Nc1ccc(Cl)c([O-])c1 ZINC001212590289 1060818729 /nfs/dbraw/zinc/81/87/29/1060818729.db2.gz FBRGPMDSNKNXOK-UHFFFAOYSA-N -1 3 331.778 4.482 20 0 EIADHM COc1ccc(Cn2nc(C)cc2Nc2ccc(Cl)c([O-])c2)cc1 ZINC001212590349 1060826084 /nfs/dbraw/zinc/82/60/84/1060826084.db2.gz IFYXXPMWTFGYPC-UHFFFAOYSA-N -1 3 343.814 4.351 20 0 EIADHM [O-]c1cc(Nc2ccn3c(Br)cnc3c2)ccc1Cl ZINC001212590580 1060831734 /nfs/dbraw/zinc/83/17/34/1060831734.db2.gz SSPSPTRBVMYANJ-UHFFFAOYSA-N -1 3 338.592 4.199 20 0 EIADHM COc1ccccc1-n1nc(C)cc1Nc1ccc(Cl)c([O-])c1 ZINC001212590687 1060841521 /nfs/dbraw/zinc/84/15/21/1060841521.db2.gz YPGRKGKQKMIIST-UHFFFAOYSA-N -1 3 329.787 4.292 20 0 EIADHM [O-]c1cc(Nc2ccc3nc(-c4ccccc4)nn3c2)ccc1Cl ZINC001212591444 1060857699 /nfs/dbraw/zinc/85/76/99/1060857699.db2.gz MZVDDVFNJMCKMR-UHFFFAOYSA-N -1 3 336.782 4.499 20 0 EIADHM Cc1ccc2nc(NCc3ncccc3[O-])nc(-c3ccccc3)c2c1 ZINC001169732075 1060934367 /nfs/dbraw/zinc/93/43/67/1060934367.db2.gz HJGJXHOKMNJBGJ-UHFFFAOYSA-N -1 3 342.402 4.318 20 0 EIADHM [O-]c1ccc(-c2noc(-c3ccc(F)cc3Br)n2)cc1 ZINC000034956071 202282749 /nfs/dbraw/zinc/28/27/49/202282749.db2.gz MBSHDNVWGCPTPX-UHFFFAOYSA-N -1 3 335.132 4.011 20 0 EIADHM CCC1(C(=O)Nc2cccc(C(C)=O)c2[O-])CCC(F)(F)CC1 ZINC000614862223 1032101794 /nfs/dbraw/zinc/10/17/94/1032101794.db2.gz XDLSONYFFWUWQJ-UHFFFAOYSA-N -1 3 325.355 4.139 20 0 EIADHM Cc1ccc(C)c(S(=O)(=O)[N-]c2ccc(OC(C)C)cc2C)c1 ZINC000614863554 1032102398 /nfs/dbraw/zinc/10/23/98/1032102398.db2.gz ABULWGDOHBHRQV-UHFFFAOYSA-N -1 3 333.453 4.200 20 0 EIADHM Cc1cccc([C@H]2CCCN2C(=O)Cc2ccc([O-])c(F)c2)c1C ZINC000449930411 1032132010 /nfs/dbraw/zinc/13/20/10/1032132010.db2.gz VSRIOXOSDQKZOY-GOSISDBHSA-N -1 3 327.399 4.054 20 0 EIADHM CCCc1cc(=O)[n-]c(C(=Cc2ccc(OC(F)F)cc2)CC)n1 ZINC000193619694 1032165459 /nfs/dbraw/zinc/16/54/59/1032165459.db2.gz QRGIEXREXGPIEF-RAXLEYEMSA-N -1 3 334.366 4.274 20 0 EIADHM CN(CCC/N=C/c1cc(Br)ccc1[O-])c1ccccc1 ZINC000005228478 1032206798 /nfs/dbraw/zinc/20/67/98/1032206798.db2.gz LLQPBAQEWFGXPT-CPNJWEJPSA-N -1 3 347.256 4.100 20 0 EIADHM Cc1nc2ccc(Nc3cc(Br)cc(F)c3[O-])cc2o1 ZINC001213068497 1032263078 /nfs/dbraw/zinc/26/30/78/1032263078.db2.gz NSGCFXQWYFCHLG-UHFFFAOYSA-N -1 3 337.148 4.487 20 0 EIADHM Cc1ccc(C)c([C@H]2CCCN2C(=O)Cc2ccc([O-])c(F)c2)c1 ZINC000450127901 1032305689 /nfs/dbraw/zinc/30/56/89/1032305689.db2.gz NBEGOCGJCGCYHX-GOSISDBHSA-N -1 3 327.399 4.054 20 0 EIADHM O=C(Nc1ccc(Cl)cc1[O-])c1ccc(Br)cc1 ZINC000532836543 1032340925 /nfs/dbraw/zinc/34/09/25/1032340925.db2.gz DPWXYTQPWHHWGO-UHFFFAOYSA-N -1 3 326.577 4.060 20 0 EIADHM O=C(Nc1ccc(Cl)cc1[O-])c1cc(Cl)cc2cccnc21 ZINC000532837542 1032342767 /nfs/dbraw/zinc/34/27/67/1032342767.db2.gz OQFVPGRQVBNBLZ-UHFFFAOYSA-N -1 3 333.174 4.500 20 0 EIADHM O=C(Nc1ccc(Cl)cc1[O-])c1csc(Br)c1 ZINC000532836969 1032343610 /nfs/dbraw/zinc/34/36/10/1032343610.db2.gz KUPNSTMQDOGTAL-UHFFFAOYSA-N -1 3 332.606 4.122 20 0 EIADHM C[C@@H](Oc1ccccc1Cl)C(=O)Nc1ccc(Cl)cc1[O-] ZINC000532840723 1032345274 /nfs/dbraw/zinc/34/52/74/1032345274.db2.gz WELJYGAPPORJGS-SECBINFHSA-N -1 3 326.179 4.105 20 0 EIADHM Cc1cccc([N-]S(=O)(=O)c2cccc3c(C)ccnc32)c1Cl ZINC000547631302 1018901545 /nfs/dbraw/zinc/90/15/45/1018901545.db2.gz DVECUVOHVYCBAC-UHFFFAOYSA-N -1 3 346.839 4.306 20 0 EIADHM Cc1ccc(Oc2ccccc2NC(=O)NCc2ncccc2[O-])cc1 ZINC000471120021 1018987590 /nfs/dbraw/zinc/98/75/90/1018987590.db2.gz CMVHNLKAJKIPTR-UHFFFAOYSA-N -1 3 349.390 4.210 20 0 EIADHM O=c1[n-]nc([C@@H]2CCCN(Cc3sc4ccccc4c3Cl)C2)o1 ZINC000340217653 1020639240 /nfs/dbraw/zinc/63/92/40/1020639240.db2.gz JZYOMUUEGMPHPF-SNVBAGLBSA-N -1 3 349.843 4.023 20 0 EIADHM Cc1cc(F)c(C(=O)[N-]c2nc(-c3ccccc3)ns2)cc1F ZINC000121853088 1021073228 /nfs/dbraw/zinc/07/32/28/1021073228.db2.gz ULEPHQSOOHJVMU-UHFFFAOYSA-N -1 3 331.347 4.044 20 0 EIADHM COc1cccc(CC2(C(=O)[N-]OCC3CCC3)CCCCC2)c1 ZINC001167368987 1021775774 /nfs/dbraw/zinc/77/57/74/1021775774.db2.gz NCUPTOXRQFQQTQ-UHFFFAOYSA-N -1 3 331.456 4.036 20 0 EIADHM NC(=O)c1ccc(Nc2cc(Cl)c(Cl)cc2Cl)cc1[O-] ZINC001210828746 1021782117 /nfs/dbraw/zinc/78/21/17/1021782117.db2.gz WWZSDFIDEBFJPH-UHFFFAOYSA-N -1 3 331.586 4.195 20 0 EIADHM Cc1ccc(C)c(Oc2cccc(Cl)c2CNCC(=O)[O-])c1C ZINC000340684739 1021990867 /nfs/dbraw/zinc/99/08/67/1021990867.db2.gz UHJVDZJHWDNTBA-UHFFFAOYSA-N -1 3 333.815 4.232 20 0 EIADHM Cc1c(-c2ccccc2)sc2[n-]c(COC3CCCC3)nc(=O)c12 ZINC000174446959 1022075456 /nfs/dbraw/zinc/07/54/56/1022075456.db2.gz RBNAOFVEENYDMD-UHFFFAOYSA-N -1 3 340.448 4.419 20 0 EIADHM COc1cccc(C(F)(F)C(=O)[N-][C@H](C)c2ccc(Cl)s2)c1 ZINC001266626157 1022241609 /nfs/dbraw/zinc/24/16/09/1022241609.db2.gz ZGAIBSYXCIWOTM-SECBINFHSA-N -1 3 345.798 4.379 20 0 EIADHM CC(C)c1cccc(S(=O)(=O)[N-]c2cc(F)c(F)cc2F)c1 ZINC000460830134 1022245934 /nfs/dbraw/zinc/24/59/34/1022245934.db2.gz OOPGFRLVAAYDPZ-UHFFFAOYSA-N -1 3 329.343 4.028 20 0 EIADHM O=C([N-]c1nc(-c2cccs2)ns1)c1ccc(Cl)s1 ZINC000182125364 1022311526 /nfs/dbraw/zinc/31/15/26/1022311526.db2.gz IAFNCVPNSSNEPH-UHFFFAOYSA-N -1 3 327.843 4.234 20 0 EIADHM Cc1sc2[n-]c([C@@H](C)OC(=O)[C@H]3CCC(C)(C)C3)nc(=O)c2c1C ZINC000781698552 1022422807 /nfs/dbraw/zinc/42/28/07/1022422807.db2.gz PUDADLIJUGLBHQ-PWSUYJOCSA-N -1 3 348.468 4.444 20 0 EIADHM Cc1nccn1CCCC(=O)Nc1cc(Cl)c([O-])c2ccccc12 ZINC001167439970 1022741730 /nfs/dbraw/zinc/74/17/30/1022741730.db2.gz NYPFGBPMJQRRKY-UHFFFAOYSA-N -1 3 343.814 4.123 20 0 EIADHM C[C@@H](C(=O)NCc1ccc([O-])c(F)c1)c1ccc(Cl)c(Cl)c1 ZINC000472609658 1022852036 /nfs/dbraw/zinc/85/20/36/1022852036.db2.gz QUTDCEDVJMPGFF-SECBINFHSA-N -1 3 342.197 4.258 20 0 EIADHM Cc1ccc([C@@H]2CCCCCN2C(=O)NCc2ccc([O-])c(F)c2)o1 ZINC000163724930 1022864292 /nfs/dbraw/zinc/86/42/92/1022864292.db2.gz SPPTVVMEIWWGPT-INIZCTEOSA-N -1 3 346.402 4.260 20 0 EIADHM CCc1ccc([C@H]2CCCCCN2Cc2nc(CC)cc(=O)[n-]2)o1 ZINC001167454962 1023033457 /nfs/dbraw/zinc/03/34/57/1023033457.db2.gz ZXKLUJOWDJSYDA-MRXNPFEDSA-N -1 3 329.444 4.017 20 0 EIADHM Cc1ccc(F)c(-c2noc(C=C([O-])c3ccccc3Cl)n2)c1 ZINC001211645362 1023129336 /nfs/dbraw/zinc/12/93/36/1023129336.db2.gz SLENNGPPEDPENC-UHFFFAOYSA-N -1 3 330.746 4.263 20 0 EIADHM CCc1cc(C(=O)Nc2cccc([O-])c2F)c2c(n1)onc2C(C)C ZINC000549104455 1023140750 /nfs/dbraw/zinc/14/07/50/1023140750.db2.gz PGEWOGNNCUKXIK-UHFFFAOYSA-N -1 3 343.358 4.006 20 0 EIADHM Cc1ccc(F)cc1-c1noc(C=C([O-])c2ccccc2Cl)n1 ZINC001211646956 1023209882 /nfs/dbraw/zinc/20/98/82/1023209882.db2.gz FEKIJDIWEFLKCH-UHFFFAOYSA-N -1 3 330.746 4.263 20 0 EIADHM Cc1c(F)ccc(-c2noc(C=C([O-])c3ccccc3Cl)n2)c1F ZINC001211647613 1023233886 /nfs/dbraw/zinc/23/38/86/1023233886.db2.gz YWIJPLMTZOJYMH-UHFFFAOYSA-N -1 3 348.736 4.402 20 0 EIADHM CC(C)C[C@@H](N)c1noc(-c2cc(Oc3ccccc3)ccc2[O-])n1 ZINC000414619871 1023297452 /nfs/dbraw/zinc/29/74/52/1023297452.db2.gz KUGPRIFDRJHMBJ-MRXNPFEDSA-N -1 3 339.395 4.280 20 0 EIADHM C[C@@H]1CCN(CCSc2cc(Cl)ccc2Cl)C[C@H]1C(=O)[O-] ZINC000584779979 1023311510 /nfs/dbraw/zinc/31/15/10/1023311510.db2.gz ZISHGQYQBOTYBS-ZYHUDNBSSA-N -1 3 348.295 4.128 20 0 EIADHM O=C([O-])[C@H](CCc1ccccc1)NCc1cc(Cl)sc1Cl ZINC000417554177 1023354490 /nfs/dbraw/zinc/35/44/90/1023354490.db2.gz JGBBZZZUAZCHIE-LBPRGKRZSA-N -1 3 344.263 4.231 20 0 EIADHM Cc1ccc(C[C@H](CNCc2c(F)cc(C)cc2Cl)C(=O)[O-])cc1 ZINC000417568191 1023361845 /nfs/dbraw/zinc/36/18/45/1023361845.db2.gz POSPMQWTILTWRX-OAHLLOKOSA-N -1 3 349.833 4.129 20 0 EIADHM O=C([O-])[C@H]1C[C@@H](NCc2cnc(C3CCCC3)s2)c2ccccc21 ZINC000417630002 1023381090 /nfs/dbraw/zinc/38/10/90/1023381090.db2.gz QQZBKWIAPZFZMA-DLBZAZTESA-N -1 3 342.464 4.204 20 0 EIADHM C[C@H](CCC[C@@H](C)C(=O)[O-])NCc1csc(-c2ccsc2)n1 ZINC000388324377 1023456118 /nfs/dbraw/zinc/45/61/18/1023456118.db2.gz DWLKVSLUGRHQBB-VXGBXAGGSA-N -1 3 338.498 4.241 20 0 EIADHM O=C([O-])[C@@H]1CCN(Cc2c(Cl)cccc2Cl)[C@@H]2CCCC[C@H]12 ZINC000656765799 1023510488 /nfs/dbraw/zinc/51/04/88/1023510488.db2.gz OSMZSLQXCLGMKN-XHBSWPGZSA-N -1 3 342.266 4.459 20 0 EIADHM CCCOc1ccc(C=C(CC)c2nc(CCC)cc(=O)[n-]2)cc1 ZINC000581704484 1023625605 /nfs/dbraw/zinc/62/56/05/1023625605.db2.gz LBBQUWATIVJGNJ-SSZFMOIBSA-N -1 3 326.440 4.462 20 0 EIADHM Cc1cccnc1C(F)(F)C(=O)[N-][C@@H](C)c1ccc(F)cc1Cl ZINC000192574007 1023630454 /nfs/dbraw/zinc/63/04/54/1023630454.db2.gz MWHAOHGJNBASLB-JTQLQIEISA-N -1 3 342.748 4.152 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1cccc(Br)c1 ZINC000058867206 1023648056 /nfs/dbraw/zinc/64/80/56/1023648056.db2.gz KMGGOFSAPXEHSP-UHFFFAOYSA-N -1 3 326.577 4.060 20 0 EIADHM Cc1nc(-c2c[nH]c(C(=O)Nc3c([O-])cccc3Cl)c2)cs1 ZINC000581754917 1023674493 /nfs/dbraw/zinc/67/44/93/1023674493.db2.gz NCVHKVZCWFNWJG-UHFFFAOYSA-N -1 3 333.800 4.058 20 0 EIADHM Cc1ccc(NC2c3ccccc3-c3ccccc32)cc1-c1nnn[n-]1 ZINC001167777589 1024067117 /nfs/dbraw/zinc/06/71/17/1024067117.db2.gz RFDTTZXIBHMQBA-UHFFFAOYSA-N -1 3 339.402 4.357 20 0 EIADHM Cc1ccc(NC2c3ccccc3-c3ccccc32)cc1-c1nn[n-]n1 ZINC001167777589 1024067128 /nfs/dbraw/zinc/06/71/28/1024067128.db2.gz RFDTTZXIBHMQBA-UHFFFAOYSA-N -1 3 339.402 4.357 20 0 EIADHM Cc1cccc(C)c1[C@@H]1CCCN1Cc1nc(=O)c2sccc2[n-]1 ZINC000661132263 1024259910 /nfs/dbraw/zinc/25/99/10/1024259910.db2.gz HMLOQUNEFZLSFE-HNNXBMFYSA-N -1 3 339.464 4.351 20 0 EIADHM CCc1onc(C)c1NC(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000091696588 1024350823 /nfs/dbraw/zinc/35/08/23/1024350823.db2.gz OBCGPBHFWWBTOZ-UHFFFAOYSA-N -1 3 336.391 4.094 20 0 EIADHM Cc1cc(N2CCCC[C@H]2C)ccc1NC(=O)c1c([O-])cccc1O ZINC000092124729 1024660259 /nfs/dbraw/zinc/66/02/59/1024660259.db2.gz OHQRLLYJZRHBKV-CQSZACIVSA-N -1 3 340.423 4.037 20 0 EIADHM O=C([O-])[C@@H](c1ccc(F)cc1)N1CC[C@H](C(F)(F)F)C2(CCC2)C1 ZINC000652446935 1024836665 /nfs/dbraw/zinc/83/66/65/1024836665.db2.gz GVFILYHVNJCWIQ-UONOGXRCSA-N -1 3 345.336 4.006 20 0 EIADHM C[C@H](c1cccs1)N(C)C(=O)c1c[n-]c2c(Cl)cccc2c1=O ZINC000341873874 1024845460 /nfs/dbraw/zinc/84/54/60/1024845460.db2.gz HPFCDVXZTQFZSJ-SNVBAGLBSA-N -1 3 346.839 4.076 20 0 EIADHM CCSc1ccc(Cl)cc1[N-]C(=O)c1cn2ccnc2s1 ZINC000188281662 1024931915 /nfs/dbraw/zinc/93/19/15/1024931915.db2.gz ZZSUJQSYJCZZQK-UHFFFAOYSA-N -1 3 337.857 4.414 20 0 EIADHM Cc1ccc(-c2nc3ccc(F)cc3c(=O)[n-]2)cc1Br ZINC000535780463 1024948614 /nfs/dbraw/zinc/94/86/14/1024948614.db2.gz SLCXWDSONRKWNO-UHFFFAOYSA-N -1 3 333.160 4.212 20 0 EIADHM CN(CCc1ccccc1)C(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000110230248 1033247830 /nfs/dbraw/zinc/24/78/30/1033247830.db2.gz JMAZHNDAXUBZTI-UHFFFAOYSA-N -1 3 345.442 4.298 20 0 EIADHM [O-]c1ccc(OCc2ccccc2)cc1-c1nc(-c2ccccn2)no1 ZINC000184838791 1024981405 /nfs/dbraw/zinc/98/14/05/1024981405.db2.gz GEZQQIVIDTWJGP-UHFFFAOYSA-N -1 3 345.358 4.083 20 0 EIADHM Cn1ccc(C(=O)Nc2cc(Br)ccc2[O-])c1C1CCC1 ZINC000343899914 1025189919 /nfs/dbraw/zinc/18/99/19/1025189919.db2.gz UIXGAEYSGXZWRM-UHFFFAOYSA-N -1 3 349.228 4.013 20 0 EIADHM CSc1ccc([N-]S(=O)(=O)c2ccc3c(c2)CCCC3)cc1 ZINC000007745957 1025452083 /nfs/dbraw/zinc/45/20/83/1025452083.db2.gz ZMXBIROILNPUII-UHFFFAOYSA-N -1 3 333.478 4.088 20 0 EIADHM CC[C@H](C)[C@@H](C)[N-]S(=O)(=O)c1ccc(Cl)cc1C(F)(F)F ZINC000512029403 1025792994 /nfs/dbraw/zinc/79/29/94/1025792994.db2.gz CBXOHAZHPXWREY-DTWKUNHWSA-N -1 3 343.798 4.072 20 0 EIADHM O=C([O-])[C@H](CCCNCc1c(F)cccc1Cl)Cc1ccccc1 ZINC000426642348 1025840066 /nfs/dbraw/zinc/84/00/66/1025840066.db2.gz HTSNJEQOYMCFPA-OAHLLOKOSA-N -1 3 349.833 4.292 20 0 EIADHM O=C([N-]c1nnc(C(F)(F)F)s1)c1cc2cc(F)ccc2s1 ZINC000344056078 1025918458 /nfs/dbraw/zinc/91/84/58/1025918458.db2.gz IDGNDLQZQMOIQG-UHFFFAOYSA-N -1 3 347.318 4.163 20 0 EIADHM Cc1cc(O[C@@H](C)C(=O)Nc2cc(Cl)ccc2[O-])ccc1Cl ZINC000111210364 1026097658 /nfs/dbraw/zinc/09/76/58/1026097658.db2.gz AFXSUQJZIOELGC-JTQLQIEISA-N -1 3 340.206 4.413 20 0 EIADHM C[C@@H](c1nc2ccccc2s1)N(C)CCc1ccccc1C(=O)[O-] ZINC000325759158 1026099505 /nfs/dbraw/zinc/09/95/05/1026099505.db2.gz INXPBIFVXDPZFX-ZDUSSCGKSA-N -1 3 340.448 4.230 20 0 EIADHM CCCn1c2ccccc2nc1NC(=O)c1cc([O-])ccc1Cl ZINC000550126159 1026203488 /nfs/dbraw/zinc/20/34/88/1026203488.db2.gz OXXUHWIXVTYVQJ-UHFFFAOYSA-N -1 3 329.787 4.058 20 0 EIADHM C[C@H]1C[C@@H](CC[N-]S(=O)(=O)c2ccc(F)cc2F)CC(C)(C)C1 ZINC001211704582 1026394527 /nfs/dbraw/zinc/39/45/27/1026394527.db2.gz BHLYARSUFZUXME-QWHCGFSZSA-N -1 3 345.455 4.096 20 0 EIADHM O=C(c1ccccc1[O-])N(CCc1ccccc1)Cc1ccccc1 ZINC000582289447 1026416705 /nfs/dbraw/zinc/41/67/05/1026416705.db2.gz IHWGVDDKHYITFB-UHFFFAOYSA-N -1 3 331.415 4.277 20 0 EIADHM O=C([O-])C[C@H](NCc1cnc(-c2ccccc2)s1)c1ccsc1 ZINC000426689422 1026492139 /nfs/dbraw/zinc/49/21/39/1026492139.db2.gz VEZPYNDNLNTQFN-HNNXBMFYSA-N -1 3 344.461 4.177 20 0 EIADHM O=C([O-])C[C@@H](NCc1cccc(-c2ccncc2)c1)c1ccsc1 ZINC000426693198 1026494968 /nfs/dbraw/zinc/49/49/68/1026494968.db2.gz YHXCXKPUKRQHON-GOSISDBHSA-N -1 3 338.432 4.116 20 0 EIADHM CCOc1cc(CN2CCc3cc(F)ccc3C2)cc(Cl)c1[O-] ZINC000559927908 1026527321 /nfs/dbraw/zinc/52/73/21/1026527321.db2.gz GHRDHNLXPILZAP-UHFFFAOYSA-N -1 3 335.806 4.142 20 0 EIADHM C[C@H](C(=O)[O-])[C@@H](NCc1ccc(-c2ccccc2)o1)c1ccccc1 ZINC000426753070 1026538191 /nfs/dbraw/zinc/53/81/91/1026538191.db2.gz GPADKTJTDMRFGM-MGPUTAFESA-N -1 3 335.403 4.498 20 0 EIADHM COc1ccc(C)cc1CN[C@H](CC(=O)[O-])c1ccc(C(C)C)cc1 ZINC000426770778 1026549008 /nfs/dbraw/zinc/54/90/08/1026549008.db2.gz VWFOAHOMHBNCRH-LJQANCHMSA-N -1 3 341.451 4.433 20 0 EIADHM O=C([O-])C[C@H](NCc1cc2ccc(F)cc2[nH]1)c1ccc(Cl)cc1 ZINC000426771239 1026550558 /nfs/dbraw/zinc/55/05/58/1026550558.db2.gz ZZMFHLKQJDNNAJ-INIZCTEOSA-N -1 3 346.789 4.266 20 0 EIADHM CC(C)c1ccc([C@H](CC(=O)[O-])NCc2cc(F)cc(F)c2)cc1 ZINC000426805654 1026559996 /nfs/dbraw/zinc/55/99/96/1026559996.db2.gz DLBDAFXLXVXIQB-SFHVURJKSA-N -1 3 333.378 4.394 20 0 EIADHM O=C([O-])[C@H](NCc1ccc(Cl)c(C(F)(F)F)c1)c1ccccc1 ZINC000426806825 1026560543 /nfs/dbraw/zinc/56/05/43/1026560543.db2.gz LEHKNJFPUQOMBY-CQSZACIVSA-N -1 3 343.732 4.274 20 0 EIADHM CC(C)CCOc1ccc(CN[C@H](C(=O)[O-])c2cccc(F)c2)cc1 ZINC000426791981 1026565980 /nfs/dbraw/zinc/56/59/80/1026565980.db2.gz KOMVMRRBTMSTTF-IBGZPJMESA-N -1 3 345.414 4.166 20 0 EIADHM Cc1cc([C@H](NCc2ccc(Cl)s2)C(=O)[O-])ccc1Cl ZINC000426828264 1026585448 /nfs/dbraw/zinc/58/54/48/1026585448.db2.gz KOMRISIAZIJCID-ZDUSSCGKSA-N -1 3 330.236 4.279 20 0 EIADHM CC(C)CCOc1ccc(CN[C@H](C(=O)[O-])c2ccsc2)cc1 ZINC000426830628 1026592103 /nfs/dbraw/zinc/59/21/03/1026592103.db2.gz ZQLCUIOUJJDYGO-KRWDZBQOSA-N -1 3 333.453 4.089 20 0 EIADHM O=C([O-])[C@@H](NCc1cccc(Oc2ccccc2)c1)c1ccsc1 ZINC000426835051 1026594012 /nfs/dbraw/zinc/59/40/12/1026594012.db2.gz PSUKFWYEMFKXHM-SFHVURJKSA-N -1 3 339.416 4.456 20 0 EIADHM Cc1ccc(C(=O)Nc2ccccc2-c2ncc3n2CCCC3)c([O-])c1 ZINC000684865261 1026606326 /nfs/dbraw/zinc/60/63/26/1026606326.db2.gz WBLIYMRFIHEYLA-UHFFFAOYSA-N -1 3 347.418 4.153 20 0 EIADHM CC(C)c1ccc(C(=O)N2CCC(c3ccc(O)cc3)CC2)c([O-])c1 ZINC000051323068 1026625231 /nfs/dbraw/zinc/62/52/31/1026625231.db2.gz XDFKIXXLEBFKAI-UHFFFAOYSA-N -1 3 339.435 4.241 20 0 EIADHM Cc1ccccc1-c1cc(=NC(=O)CCc2cc3ccccc3o2)[nH][n-]1 ZINC000512322752 1026688121 /nfs/dbraw/zinc/68/81/21/1026688121.db2.gz APFRMXYVBJFVEX-UHFFFAOYSA-N -1 3 345.402 4.125 20 0 EIADHM Cc1cc(C(=O)Nc2cc(F)ccc2[O-])c(C)cc1Br ZINC000507378375 1026763837 /nfs/dbraw/zinc/76/38/37/1026763837.db2.gz ZRQLKKXLWXJGKN-UHFFFAOYSA-N -1 3 338.176 4.163 20 0 EIADHM Cc1cccc(Oc2cc(CNC(=O)c3ccccc3[O-])ccn2)c1C ZINC000440649182 1026989526 /nfs/dbraw/zinc/98/95/26/1026989526.db2.gz KVKZDHNVPRUGNK-UHFFFAOYSA-N -1 3 348.402 4.126 20 0 EIADHM COc1ccc(S(=O)(=O)[N-]c2ccccc2CCC(C)C)cc1 ZINC000520077967 1027173821 /nfs/dbraw/zinc/17/38/21/1027173821.db2.gz YSDLDYFAMMQSEL-UHFFFAOYSA-N -1 3 333.453 4.085 20 0 EIADHM CCN(Cc1csc(-c2cccc(C(=O)[O-])c2)n1)C1CCCC1 ZINC000566358037 1027355173 /nfs/dbraw/zinc/35/51/73/1027355173.db2.gz CUSWQKAGQQFLRT-UHFFFAOYSA-N -1 3 330.453 4.273 20 0 EIADHM CSc1ccc(C(=O)Nc2ccc(Br)cc2[O-])cc1 ZINC000261370517 1027497460 /nfs/dbraw/zinc/49/74/60/1027497460.db2.gz VVHSXHCEZBOGBL-UHFFFAOYSA-N -1 3 338.226 4.129 20 0 EIADHM C[C@H](CC(=O)[N-]OCc1ccccc1)c1ccccc1C(F)(F)F ZINC000303833595 1027672999 /nfs/dbraw/zinc/67/29/99/1027672999.db2.gz BVFOSWNRYZWXMZ-CYBMUJFWSA-N -1 3 337.341 4.447 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)Nc1cc(Cl)ccc1Cl ZINC000121440941 1027690322 /nfs/dbraw/zinc/69/03/22/1027690322.db2.gz AFTLODBQNOLEJM-UHFFFAOYSA-N -1 3 329.158 4.160 20 0 EIADHM C[C@@H](OCC(F)(F)F)c1noc(-c2cc3ccccc3cc2[O-])n1 ZINC000896606000 1027697903 /nfs/dbraw/zinc/69/79/03/1027697903.db2.gz FRJUZULFXJJBEP-SECBINFHSA-N -1 3 338.285 4.235 20 0 EIADHM C[C@@H](CC(C)(C)C)NC(=O)c1c[n-]c(=NC(=O)OC(C)(C)C)s1 ZINC001141904545 1027740346 /nfs/dbraw/zinc/74/03/46/1027740346.db2.gz UVRGXJBSWAUQIW-JTQLQIEISA-N -1 3 341.477 4.045 20 0 EIADHM C[C@@H]1C[C@@H](CCNC(=O)c2cc(=O)c3ccccc3[n-]2)CC(C)(C)C1 ZINC000444465863 1027817351 /nfs/dbraw/zinc/81/73/51/1027817351.db2.gz SZMPEMAHLFDKGN-HUUCEWRRSA-N -1 3 340.467 4.110 20 0 EIADHM C[C@H](c1ccc(Cl)cc1Cl)N(C)C(=O)c1ccc(O)cc1[O-] ZINC000193125454 1027850591 /nfs/dbraw/zinc/85/05/91/1027850591.db2.gz NSJMITNMUHXWKN-SECBINFHSA-N -1 3 340.206 4.238 20 0 EIADHM CC(C)Sc1cccc(Cl)c1CN1CC[C@@H](C)[C@H](C(=O)[O-])C1 ZINC000583024764 1027860824 /nfs/dbraw/zinc/86/08/24/1027860824.db2.gz JKXBSKOANSNBOD-CHWSQXEVSA-N -1 3 341.904 4.383 20 0 EIADHM O=C(CCCc1cc(Cl)sc1Cl)[N-]OCc1ccccn1 ZINC000909540617 1028078279 /nfs/dbraw/zinc/07/82/79/1028078279.db2.gz VDLHBDAFXVHFJS-UHFFFAOYSA-N -1 3 345.251 4.021 20 0 EIADHM COc1ccc(Cl)cc1-c1cc(=NC(=O)C2CCCCCC2)[nH][n-]1 ZINC000523551532 1028207016 /nfs/dbraw/zinc/20/70/16/1028207016.db2.gz RWYARYSOKVWZHX-UHFFFAOYSA-N -1 3 347.846 4.070 20 0 EIADHM COc1ccc2cc(-c3nc4cc(Cl)ccc4c(=O)[n-]3)ccc2c1 ZINC000523583721 1028247706 /nfs/dbraw/zinc/24/77/06/1028247706.db2.gz GAZMELNWLBLNQO-UHFFFAOYSA-N -1 3 336.778 4.405 20 0 EIADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)c3ccoc3C3CC3)c2)n1 ZINC000281317334 1028526662 /nfs/dbraw/zinc/52/66/62/1028526662.db2.gz UXVOOZIMORRASV-UHFFFAOYSA-N -1 3 349.390 4.134 20 0 EIADHM C[C@@H](c1nc(-c2ccc([O-])cc2Cl)no1)N(C)Cc1ccccc1 ZINC000445446742 1028578296 /nfs/dbraw/zinc/57/82/96/1028578296.db2.gz MVKJXNWOVRCXLP-LBPRGKRZSA-N -1 3 343.814 4.289 20 0 EIADHM C[C@H](c1nc(-c2ccc([O-])cc2Cl)no1)N(C)Cc1ccccc1 ZINC000445446741 1028579438 /nfs/dbraw/zinc/57/94/38/1028579438.db2.gz MVKJXNWOVRCXLP-GFCCVEGCSA-N -1 3 343.814 4.289 20 0 EIADHM COC(=O)c1cc2cc(Nc3cc(F)c([O-])c(F)c3)ccc2s1 ZINC001213384528 1028731337 /nfs/dbraw/zinc/73/13/37/1028731337.db2.gz QYYFYPFKGVEGFH-UHFFFAOYSA-N -1 3 335.331 4.415 20 0 EIADHM CSc1cccnc1-c1noc(-c2cc3ccccc3cc2[O-])n1 ZINC000445607358 1028774426 /nfs/dbraw/zinc/77/44/26/1028774426.db2.gz GTCLABIYRHPXQX-UHFFFAOYSA-N -1 3 335.388 4.379 20 0 EIADHM COc1cc(C(=O)NC2CCC3(CCCCC3)CC2)cc(OC)c1[O-] ZINC000347204844 1028921977 /nfs/dbraw/zinc/92/19/77/1028921977.db2.gz MULYOMRFCYMNPC-UHFFFAOYSA-N -1 3 347.455 4.032 20 0 EIADHM Cc1cc(-n2c([O-])c(CC(F)(F)F)[nH]c2=O)ccc1-c1ccccc1 ZINC000445921905 1029001088 /nfs/dbraw/zinc/00/10/88/1029001088.db2.gz OVKKCWIQKOHZAK-OAHLLOKOSA-N -1 3 348.324 4.039 20 0 EIADHM COc1ccc([C@H]2CCCN2C(=O)c2cc(SC)ccc2[O-])cc1 ZINC000665582969 1029162740 /nfs/dbraw/zinc/16/27/40/1029162740.db2.gz WWQOMHNIDVZKCL-QGZVFWFLSA-N -1 3 343.448 4.100 20 0 EIADHM Cc1c2cc(C)ccc2sc1C(=O)NCc1ccc([O-])c(F)c1 ZINC000446226511 1029220518 /nfs/dbraw/zinc/22/05/18/1029220518.db2.gz MDTSHYUYFFCPGN-UHFFFAOYSA-N -1 3 329.396 4.293 20 0 EIADHM CSc1ccc(O[C@H](C)C(=O)Nc2cc(Cl)ccc2[O-])cc1 ZINC000524908508 1029322439 /nfs/dbraw/zinc/32/24/39/1029322439.db2.gz XXSYIBSHWNZTHS-SNVBAGLBSA-N -1 3 337.828 4.174 20 0 EIADHM O=c1cc(OC2CCC(C(F)(F)F)CC2)[n-]c(C(F)(F)F)c1 ZINC001227585453 1029359101 /nfs/dbraw/zinc/35/91/01/1029359101.db2.gz CARDNXBBMDJRJX-UHFFFAOYSA-N -1 3 329.240 4.306 20 0 EIADHM COc1cc(Cl)c(F)c(C(=O)[N-]c2c(C)noc2C(C)C)c1 ZINC000928782760 1029378006 /nfs/dbraw/zinc/37/80/06/1029378006.db2.gz QYBOEZQIMOBTGW-UHFFFAOYSA-N -1 3 326.755 4.160 20 0 EIADHM O=C([O-])CN(Cc1c(Cl)cccc1Oc1ccccc1)CC1CC1 ZINC000650798684 1029645681 /nfs/dbraw/zinc/64/56/81/1029645681.db2.gz GOXBVZLIFSKZIX-UHFFFAOYSA-N -1 3 345.826 4.429 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(NC[C@H]3CCCC[C@@H]3C)nc2)n1 ZINC000301183065 1029682370 /nfs/dbraw/zinc/68/23/70/1029682370.db2.gz RBEOGYOFTRDDFF-UONOGXRCSA-N -1 3 326.444 4.045 20 0 EIADHM O=C([N-]c1ccccc1SC(F)(F)F)c1ccnc(F)c1F ZINC000187651494 1029764789 /nfs/dbraw/zinc/76/47/89/1029764789.db2.gz YSAGDFFZIDZBOA-UHFFFAOYSA-N -1 3 334.269 4.224 20 0 EIADHM [O-]c1ccc(CNc2nc3ccccc3s2)cc1Br ZINC000301699801 1029792874 /nfs/dbraw/zinc/79/28/74/1029792874.db2.gz PDADKLCHCAZFIZ-UHFFFAOYSA-N -1 3 335.226 4.377 20 0 EIADHM C[C@H]1CN(Cc2nc3c4ccccc4oc3c(=O)[n-]2)[C@@H]1c1ccccc1 ZINC000081573311 1029805911 /nfs/dbraw/zinc/80/59/11/1029805911.db2.gz HMLVGZGMFGUVRV-DJJJIMSYSA-N -1 3 345.402 4.275 20 0 EIADHM CCc1cccc(C(=O)N2CCCCC[C@H]2[C@H]2CCCCC2=O)c1[O-] ZINC000092429860 1029907900 /nfs/dbraw/zinc/90/79/00/1029907900.db2.gz YBBZURBJLVSSCQ-AEFFLSMTSA-N -1 3 343.467 4.099 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N3Cc4ccccc4[C@@H]3CC)nc2)n1 ZINC000897353427 1029983752 /nfs/dbraw/zinc/98/37/52/1029983752.db2.gz AQRMWXNDGHWCLY-SFHVURJKSA-N -1 3 346.434 4.278 20 0 EIADHM O=S(=O)(CCCCF)[N-]c1c(F)cccc1Oc1ccccc1 ZINC000451013827 1030176392 /nfs/dbraw/zinc/17/63/92/1030176392.db2.gz KGHQGUNSKLBVMC-UHFFFAOYSA-N -1 3 341.379 4.109 20 0 EIADHM Cc1ccc([C@H]2CCCCCN2C(=O)NCc2ccc([O-])c(F)c2)o1 ZINC000163725033 1030176651 /nfs/dbraw/zinc/17/66/51/1030176651.db2.gz SPPTVVMEIWWGPT-MRXNPFEDSA-N -1 3 346.402 4.260 20 0 EIADHM CC(C)Oc1ccc(CN2[C@@H](C)CC(C(=O)[O-])C[C@@H]2C)cc1Cl ZINC000530174305 1030198400 /nfs/dbraw/zinc/19/84/00/1030198400.db2.gz JZMHWLCSOXAIJC-STQMWFEESA-N -1 3 339.863 4.201 20 0 EIADHM C[C@H](CS(=O)(=O)[N-]c1ccccc1C(C)(F)F)c1ccccc1 ZINC000451090399 1030232022 /nfs/dbraw/zinc/23/20/22/1030232022.db2.gz UDBYDUHPSZYKFK-CYBMUJFWSA-N -1 3 339.407 4.344 20 0 EIADHM COc1ccc(C(=O)N(C)[C@H](c2ccc(F)cc2)C(C)C)c([O-])c1 ZINC000447859975 1030385728 /nfs/dbraw/zinc/38/57/28/1030385728.db2.gz BDAGVEKTUYLWIH-SFHVURJKSA-N -1 3 331.387 4.009 20 0 EIADHM CC(C)[C@H](c1ccc(F)cc1)N(C)C(=O)Cc1ccc([O-])c(F)c1 ZINC000451510543 1030545486 /nfs/dbraw/zinc/54/54/86/1030545486.db2.gz OTMGYFFDHPHDJN-LJQANCHMSA-N -1 3 333.378 4.069 20 0 EIADHM C[C@@H](NC(=O)c1cc([O-])ccc1Cl)c1ccc2c(c1)CCCC2 ZINC000431617066 1030560182 /nfs/dbraw/zinc/56/01/82/1030560182.db2.gz AAIUFXKNGRFDMJ-GFCCVEGCSA-N -1 3 329.827 4.415 20 0 EIADHM CCSc1ccccc1C(=O)N=c1cc(-c2ccccc2C)[n-][nH]1 ZINC000527365395 1030651776 /nfs/dbraw/zinc/65/17/76/1030651776.db2.gz QAZRMXVROJXLRI-UHFFFAOYSA-N -1 3 337.448 4.171 20 0 EIADHM COc1ccc([N-]S(=O)(=O)c2ccc(C3CC3)cc2)cc1SC ZINC000666310179 1030836250 /nfs/dbraw/zinc/83/62/50/1030836250.db2.gz SRNJNMDKIDTREH-UHFFFAOYSA-N -1 3 349.477 4.095 20 0 EIADHM CC(C)Sc1cccc(Cl)c1CN1CCC[C@@H](C(=O)[O-])C1 ZINC000263380838 1030844403 /nfs/dbraw/zinc/84/44/03/1030844403.db2.gz BOVDBADOCFOYKD-GFCCVEGCSA-N -1 3 327.877 4.137 20 0 EIADHM CCC(CC)c1nnc([N-]C(=O)c2sc(Cl)nc2C)s1 ZINC000177021647 1030852395 /nfs/dbraw/zinc/85/23/95/1030852395.db2.gz ZTLFWVAAJPVXGZ-UHFFFAOYSA-N -1 3 330.866 4.112 20 0 EIADHM O=C(Cc1ccc([O-])c(F)c1)N1CCC[C@@H]1c1ccc(Cl)cc1 ZINC000448655804 1030905587 /nfs/dbraw/zinc/90/55/87/1030905587.db2.gz LZWUSTKCPJUHDY-MRXNPFEDSA-N -1 3 333.790 4.091 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1cccc(C(F)(F)F)c1F ZINC000531190413 1030953023 /nfs/dbraw/zinc/95/30/23/1030953023.db2.gz HUUJLNYYJOFAED-UHFFFAOYSA-N -1 3 333.668 4.456 20 0 EIADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)[C@]3(C)CCC[C@H]3C)c2)n1 ZINC000448724385 1030990782 /nfs/dbraw/zinc/99/07/82/1030990782.db2.gz KZTBWRVIZDBOLZ-ZUOKHONESA-N -1 3 339.439 4.176 20 0 EIADHM C[C@H]1C[C@H]1c1ccc(CN2CCC(c3ccccc3C(=O)[O-])CC2)o1 ZINC000666586634 1031051634 /nfs/dbraw/zinc/05/16/34/1031051634.db2.gz SKNMHKDVUNAYPB-IFXJQAMLSA-N -1 3 339.435 4.481 20 0 EIADHM CCc1cccc(C(=O)N2CC=C(c3ccc(F)cc3)CC2)c1[O-] ZINC000531436244 1031235313 /nfs/dbraw/zinc/23/53/13/1031235313.db2.gz LQJCYZRWQLMFNV-UHFFFAOYSA-N -1 3 325.383 4.023 20 0 EIADHM Cc1c(Br)ccc([O-])c1NC(=O)c1ccc(C(C)C)nc1 ZINC000452756113 1031306193 /nfs/dbraw/zinc/30/61/93/1031306193.db2.gz ODCOADRBNASTDG-UHFFFAOYSA-N -1 3 349.228 4.234 20 0 EIADHM O=C(NC[C@@H]1CCCC[C@@H]1C(F)(F)F)c1cc([O-])ccc1Cl ZINC000685772680 1031479855 /nfs/dbraw/zinc/47/98/55/1031479855.db2.gz DSKQDIGIXUDQIH-CABZTGNLSA-N -1 3 335.753 4.144 20 0 EIADHM O=C(Nc1cc(F)ccc1[O-])c1cc(Cl)cc(Br)c1 ZINC000532637095 1031480828 /nfs/dbraw/zinc/48/08/28/1031480828.db2.gz DJKJPTHBNOPFCQ-UHFFFAOYSA-N -1 3 344.567 4.200 20 0 EIADHM C[C@@H](c1cccc(O)c1)N(C)Cc1cccc([O-])c1Br ZINC000459346953 1031871468 /nfs/dbraw/zinc/87/14/68/1031871468.db2.gz KVKPHIFBALWIEK-NSHDSACASA-N -1 3 336.229 4.053 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]Cc2ccc(C3CCCCC3)cc2)o1 ZINC001211950938 1031965343 /nfs/dbraw/zinc/96/53/43/1031965343.db2.gz RAXWITUGNXPDIK-UHFFFAOYSA-N -1 3 333.453 4.114 20 0 EIADHM CC1(C)CCC[C@@H]1C[N-]S(=O)(=O)c1cccc(Cl)c1Cl ZINC001211951175 1031987397 /nfs/dbraw/zinc/98/73/97/1031987397.db2.gz ZBSLGPWWGGPREX-SNVBAGLBSA-N -1 3 336.284 4.098 20 0 EIADHM CC[C@@H](C)c1ccc(S(=O)(=O)[N-]c2cc(OC)ccc2F)cc1 ZINC000532037677 1031988057 /nfs/dbraw/zinc/98/80/57/1031988057.db2.gz AGIJIUVBQNZROO-GFCCVEGCSA-N -1 3 337.416 4.149 20 0 EIADHM COc1cc(-c2nc3cc(Cl)ccc3c(=O)[n-]2)ccc1OC(C)C ZINC000614110882 1033391245 /nfs/dbraw/zinc/39/12/45/1033391245.db2.gz XXZSLYNFQYUQOV-UHFFFAOYSA-N -1 3 344.798 4.452 20 0 EIADHM C[C@H]1C[C@H](C(F)(F)F)CCN1C(=O)c1cc([O-])c2ccccc2c1 ZINC000295706917 1033808384 /nfs/dbraw/zinc/80/83/84/1033808384.db2.gz CBTAGRQDEHSDJP-SMDDNHRTSA-N -1 3 337.341 4.348 20 0 EIADHM Cc1ccc(NC(=O)c2c[n-]c3c(C)cc(F)cc3c2=O)c(Cl)c1 ZINC000433110810 1033860015 /nfs/dbraw/zinc/86/00/15/1033860015.db2.gz QIZIPKHKAUBHDU-UHFFFAOYSA-N -1 3 344.773 4.190 20 0 EIADHM O=C(c1cc([O-])ccc1Cl)N1CCCCC[C@H]1[C@H]1CCCCC1=O ZINC000433367135 1034280509 /nfs/dbraw/zinc/28/05/09/1034280509.db2.gz PVLQGTNSFVLHLY-PBHICJAKSA-N -1 3 349.858 4.190 20 0 EIADHM C[C@H](S[C@@H]1CCOC1)c1nc(=O)c2c(-c3ccco3)csc2[n-]1 ZINC000419352077 1034402420 /nfs/dbraw/zinc/40/24/20/1034402420.db2.gz AGNIUDXLUVAUHP-VHSXEESVSA-N -1 3 348.449 4.240 20 0 EIADHM O=C(Cc1ccc(Cl)s1)Nc1cc(Br)ccc1[O-] ZINC000513598769 1035054727 /nfs/dbraw/zinc/05/47/27/1035054727.db2.gz BFQXWZFLWNGQFP-UHFFFAOYSA-N -1 3 346.633 4.051 20 0 EIADHM O=C(Nc1ccc(Cl)cc1[O-])c1ccc(Cl)c2ncccc12 ZINC000513621323 1035063962 /nfs/dbraw/zinc/06/39/62/1035063962.db2.gz DTMIJMRXNSJNMJ-UHFFFAOYSA-N -1 3 333.174 4.500 20 0 EIADHM Cc1sc2[n-]c(-c3ccncn3)nc(=O)c2c1-c1ccc(C)cc1 ZINC000345359989 1035200410 /nfs/dbraw/zinc/20/04/10/1035200410.db2.gz XZAXQXXFDPRRHT-UHFFFAOYSA-N -1 3 334.404 4.138 20 0 EIADHM C[C@H](NC(=O)c1cc([O-])ccc1Cl)c1ccc2ncsc2c1 ZINC000501360240 1035430056 /nfs/dbraw/zinc/43/00/56/1035430056.db2.gz VGDLEEHVAKLYEY-VIFPVBQESA-N -1 3 332.812 4.146 20 0 EIADHM CCOc1ccc(S(=O)(=O)[N-]c2cccc(Cl)c2C)c(C)c1 ZINC000501805352 1035610098 /nfs/dbraw/zinc/61/00/98/1035610098.db2.gz GXSSUUDZAOJWSJ-UHFFFAOYSA-N -1 3 339.844 4.156 20 0 EIADHM O=C(OCc1ccccc1C(F)(F)F)c1cc(-c2ccco2)[n-]n1 ZINC000913299316 1035630536 /nfs/dbraw/zinc/63/05/36/1035630536.db2.gz ZYKSVVDKGFPBJC-UHFFFAOYSA-N -1 3 336.269 4.046 20 0 EIADHM O=C(OCc1ccccc1C(F)(F)F)c1cc(-c2ccco2)n[n-]1 ZINC000913299316 1035630565 /nfs/dbraw/zinc/63/05/65/1035630565.db2.gz ZYKSVVDKGFPBJC-UHFFFAOYSA-N -1 3 336.269 4.046 20 0 EIADHM CCCCS[C@@H](C)C(=O)Nc1n[n-]c(-c2cc3ccccc3o2)n1 ZINC000485125022 1035717136 /nfs/dbraw/zinc/71/71/36/1035717136.db2.gz YMVXSHVINPHTLW-NSHDSACASA-N -1 3 344.440 4.078 20 0 EIADHM O=C([N-]c1nnc(C2CC2)s1)c1csc(C2CCCCC2)n1 ZINC000571407412 1036038896 /nfs/dbraw/zinc/03/88/96/1036038896.db2.gz NDJLPTCCZUFXHI-UHFFFAOYSA-N -1 3 334.470 4.172 20 0 EIADHM CC(=O)c1cc(F)c([N-]C(=O)c2scc(C)c2Cl)c(F)c1 ZINC000485644101 1036141986 /nfs/dbraw/zinc/14/19/86/1036141986.db2.gz OXASPLWMQLXHOZ-UHFFFAOYSA-N -1 3 329.755 4.443 20 0 EIADHM Cc1cc([C@H](C)N(C)CCCOc2ccccc2C)oc1C(=O)[O-] ZINC000571811728 1036259222 /nfs/dbraw/zinc/25/92/22/1036259222.db2.gz PPJKXXLWSCCWET-HNNXBMFYSA-N -1 3 331.412 4.057 20 0 EIADHM O=C([N-]Cc1ccc(Cl)cc1Cl)C(F)(F)c1ccccc1 ZINC000060730209 1036384634 /nfs/dbraw/zinc/38/46/34/1036384634.db2.gz OSKUQYISMJBEAS-UHFFFAOYSA-N -1 3 330.161 4.402 20 0 EIADHM O=c1cc(C=Cc2cccc(C(F)(F)F)c2)nc(-c2ccncc2)[n-]1 ZINC000486032335 1036433216 /nfs/dbraw/zinc/43/32/16/1036433216.db2.gz VJXCJOJXKGLADK-PLNGDYQASA-N -1 3 343.308 4.021 20 0 EIADHM Cc1cc(=O)[n-]c([C@@H](C)Sc2ncc(C(F)(F)F)cc2Cl)n1 ZINC000486559673 1036768052 /nfs/dbraw/zinc/76/80/52/1036768052.db2.gz HYXYNKPIOPKSFV-SSDOTTSWSA-N -1 3 349.765 4.411 20 0 EIADHM CCc1ccc([C@H](C)C(=O)Nc2ccc(Br)cc2[O-])cc1 ZINC000589943533 1036915179 /nfs/dbraw/zinc/91/51/79/1036915179.db2.gz FRZDVOSYNHCDCJ-NSHDSACASA-N -1 3 348.240 4.459 20 0 EIADHM Cc1ccc(NCc2cc([O-])cc(F)c2)cc1C(=O)N1CCCCC1 ZINC000487159943 1037017706 /nfs/dbraw/zinc/01/77/06/1037017706.db2.gz ODBYQHRIGADJGE-UHFFFAOYSA-N -1 3 342.414 4.078 20 0 EIADHM CO[C@H]1CCCC[C@H]1S(=O)(=O)[N-]c1ccccc1-c1ccccc1 ZINC000647920503 1037128946 /nfs/dbraw/zinc/12/89/46/1037128946.db2.gz BVMGGEKEQJOBMZ-RBUKOAKNSA-N -1 3 345.464 4.053 20 0 EIADHM O=C([N-]c1ccccc1SC(F)F)c1cc(-c2cccnc2)on1 ZINC000045766276 1037386998 /nfs/dbraw/zinc/38/69/98/1037386998.db2.gz IVKVUMACNLPXHC-UHFFFAOYSA-N -1 3 347.346 4.304 20 0 EIADHM Cc1ccc([C@@H]2CCCN2Cc2nc3c4ccccc4oc3c(=O)[n-]2)o1 ZINC000604761147 1037531278 /nfs/dbraw/zinc/53/12/78/1037531278.db2.gz IWARFZVZIPJAQI-AWEZNQCLSA-N -1 3 349.390 4.320 20 0 EIADHM CC[C@@H](NC(=O)Nc1ccc(-c2cc(=O)[n-]c(C)n2)cc1)C(C)(C)C ZINC000591822847 1037606899 /nfs/dbraw/zinc/60/68/99/1037606899.db2.gz UGTWZIXTJGPKGF-MRXNPFEDSA-N -1 3 342.443 4.104 20 0 EIADHM Cc1cccc2c1[C@@H](C)C[C@H]2CC(=O)NCc1ccc([O-])c(F)c1 ZINC000488990223 1037827572 /nfs/dbraw/zinc/82/75/72/1037827572.db2.gz YCJBPWSKJXNXJH-ZFWWWQNUSA-N -1 3 327.399 4.137 20 0 EIADHM O=C([O-])C[C@H](NCc1cscc1C(F)(F)F)c1cccs1 ZINC000669472746 1037942229 /nfs/dbraw/zinc/94/22/29/1037942229.db2.gz RNNGUWGFXBNXTD-JTQLQIEISA-N -1 3 335.372 4.134 20 0 EIADHM CC(C)(C)CC[C@H](NCc1c(Cl)cccc1OC(F)F)C(=O)[O-] ZINC000669480354 1038025370 /nfs/dbraw/zinc/02/53/70/1038025370.db2.gz QISGICRLOGECJD-LBPRGKRZSA-N -1 3 349.805 4.311 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)c1ccccc1Oc1ccccc1 ZINC000606537596 1038153770 /nfs/dbraw/zinc/15/37/70/1038153770.db2.gz WRCOCQQQMXFIFG-UHFFFAOYSA-N -1 3 337.350 4.254 20 0 EIADHM Cc1cccc(CN(CC(C)C)C(=O)NCc2ccc([O-])c(F)c2)c1 ZINC000606719839 1038229782 /nfs/dbraw/zinc/22/97/82/1038229782.db2.gz KNNSGTILOWBBMG-UHFFFAOYSA-N -1 3 344.430 4.208 20 0 EIADHM Cc1nc(-c2ccc(F)cc2)sc1C(=O)Nc1cc(F)ccc1[O-] ZINC000533964235 1038255177 /nfs/dbraw/zinc/25/51/77/1038255177.db2.gz YYIMWBFCXNVICY-UHFFFAOYSA-N -1 3 346.358 4.355 20 0 EIADHM CCN(C(=O)N=c1cc2ccccn2[n-]1)[C@@H](C)c1cc2ccccc2o1 ZINC000574543523 1038292917 /nfs/dbraw/zinc/29/29/17/1038292917.db2.gz SEKHSQJTSODHJN-AWEZNQCLSA-N -1 3 348.406 4.117 20 0 EIADHM O=C(Nc1c([O-])cccc1Cl)c1ccc(Br)c(F)c1 ZINC000574592670 1038300226 /nfs/dbraw/zinc/30/02/26/1038300226.db2.gz ODWCOAFQHHOFJY-UHFFFAOYSA-N -1 3 344.567 4.200 20 0 EIADHM CCc1ccc(C(=O)Nc2ccc3ccnc(Cl)c3c2)c([O-])c1 ZINC001142615557 1038812129 /nfs/dbraw/zinc/81/21/29/1038812129.db2.gz BVKLJXWQBHNYSO-UHFFFAOYSA-N -1 3 326.783 4.409 20 0 EIADHM CCc1ccc([O-])c(C(=O)Nc2ccc(Oc3ccc(C)nn3)cc2)c1 ZINC000608436766 1038823313 /nfs/dbraw/zinc/82/33/13/1038823313.db2.gz TVLHKZZFNPCWQJ-UHFFFAOYSA-N -1 3 349.390 4.098 20 0 EIADHM O=C(Nc1ccc(-c2nccs2)cc1)c1cc([O-])ccc1Cl ZINC000555029022 1038840554 /nfs/dbraw/zinc/84/05/54/1038840554.db2.gz XQFYYIHMFNDAJT-UHFFFAOYSA-N -1 3 330.796 4.421 20 0 EIADHM CCc1noc(C)c1[N-]C(=O)c1csc(Cc2ccc(C)cc2)n1 ZINC000119398884 1038889864 /nfs/dbraw/zinc/88/98/64/1038889864.db2.gz BNVDWFBJWMMSBY-UHFFFAOYSA-N -1 3 341.436 4.153 20 0 EIADHM CSc1ccc([O-])c(C(=O)N2CCC[C@H]2Cc2ccc(F)cc2)c1 ZINC000666931286 1039042809 /nfs/dbraw/zinc/04/28/09/1039042809.db2.gz SVMGYVGSJJBTHI-HNNXBMFYSA-N -1 3 345.439 4.101 20 0 EIADHM CC[C@H](C)Oc1ccc(-c2nc3cc(Cl)ccc3c(=O)[n-]2)cc1 ZINC000481195433 1039106736 /nfs/dbraw/zinc/10/67/36/1039106736.db2.gz HTMGXLFPMSWMOW-NSHDSACASA-N -1 3 328.799 4.421 20 0 EIADHM O=C(Nc1cccc([O-])c1F)c1ccccc1CCC(F)(F)F ZINC000534208485 1039204640 /nfs/dbraw/zinc/20/46/40/1039204640.db2.gz BHMNOYIGLNAOJJ-UHFFFAOYSA-N -1 3 327.277 4.279 20 0 EIADHM O=C(CCC(=O)c1ccc2ccccc2c1)Nc1cccc([O-])c1F ZINC000534210187 1039205917 /nfs/dbraw/zinc/20/59/17/1039205917.db2.gz IIAKDNXDZAGTPG-UHFFFAOYSA-N -1 3 337.350 4.286 20 0 EIADHM CC(=O)c1cccc(NC(=O)[C@@H](Cc2ccccc2)C(C)C)c1[O-] ZINC000552287039 1039341023 /nfs/dbraw/zinc/34/10/23/1039341023.db2.gz GNXZONKUZSIOBT-KRWDZBQOSA-N -1 3 325.408 4.048 20 0 EIADHM C[C@H](Sc1cc(Cl)ccc1Cl)C(=O)Nc1ncccc1[O-] ZINC000059363162 1039350261 /nfs/dbraw/zinc/35/02/61/1039350261.db2.gz HCURXKMUOLWNQW-QMMMGPOBSA-N -1 3 343.235 4.213 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)N1CC2(CCC2)c2ccccc21 ZINC000481456027 1039467732 /nfs/dbraw/zinc/46/77/32/1039467732.db2.gz MFYPMBPUUPLULU-UHFFFAOYSA-N -1 3 339.410 4.323 20 0 EIADHM Cc1ccc(OCCCC(=O)Nc2c([O-])cccc2Cl)cc1C ZINC000552433516 1039512939 /nfs/dbraw/zinc/51/29/39/1039512939.db2.gz NEZVCADSDPYTLK-UHFFFAOYSA-N -1 3 333.815 4.460 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)N[C@H]1C[C@H](c2ccc(F)cc2)C1 ZINC000481526390 1039550760 /nfs/dbraw/zinc/55/07/60/1039550760.db2.gz GERLWJHYDQOZBX-JCNLHEQBSA-N -1 3 345.389 4.056 20 0 EIADHM CC(C)[C@H](c1ccc(F)cc1)N(C)Cc1nc(=O)c2sccc2[n-]1 ZINC000434612067 1039709376 /nfs/dbraw/zinc/70/93/76/1039709376.db2.gz NVAKMHFZGJSQKN-MRXNPFEDSA-N -1 3 345.443 4.365 20 0 EIADHM C[C@H](OC(=O)c1ccc([O-])cc1)c1nc2ccccc2n1C(F)F ZINC000054608676 1039736788 /nfs/dbraw/zinc/73/67/88/1039736788.db2.gz HZGQVGGUGZGSFC-JTQLQIEISA-N -1 3 332.306 4.055 20 0 EIADHM Cc1ccc([C@H]2CCN(C(=O)c3cc([O-])ccc3Cl)C2)c(C)c1 ZINC000510002126 1039845169 /nfs/dbraw/zinc/84/51/69/1039845169.db2.gz JTWDRZSYXAQYGK-AWEZNQCLSA-N -1 3 329.827 4.292 20 0 EIADHM COC(=O)c1ccc(C(=O)Nc2cccc(CSC(C)C)c2C)[n-]1 ZINC000551092081 1039975397 /nfs/dbraw/zinc/97/53/97/1039975397.db2.gz PDIFNMOPMRCGBB-UHFFFAOYSA-N -1 3 346.452 4.004 20 0 EIADHM CCCCCc1nnc([N-]C(=O)c2c(F)cc(C)cc2F)s1 ZINC000666968168 1040050005 /nfs/dbraw/zinc/05/00/05/1040050005.db2.gz CCPIDGDIQPMKJD-UHFFFAOYSA-N -1 3 325.384 4.110 20 0 EIADHM C[C@H]1C[C@H](c2ccccc2)N(C(=O)CCCc2ccc([O-])c(F)c2)C1 ZINC000553337796 1040146279 /nfs/dbraw/zinc/14/62/79/1040146279.db2.gz VKEKOYXRKQPAGM-HNAYVOBHSA-N -1 3 341.426 4.464 20 0 EIADHM CCCOc1cccc(C=C(CC)c2nc(CCC)cc(=O)[n-]2)c1 ZINC000435340792 1040293507 /nfs/dbraw/zinc/29/35/07/1040293507.db2.gz NGTHMYNUCQQCEX-FOWTUZBSSA-N -1 3 326.440 4.462 20 0 EIADHM C[C@H]1CCCN(Cc2csc(-c3cccc(C(=O)[O-])c3)n2)CC1 ZINC000515066797 1040460565 /nfs/dbraw/zinc/46/05/65/1040460565.db2.gz VJWQCQODYKOHQP-ZDUSSCGKSA-N -1 3 330.453 4.130 20 0 EIADHM CCC(CC)(CC)[N-]S(=O)(=O)c1ccc(F)cc1C(F)(F)F ZINC000462310641 1040463877 /nfs/dbraw/zinc/46/38/77/1040463877.db2.gz AEFMPUICYXBLHD-UHFFFAOYSA-N -1 3 341.370 4.092 20 0 EIADHM CSc1ccc(C=C(Cc2ccccc2)c2nccc(=O)[n-]2)cc1 ZINC000477413740 1040489762 /nfs/dbraw/zinc/48/97/62/1040489762.db2.gz OKPBAPJWGHQDLH-SAPNQHFASA-N -1 3 334.444 4.275 20 0 EIADHM CCSc1ccc(Cl)cc1C(=O)NCc1ccc([O-])c(F)c1 ZINC000084404352 1040552807 /nfs/dbraw/zinc/55/28/07/1040552807.db2.gz ZKGITTOQEXDSRC-UHFFFAOYSA-N -1 3 339.819 4.227 20 0 EIADHM O=C([N-]c1nnc(CC2CCCCC2)s1)c1cccc(F)c1F ZINC000504594887 1040615337 /nfs/dbraw/zinc/61/53/37/1040615337.db2.gz ZCSMZDFSEPSQEO-UHFFFAOYSA-N -1 3 337.395 4.191 20 0 EIADHM CC(C)Oc1ccc([N-]S(=O)(=O)c2ccccc2F)c(Cl)c1 ZINC000436151971 1040925821 /nfs/dbraw/zinc/92/58/21/1040925821.db2.gz FPLPQADRPSRTPV-UHFFFAOYSA-N -1 3 343.807 4.067 20 0 EIADHM Cc1cc(C)c([N-]S(=O)(=O)c2ccc3c(c2)CC(C)(C)O3)c(C)c1 ZINC000538011113 1040988294 /nfs/dbraw/zinc/98/82/94/1040988294.db2.gz DSNNTRXRRUOGMW-UHFFFAOYSA-N -1 3 345.464 4.126 20 0 EIADHM Cc1ccccc1-c1cc(=NC(=O)c2occc2-c2ccccc2)[nH][n-]1 ZINC000538222151 1041180201 /nfs/dbraw/zinc/18/02/01/1041180201.db2.gz SZHDCSBSQJHQNF-UHFFFAOYSA-N -1 3 343.386 4.319 20 0 EIADHM Cc1cccc(F)c1[N-]S(=O)(=O)c1cc(Cl)cc(Cl)c1 ZINC000461114482 1041245642 /nfs/dbraw/zinc/24/56/42/1041245642.db2.gz RYAUMJSURUSYBG-UHFFFAOYSA-N -1 3 334.199 4.242 20 0 EIADHM CC[C@@H](CCNCc1csc(-c2ccc(Cl)cc2)n1)C(=O)[O-] ZINC000904018662 1041260370 /nfs/dbraw/zinc/26/03/70/1041260370.db2.gz RWRVQPSGLOJKIN-NSHDSACASA-N -1 3 338.860 4.054 20 0 EIADHM O=C([O-])[C@@H]1CC=C[C@@H](NCc2cc(Cl)ccc2OC2CCCC2)C1 ZINC000904035873 1041284591 /nfs/dbraw/zinc/28/45/91/1041284591.db2.gz SNQGMFDBBQETPN-CZUORRHYSA-N -1 3 349.858 4.170 20 0 EIADHM CC(C)c1ccc(C(=O)N2CC[C@H](c3ccccc3F)C2)c([O-])c1 ZINC000436484040 1041286504 /nfs/dbraw/zinc/28/65/04/1041286504.db2.gz HGEOJZUFILXNBM-HNNXBMFYSA-N -1 3 327.399 4.284 20 0 EIADHM CO[C@H](C)c1cccc(NC(=O)c2cc3c(cc2[O-])CCCC3)c1 ZINC000436511601 1041296734 /nfs/dbraw/zinc/29/67/34/1041296734.db2.gz HGDNDLREOBOWQC-CYBMUJFWSA-N -1 3 325.408 4.231 20 0 EIADHM CC(C)c1ccc(C(=O)N(Cc2ccco2)CC(F)(F)F)c([O-])c1 ZINC000436536586 1041319656 /nfs/dbraw/zinc/31/96/56/1041319656.db2.gz DGQGRPQIURFVLJ-UHFFFAOYSA-N -1 3 341.329 4.313 20 0 EIADHM COc1ccc(C(=O)N(C)[C@@H](C)[C@H](C)c2ccc(Cl)cc2)c([O-])c1 ZINC000436575497 1041338992 /nfs/dbraw/zinc/33/89/92/1041338992.db2.gz NPAMOHRJMPMTJU-STQMWFEESA-N -1 3 347.842 4.318 20 0 EIADHM CC(=O)c1ccc(C(=O)Nc2ccc(OC3CCCC3)cc2)cc1[O-] ZINC000436577363 1041340967 /nfs/dbraw/zinc/34/09/67/1041340967.db2.gz OJDBXEDUTHUHSF-UHFFFAOYSA-N -1 3 339.391 4.169 20 0 EIADHM Cc1ccc(C(=O)Nc2cccc(Cn3ccnc3C(C)C)c2)c([O-])c1 ZINC000436564062 1041343070 /nfs/dbraw/zinc/34/30/70/1041343070.db2.gz OAIXBFUNUXDNFO-UHFFFAOYSA-N -1 3 349.434 4.321 20 0 EIADHM Cc1ccc(C(=O)N(C)[C@H](Cc2ccc(F)cc2)C(C)C)c([O-])c1 ZINC000436571790 1041349029 /nfs/dbraw/zinc/34/90/29/1041349029.db2.gz DUQFWFZQIFYPKI-GOSISDBHSA-N -1 3 329.415 4.179 20 0 EIADHM O=C(c1cc(CCc2ccccc2)ccc1[O-])N1C[C@H]2CCC[C@@H]2C1 ZINC000436585952 1041361179 /nfs/dbraw/zinc/36/11/79/1041361179.db2.gz RUCUWSVFEVJDIC-RTBURBONSA-N -1 3 335.447 4.050 20 0 EIADHM CC[C@@H](NC(=O)c1ccc(C)cc1[O-])c1nc(C(F)(F)F)cs1 ZINC000436581341 1041361235 /nfs/dbraw/zinc/36/12/35/1041361235.db2.gz APWGWMPZWABTDA-SNVBAGLBSA-N -1 3 344.358 4.057 20 0 EIADHM CC(C)c1ccc(C(=O)N(C[C@@H]2CCCO2)C2CCCC2)c([O-])c1 ZINC000436581461 1041361425 /nfs/dbraw/zinc/36/14/25/1041361425.db2.gz FJNQDBOEGAEXBG-KRWDZBQOSA-N -1 3 331.456 4.079 20 0 EIADHM Cc1ncsc1NC(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436589936 1041365344 /nfs/dbraw/zinc/36/53/44/1041365344.db2.gz RCTHOBIBYLLFSX-UHFFFAOYSA-N -1 3 326.377 4.202 20 0 EIADHM Cc1occc1CN(C)C(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436608655 1041370513 /nfs/dbraw/zinc/37/05/13/1041370513.db2.gz JTAKFMIPCFHPST-UHFFFAOYSA-N -1 3 335.403 4.157 20 0 EIADHM CC(=O)c1ccc(C(=O)Nc2ccc(Oc3ccncc3)cc2)cc1[O-] ZINC000436626263 1041377872 /nfs/dbraw/zinc/37/78/72/1041377872.db2.gz QXQPJAJSFGTGAC-UHFFFAOYSA-N -1 3 348.358 4.034 20 0 EIADHM COc1cccc(C(=O)Nc2cccc(-c3cccs3)c2)c1[O-] ZINC000436634815 1041384021 /nfs/dbraw/zinc/38/40/21/1041384021.db2.gz LVJYYWGIIGPQSY-UHFFFAOYSA-N -1 3 325.389 4.382 20 0 EIADHM CC(C)CCOC1CCN(C(=O)c2ccc(C(C)C)cc2[O-])CC1 ZINC000436642941 1041400372 /nfs/dbraw/zinc/40/03/72/1041400372.db2.gz KVEBIONVJWZKGY-UHFFFAOYSA-N -1 3 333.472 4.183 20 0 EIADHM COc1cc(-c2nc3cc(C)ccc3n2C)cc(Br)c1[O-] ZINC000436658952 1041412891 /nfs/dbraw/zinc/41/28/91/1041412891.db2.gz WZJAXIFOLRQAIU-UHFFFAOYSA-N -1 3 347.212 4.025 20 0 EIADHM CCc1ccc(C(=O)N2CC[C@H](C(F)(F)F)C3(CCC3)C2)c([O-])c1 ZINC000436661626 1041415102 /nfs/dbraw/zinc/41/51/02/1041415102.db2.gz DNINVDZKLGVADD-HNNXBMFYSA-N -1 3 341.373 4.149 20 0 EIADHM O=C(c1ccc(O)cc1[O-])N1CCCCC[C@H]1/C=C\c1ccccc1 ZINC000436677886 1041417320 /nfs/dbraw/zinc/41/73/20/1041417320.db2.gz FYGXGOOQQNPEJR-MQNTZWLQSA-N -1 3 337.419 4.196 20 0 EIADHM CCOCCOc1ccc(Cl)cc1NC(=O)c1ccc(C)cc1[O-] ZINC000436704749 1041434101 /nfs/dbraw/zinc/43/41/01/1041434101.db2.gz PLCNWOOKKQEXRC-UHFFFAOYSA-N -1 3 349.814 4.022 20 0 EIADHM O=C(c1ccc(O)cc1[O-])N(Cc1ccccc1Cl)C1CCCC1 ZINC000436716235 1041441127 /nfs/dbraw/zinc/44/11/27/1041441127.db2.gz SEVUCPWTWDGEPL-UHFFFAOYSA-N -1 3 345.826 4.336 20 0 EIADHM COc1cccc(C(=O)Nc2ccc(-c3ccco3)cc2F)c1[O-] ZINC000436729592 1041454216 /nfs/dbraw/zinc/45/42/16/1041454216.db2.gz SAVODICWUMRFNM-UHFFFAOYSA-N -1 3 327.311 4.052 20 0 EIADHM CCc1ccc(C(=O)N(C)[C@H](CC)c2cccc(OC)c2)c([O-])c1 ZINC000436750315 1041463319 /nfs/dbraw/zinc/46/33/19/1041463319.db2.gz MYSQSKYZJSKGQL-GOSISDBHSA-N -1 3 327.424 4.187 20 0 EIADHM CCN(Cc1ccc2ccccc2c1)C(=O)c1ccc(OC)cc1[O-] ZINC000436749293 1041463344 /nfs/dbraw/zinc/46/33/44/1041463344.db2.gz SLDQZMVCKFYRCF-UHFFFAOYSA-N -1 3 335.403 4.216 20 0 EIADHM C[C@@H](C1CC1)N(C(=O)c1cc(Cc2ccccc2)ccc1[O-])C1CC1 ZINC000436756690 1041466847 /nfs/dbraw/zinc/46/68/47/1041466847.db2.gz SPKISUSJKNIMDV-HNNXBMFYSA-N -1 3 335.447 4.386 20 0 EIADHM O=C(c1cc(Oc2ccccc2)ccc1[O-])N1CCOc2ccccc21 ZINC000436754688 1041467250 /nfs/dbraw/zinc/46/72/50/1041467250.db2.gz JANSYUPCMPOOLK-UHFFFAOYSA-N -1 3 347.370 4.224 20 0 EIADHM CSc1ccc([O-])c(C(=O)N(C)[C@H](C)c2sc(C)nc2C)c1 ZINC000668400182 1041473475 /nfs/dbraw/zinc/47/34/75/1041473475.db2.gz VVVGCZFPEOZZEQ-SNVBAGLBSA-N -1 3 336.482 4.021 20 0 EIADHM CCc1ccc(C(=O)N2CCCCC[C@@H]2[C@H]2CCCCC2=O)c([O-])c1 ZINC000436832588 1041498693 /nfs/dbraw/zinc/49/86/93/1041498693.db2.gz SQFRJGOQACVWDA-SJLPKXTDSA-N -1 3 343.467 4.099 20 0 EIADHM CCc1ccc(C(=O)N2CCC(c3c(F)cccc3F)CC2)c([O-])c1 ZINC000436839150 1041499376 /nfs/dbraw/zinc/49/93/76/1041499376.db2.gz PCUOUJMKMODNRW-UHFFFAOYSA-N -1 3 345.389 4.253 20 0 EIADHM Cc1[nH]nc(-c2ccccc2)c1NC(=O)c1cc2c(cc1[O-])CCCC2 ZINC000436841258 1041510193 /nfs/dbraw/zinc/51/01/93/1041510193.db2.gz UCUVXWVYILLXQH-UHFFFAOYSA-N -1 3 347.418 4.222 20 0 EIADHM CC(=O)c1ccc(C(=O)N[C@@H](C)c2cccc3ccccc32)cc1[O-] ZINC000436843417 1041511145 /nfs/dbraw/zinc/51/11/45/1041511145.db2.gz HHGSQCGKLRHAJQ-ZDUSSCGKSA-N -1 3 333.387 4.239 20 0 EIADHM Cc1cccc(C(=O)Nc2cccc(Cl)c2OCC(F)F)c1[O-] ZINC000436847225 1041514778 /nfs/dbraw/zinc/51/47/78/1041514778.db2.gz PAJDEZOCOARIEW-UHFFFAOYSA-N -1 3 341.741 4.250 20 0 EIADHM COc1cccc(C(=O)Nc2cccc(-c3ccccc3OC)c2)c1[O-] ZINC000436864817 1041523234 /nfs/dbraw/zinc/52/32/34/1041523234.db2.gz PJSUKBWZBJJCHP-UHFFFAOYSA-N -1 3 349.386 4.329 20 0 EIADHM COc1ccc(-c2noc(-c3ccc(C(C)C)cc3[O-])n2)cc1OC ZINC000436893784 1041534246 /nfs/dbraw/zinc/53/42/46/1041534246.db2.gz BLTWGMWRAZLSPR-UHFFFAOYSA-N -1 3 340.379 4.250 20 0 EIADHM COCCCCc1noc(-c2cc(Cc3ccccc3)ccc2[O-])n1 ZINC000436916752 1041556197 /nfs/dbraw/zinc/55/61/97/1041556197.db2.gz BFFUTMYAKZIKDP-UHFFFAOYSA-N -1 3 338.407 4.002 20 0 EIADHM [O-]c1ccccc1-c1nc(Cc2c[nH]c3cc(Cl)ccc23)no1 ZINC000436917857 1041558077 /nfs/dbraw/zinc/55/80/77/1041558077.db2.gz FXAMTWUOHUSBHZ-UHFFFAOYSA-N -1 3 325.755 4.168 20 0 EIADHM Cc1cc(-c2noc(-c3cc4ccccc4cc3[O-])n2)cc2[nH]cnc21 ZINC000436932667 1041564331 /nfs/dbraw/zinc/56/43/31/1041564331.db2.gz QCCFMJBZBXNWTL-UHFFFAOYSA-N -1 3 342.358 4.447 20 0 EIADHM [O-]c1ccc(Cc2ccccc2)cc1-c1nc(CCc2ccco2)no1 ZINC000436945188 1041569024 /nfs/dbraw/zinc/56/90/24/1041569024.db2.gz MIJSWJWKKVICMS-UHFFFAOYSA-N -1 3 346.386 4.411 20 0 EIADHM C[C@@H]1C[C@H](C)CN(C(=O)c2cc(Oc3ccccc3)ccc2[O-])C1 ZINC000436953453 1041575458 /nfs/dbraw/zinc/57/54/58/1041575458.db2.gz POMGSFSTXOFEEH-GASCZTMLSA-N -1 3 325.408 4.303 20 0 EIADHM Cc1c[nH]c(-c2ccccc2NC(=O)c2ccc3c(c2[O-])CCCC3)n1 ZINC000436978258 1041579009 /nfs/dbraw/zinc/57/90/09/1041579009.db2.gz UYOQAOYNPBOXJY-UHFFFAOYSA-N -1 3 347.418 4.222 20 0 EIADHM CC[C@@H](C)n1nc(C(=O)Nc2ccc([O-])c(C(F)(F)F)c2)cc1C ZINC000437004780 1041589445 /nfs/dbraw/zinc/58/94/45/1041589445.db2.gz NFQASXRHVWJMGP-SECBINFHSA-N -1 3 341.333 4.139 20 0 EIADHM Cc1ccc(C(=O)Nc2ccc(Oc3ccncc3)cc2)c([O-])c1C ZINC000437001970 1041596053 /nfs/dbraw/zinc/59/60/53/1041596053.db2.gz RRKOTILZQKJNQB-UHFFFAOYSA-N -1 3 334.375 4.449 20 0 EIADHM O=C([N-]c1nncs1)c1c(F)cccc1Sc1ccccc1 ZINC000463643223 1041687437 /nfs/dbraw/zinc/68/74/37/1041687437.db2.gz JRNGOFBCDVPOFJ-UHFFFAOYSA-N -1 3 331.397 4.081 20 0 EIADHM O=C(COc1c(Cl)cccc1Cl)Nc1cc(Cl)ccc1[O-] ZINC000517092070 1041869611 /nfs/dbraw/zinc/86/96/11/1041869611.db2.gz UNKIWUGHKWEVFP-UHFFFAOYSA-N -1 3 346.597 4.370 20 0 EIADHM CC(C)c1ccc(C(=O)N2CC[C@](F)(c3ccccc3)C2)c([O-])c1 ZINC000669929623 1042370976 /nfs/dbraw/zinc/37/09/76/1042370976.db2.gz CSIQBHYRWMEXMR-HXUWFJFHSA-N -1 3 327.399 4.227 20 0 EIADHM CC(C)(Oc1cccc(Cl)c1)C(=O)Nc1cc(Cl)ccc1[O-] ZINC000303509768 1042453618 /nfs/dbraw/zinc/45/36/18/1042453618.db2.gz NTLGQMTZXZJJHO-UHFFFAOYSA-N -1 3 340.206 4.495 20 0 EIADHM Cc1sccc1NC(=O)c1c[n-]c(=NC(=O)OC(C)(C)C)s1 ZINC000913666761 1042462367 /nfs/dbraw/zinc/46/23/67/1042462367.db2.gz JUFQXXMBIQKTCU-UHFFFAOYSA-N -1 3 339.442 4.112 20 0 EIADHM Cc1ccc(C)c(OC2CCN([C@@H](C)c3ccc(C(=O)[O-])o3)CC2)c1 ZINC000518990486 1042786414 /nfs/dbraw/zinc/78/64/14/1042786414.db2.gz IWPDSJGXXTUMIU-HNNXBMFYSA-N -1 3 343.423 4.199 20 0 EIADHM O=C([O-])c1cccc(CNCc2cccc(OCc3ccccc3)c2)c1 ZINC000311484575 1042860614 /nfs/dbraw/zinc/86/06/14/1042860614.db2.gz IMARFIWERBSUKJ-UHFFFAOYSA-N -1 3 347.414 4.254 20 0 EIADHM Cc1nc(C(=O)[N-]c2nc(Sc3ccccc3)ns2)c(C)s1 ZINC000178550032 1042869039 /nfs/dbraw/zinc/86/90/39/1042869039.db2.gz JANKNAYQLFJXDK-UHFFFAOYSA-N -1 3 348.478 4.015 20 0 EIADHM O=C([N-]c1cc(Cl)cc(F)c1F)c1cc(F)c(F)c(F)c1F ZINC000441597827 1042905752 /nfs/dbraw/zinc/90/57/52/1042905752.db2.gz LZYRHLAGCPQIRG-UHFFFAOYSA-N -1 3 339.622 4.427 20 0 EIADHM CCSc1ccc(-c2noc(-c3cccc(OC)c3[O-])n2)cc1 ZINC000391793610 1043031596 /nfs/dbraw/zinc/03/15/96/1043031596.db2.gz BJLCUBZLNVSZQY-UHFFFAOYSA-N -1 3 328.393 4.230 20 0 EIADHM O=C([O-])C[C@H]1CCCN(CCSc2cc(Cl)ccc2Cl)C1 ZINC000054298520 1043153975 /nfs/dbraw/zinc/15/39/75/1043153975.db2.gz AEBQJJAGORFSNO-LLVKDONJSA-N -1 3 348.295 4.272 20 0 EIADHM Cc1ccc(NC(=O)C(C)(C)C)cc1NCc1cc([O-])cc(F)c1 ZINC000185595883 1043201841 /nfs/dbraw/zinc/20/18/41/1043201841.db2.gz VGVKGHOXTRZAMQ-UHFFFAOYSA-N -1 3 330.403 4.436 20 0 EIADHM O=C(Nc1ccnn1Cc1ccccc1)c1cc([O-])c2ccccc2c1 ZINC000527165840 1043250866 /nfs/dbraw/zinc/25/08/66/1043250866.db2.gz BGUNTEDZXFGMDI-UHFFFAOYSA-N -1 3 343.386 4.043 20 0 EIADHM O=C(NC[C@@H]1SCCc2ccccc21)c1cc([O-])c2ccccc2c1 ZINC000527166864 1043253548 /nfs/dbraw/zinc/25/35/48/1043253548.db2.gz UMYXMPIQJSBAKM-FQEVSTJZSA-N -1 3 349.455 4.306 20 0 EIADHM C[C@H]1CO[C@H](c2ccccc2)CN1C(=O)c1cc([O-])c2ccccc2c1 ZINC000527449291 1043261231 /nfs/dbraw/zinc/26/12/31/1043261231.db2.gz XXDORCKWLWIVIH-BTYIYWSLSA-N -1 3 347.414 4.148 20 0 EIADHM COc1ccccc1C[C@H](C)N(C)C(=O)c1cc([O-])c2ccccc2c1 ZINC000527467775 1043263293 /nfs/dbraw/zinc/26/32/93/1043263293.db2.gz GPIWFVZDUXSFNW-HNNXBMFYSA-N -1 3 349.430 4.257 20 0 EIADHM O=c1[n-]c(CN2CC[C@H]2c2cccc(F)c2)nc2c3ccccc3oc21 ZINC000674012856 1043291521 /nfs/dbraw/zinc/29/15/21/1043291521.db2.gz FWJIMQWHVHTIFZ-HNNXBMFYSA-N -1 3 349.365 4.168 20 0 EIADHM [O-]c1cccc(O[C@H]2Cc3ccc(Br)cc3C2)c1Cl ZINC001226712723 1043384408 /nfs/dbraw/zinc/38/44/08/1043384408.db2.gz USAWMMSUSSJBIF-LBPRGKRZSA-N -1 3 339.616 4.354 20 0 EIADHM Cc1cc(S(=O)(=O)[N-][C@@H](C)CCCC(F)(F)F)sc1Cl ZINC000494366764 1043436256 /nfs/dbraw/zinc/43/62/56/1043436256.db2.gz IXTJBDVJWVONFM-QMMMGPOBSA-N -1 3 349.827 4.109 20 0 EIADHM O=[S@@](Cc1ccc(Br)c(Cl)c1)c1ccc([O-])cc1 ZINC000189100108 1043436429 /nfs/dbraw/zinc/43/64/29/1043436429.db2.gz BNWFQDDZYXVPOI-SFHVURJKSA-N -1 3 345.645 4.116 20 0 EIADHM [O-]c1c(F)cc(F)cc1Nc1cn2cc(C(F)(F)F)ccc2n1 ZINC001212481656 1043453408 /nfs/dbraw/zinc/45/34/08/1043453408.db2.gz BPBXDJLWDJRLQE-UHFFFAOYSA-N -1 3 329.228 4.081 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2ccc(COC(C)(C)C)cc2)cc1C ZINC000674648551 1043818963 /nfs/dbraw/zinc/81/89/63/1043818963.db2.gz QZPSVNKMOMLMNF-UHFFFAOYSA-N -1 3 347.480 4.419 20 0 EIADHM O=C(CCCc1ccccc1)[N-]OCc1ccccc1C(F)(F)F ZINC000732804404 1044007588 /nfs/dbraw/zinc/00/75/88/1044007588.db2.gz JKCRHIWBKGYYSE-UHFFFAOYSA-N -1 3 337.341 4.276 20 0 EIADHM C[C@H](Oc1c([O-])cc(Cl)cc1F)c1cccc(Br)n1 ZINC001234448551 1044055645 /nfs/dbraw/zinc/05/56/45/1044055645.db2.gz UQIFWRQLCLYUGJ-ZETCQYMHSA-N -1 3 346.583 4.482 20 0 EIADHM Cc1ccc(C(=O)Nc2ccc(SC(=O)N(C)C)cc2)c([O-])c1C ZINC000733362216 1044206853 /nfs/dbraw/zinc/20/68/53/1044206853.db2.gz IVCSKFMKEXXODL-UHFFFAOYSA-N -1 3 344.436 4.035 20 0 EIADHM CCCCc1nc(COC(=O)c2cc(-c3ccc(C)o3)[n-]n2)cs1 ZINC000733450035 1044234043 /nfs/dbraw/zinc/23/40/43/1044234043.db2.gz BAGDNWIOIUHTIW-UHFFFAOYSA-N -1 3 345.424 4.134 20 0 EIADHM CCCCc1nc(COC(=O)c2cc(-c3ccc(C)o3)n[n-]2)cs1 ZINC000733450035 1044234056 /nfs/dbraw/zinc/23/40/56/1044234056.db2.gz BAGDNWIOIUHTIW-UHFFFAOYSA-N -1 3 345.424 4.134 20 0 EIADHM CC(=O)c1ccc(Cl)c([N-]S(=O)(=O)c2cc(C)sc2C)c1 ZINC000191178412 1044248108 /nfs/dbraw/zinc/24/81/08/1044248108.db2.gz PHQLRPPPTGHYEI-UHFFFAOYSA-N -1 3 343.857 4.022 20 0 EIADHM CCc1ccc([O-])c(C(=O)N(C)Cc2cccc(C(F)(F)F)c2)c1 ZINC000499716064 1044314238 /nfs/dbraw/zinc/31/42/38/1044314238.db2.gz VUFSGRJHQKSBQJ-UHFFFAOYSA-N -1 3 337.341 4.246 20 0 EIADHM O=C([O-])CCC1CCN(Cc2cnc(-c3ccccc3F)s2)CC1 ZINC000665343433 1044396010 /nfs/dbraw/zinc/39/60/10/1044396010.db2.gz IPVANIHXIOJAJX-UHFFFAOYSA-N -1 3 348.443 4.026 20 0 EIADHM Cc1cc(Cl)ccc1O[C@@H](C)C(=O)Nc1cc(Cl)ccc1[O-] ZINC000069693356 1044560185 /nfs/dbraw/zinc/56/01/85/1044560185.db2.gz YMTYBDNRKAVWTJ-JTQLQIEISA-N -1 3 340.206 4.413 20 0 EIADHM CC(=O)c1cccc(NC(=O)CCSc2ccc(C)c(C)c2)c1[O-] ZINC000673526582 1044584095 /nfs/dbraw/zinc/58/40/95/1044584095.db2.gz UGFVLMCJGLBYSY-UHFFFAOYSA-N -1 3 343.448 4.333 20 0 EIADHM O=C(OCc1coc(-c2ccc(Cl)cc2)n1)c1ccc([O-])cc1 ZINC000032169060 1044713453 /nfs/dbraw/zinc/71/34/53/1044713453.db2.gz JAANUKFELRUJMW-UHFFFAOYSA-N -1 3 329.739 4.058 20 0 EIADHM O=C([O-])C[C@H](NCc1ccccc1C(F)(F)F)c1cccs1 ZINC000315387113 1044877005 /nfs/dbraw/zinc/87/70/05/1044877005.db2.gz DUNQWXKANNCEKE-LBPRGKRZSA-N -1 3 329.343 4.073 20 0 EIADHM O=C([O-])C[C@H](NCc1cccc(C(F)(F)F)c1)c1cccs1 ZINC000315378486 1044877704 /nfs/dbraw/zinc/87/77/04/1044877704.db2.gz DEIBNBVQMJSZBO-LBPRGKRZSA-N -1 3 329.343 4.073 20 0 EIADHM CCc1oc2ccccc2c1CN[C@H](CC(=O)[O-])c1cccs1 ZINC000319915952 1045108754 /nfs/dbraw/zinc/10/87/54/1045108754.db2.gz DPHKBDNESYHDAC-CQSZACIVSA-N -1 3 329.421 4.362 20 0 EIADHM CCCOc1ccc([N-]S(=O)(=O)c2ccccc2C)cc1Cl ZINC000316434824 1045431584 /nfs/dbraw/zinc/43/15/84/1045431584.db2.gz JUWZRRJBBXFFDK-UHFFFAOYSA-N -1 3 339.844 4.238 20 0 EIADHM CCCOc1ccc([N-]S(=O)(=O)c2ccc(F)cc2)cc1Cl ZINC000316595898 1045449859 /nfs/dbraw/zinc/44/98/59/1045449859.db2.gz HQBPTACTHZAAJK-UHFFFAOYSA-N -1 3 343.807 4.069 20 0 EIADHM Clc1ccc2nsnc2c1[N-]c1nc(-c2cnccn2)cs1 ZINC000790585408 1045537050 /nfs/dbraw/zinc/53/70/50/1045537050.db2.gz BVPWGXLWJBQDBE-UHFFFAOYSA-N -1 3 346.828 4.002 20 0 EIADHM CCS[C@@H]1CCC[C@H](NC(=O)c2cc3sccc3c([O-])c2)C1 ZINC000791378553 1045726709 /nfs/dbraw/zinc/72/67/09/1045726709.db2.gz KHULNZQPJZKUGS-QWHCGFSZSA-N -1 3 335.494 4.401 20 0 EIADHM Cc1cccnc1[C@@H](NC(=O)c1cc2sccc2c([O-])c1)C(C)C ZINC000791365702 1045730489 /nfs/dbraw/zinc/73/04/89/1045730489.db2.gz CLXMGEJPKMIZDN-KRWDZBQOSA-N -1 3 340.448 4.437 20 0 EIADHM Cc1nn(-c2ccccc2)c(C)c1C(=O)Nc1cc(Cl)ccc1[O-] ZINC000067145569 1045738720 /nfs/dbraw/zinc/73/87/20/1045738720.db2.gz FZCJSCQWUKPEAZ-UHFFFAOYSA-N -1 3 341.798 4.100 20 0 EIADHM CCOc1cc(/C=C\c2nc(Cl)ncc2C)cc(Cl)c1[O-] ZINC000791435288 1045740171 /nfs/dbraw/zinc/74/01/71/1045740171.db2.gz RRGOFTXMFOIFNQ-PLNGDYQASA-N -1 3 325.195 4.367 20 0 EIADHM Nc1cc(Cl)c(Br)cc1Nc1ccc([O-])c(F)c1F ZINC001212016224 1045839626 /nfs/dbraw/zinc/83/96/26/1045839626.db2.gz FEAICXKSBHFTBL-UHFFFAOYSA-N -1 3 349.562 4.412 20 0 EIADHM Cc1cc(-c2ccccc2)ccc1NC(=O)NCc1ncccc1[O-] ZINC000791746089 1045804621 /nfs/dbraw/zinc/80/46/21/1045804621.db2.gz XDWMXSOCHDYDFM-UHFFFAOYSA-N -1 3 333.391 4.084 20 0 EIADHM Cc1cc(N)c(Nc2ccc([O-])c(F)c2F)cc1Br ZINC001212009736 1045831781 /nfs/dbraw/zinc/83/17/81/1045831781.db2.gz UFPXHWHRFWFTOO-UHFFFAOYSA-N -1 3 329.144 4.067 20 0 EIADHM O=C(NC1CCCCC1)c1cccc(Nc2ccc([O-])c(F)c2F)c1 ZINC001212009462 1045832447 /nfs/dbraw/zinc/83/24/47/1045832447.db2.gz PNLIOKMVHWBGOL-UHFFFAOYSA-N -1 3 346.377 4.477 20 0 EIADHM COc1c(F)cc(Nc2ccc([O-])c(F)c2F)cc1Br ZINC001212013977 1045834673 /nfs/dbraw/zinc/83/46/73/1045834673.db2.gz STJAHDVFADLHQF-UHFFFAOYSA-N -1 3 348.118 4.324 20 0 EIADHM Cc1nnc(-c2ccc(NC(=O)c3cc([O-])c4ccccc4c3)cc2)o1 ZINC000792191256 1045876216 /nfs/dbraw/zinc/87/62/16/1045876216.db2.gz SEIHEHJXJPOGHA-UHFFFAOYSA-N -1 3 345.358 4.156 20 0 EIADHM O=C([O-])CCCCCCCNCc1cccc(F)c1Br ZINC000841795691 1045915969 /nfs/dbraw/zinc/91/59/69/1045915969.db2.gz USYFGKHCZSNVJN-UHFFFAOYSA-N -1 3 346.240 4.103 20 0 EIADHM C[C@@H](NCc1cc(Cl)cc([N+](=O)[O-])c1[O-])c1ccc(F)cc1F ZINC000237456014 1046061947 /nfs/dbraw/zinc/06/19/47/1046061947.db2.gz BIMDAEBELKMFMJ-MRVPVSSYSA-N -1 3 342.729 4.083 20 0 EIADHM CS/C=C\C(=O)Nc1ccc([O-])c(-c2nc3ccccc3s2)c1 ZINC000770079491 1046143354 /nfs/dbraw/zinc/14/33/54/1046143354.db2.gz KPIPHZHAQKSNIC-HJWRWDBZSA-N -1 3 342.445 4.484 20 0 EIADHM O=C([O-])CC[C@H]1CCCN(Cc2cc(-c3ccc(Cl)cc3)no2)C1 ZINC000263086189 1046250627 /nfs/dbraw/zinc/25/06/27/1046250627.db2.gz IKDUWQCSXJJVGO-CYBMUJFWSA-N -1 3 348.830 4.072 20 0 EIADHM C[C@@H](NCc1ccc(C(=O)[O-])cc1)c1ccc(OCC2CC2)c(F)c1 ZINC000263414999 1046285310 /nfs/dbraw/zinc/28/53/10/1046285310.db2.gz MVOBKOZRMPBYSE-CYBMUJFWSA-N -1 3 343.398 4.164 20 0 EIADHM C[C@H](C(=O)Nc1cc(Br)ccc1[O-])c1cccc(F)c1 ZINC000126683557 1046514294 /nfs/dbraw/zinc/51/42/94/1046514294.db2.gz TZPGEXHBFLOHEV-VIFPVBQESA-N -1 3 338.176 4.036 20 0 EIADHM Cc1onc(-c2ccccc2C)c1C(=O)[N-]c1ccnc(Cl)c1F ZINC001129620798 1046605848 /nfs/dbraw/zinc/60/58/48/1046605848.db2.gz GRHAGYJGAVZAIS-UHFFFAOYSA-N -1 3 345.761 4.398 20 0 EIADHM C[C@@H]1C[C@H](c2cccnc2)N(Cc2cccc([O-])c2Br)C1 ZINC000459489722 1046716479 /nfs/dbraw/zinc/71/64/79/1046716479.db2.gz UOTYIDNZCYHQPZ-IUODEOHRSA-N -1 3 347.256 4.133 20 0 EIADHM COc1ccc([O-])c(C(=O)Nc2cccc(COC(C)(C)C)c2C)c1 ZINC000536725367 1046722088 /nfs/dbraw/zinc/72/20/88/1046722088.db2.gz GQYUYIOUIQSCEU-UHFFFAOYSA-N -1 3 343.423 4.277 20 0 EIADHM CCOc1ccccc1C1=CCN(C(=O)c2ccc(C)cc2[O-])CC1 ZINC000127984235 1046745715 /nfs/dbraw/zinc/74/57/15/1046745715.db2.gz JYQZNNQBHBILLN-UHFFFAOYSA-N -1 3 337.419 4.029 20 0 EIADHM CCCN(CCc1ccccn1)Cc1cccc([O-])c1Br ZINC000459555982 1046774216 /nfs/dbraw/zinc/77/42/16/1046774216.db2.gz HOBSKDPNZAMXBF-UHFFFAOYSA-N -1 3 349.272 4.004 20 0 EIADHM O=C(Nc1cccc([O-])c1F)c1ccc(Br)c(Cl)c1 ZINC000128444450 1046870792 /nfs/dbraw/zinc/87/07/92/1046870792.db2.gz PHHUZUGSQSAODG-UHFFFAOYSA-N -1 3 344.567 4.200 20 0 EIADHM CN(C(=O)c1cc2c(cc1[O-])CCCC2)c1cccc2cccnc21 ZINC000670381225 1046885095 /nfs/dbraw/zinc/88/50/95/1046885095.db2.gz GOQSHEISGFPHCM-UHFFFAOYSA-N -1 3 332.403 4.096 20 0 EIADHM COC(=O)c1ccc(C(=O)[N-]c2cc(Cl)ccc2SC)s1 ZINC000068298266 1046969629 /nfs/dbraw/zinc/96/96/29/1046969629.db2.gz OBMSYXANBWVVFL-UHFFFAOYSA-N -1 3 341.841 4.162 20 0 EIADHM CSc1cccc([C@H]([N-]C(=O)C(F)F)c2cc(F)ccc2F)c1 ZINC000787397616 1047005785 /nfs/dbraw/zinc/00/57/85/1047005785.db2.gz WIKKOWFTHWDJNH-AWEZNQCLSA-N -1 3 343.345 4.157 20 0 EIADHM O=C([N-][C@@H](c1ccccc1)c1cc(Cl)ccc1Cl)C(F)F ZINC000787516378 1047022638 /nfs/dbraw/zinc/02/26/38/1047022638.db2.gz VWMLPXCSQIXUSF-ZDUSSCGKSA-N -1 3 330.161 4.464 20 0 EIADHM O=C([N-][C@H](c1ccccc1)c1cc(Cl)ccc1Cl)C(F)F ZINC000787516376 1047023219 /nfs/dbraw/zinc/02/32/19/1047023219.db2.gz VWMLPXCSQIXUSF-CYBMUJFWSA-N -1 3 330.161 4.464 20 0 EIADHM CC(C)(C)c1cc(CS(=O)(=O)[N-]c2ccc3ccccc3c2)no1 ZINC000788140653 1047115505 /nfs/dbraw/zinc/11/55/05/1047115505.db2.gz YRZANCOZELWQMW-UHFFFAOYSA-N -1 3 344.436 4.067 20 0 EIADHM CCOCc1cccc(NC(=O)c2cc3sccc3c([O-])c2)c1 ZINC000788296380 1047149620 /nfs/dbraw/zinc/14/96/20/1047149620.db2.gz MIXLAIISTDVTHZ-UHFFFAOYSA-N -1 3 327.405 4.396 20 0 EIADHM O=C(NCCCOC1CCCCC1)c1cc2sccc2c([O-])c1 ZINC000788265126 1047149766 /nfs/dbraw/zinc/14/97/66/1047149766.db2.gz JJNMPMKCWSBCPT-UHFFFAOYSA-N -1 3 333.453 4.076 20 0 EIADHM O=C(Nc1cccc(OC(F)F)c1)c1cc2sccc2c([O-])c1 ZINC000788282078 1047156649 /nfs/dbraw/zinc/15/66/49/1047156649.db2.gz ORSMEGYBBJPCRG-UHFFFAOYSA-N -1 3 335.331 4.461 20 0 EIADHM CC(C)(C)c1nnc(NC(=O)c2cc3sccc3c([O-])c2)s1 ZINC000788291910 1047159105 /nfs/dbraw/zinc/15/91/05/1047159105.db2.gz WMPLJOREDGLCBV-UHFFFAOYSA-N -1 3 333.438 4.008 20 0 EIADHM C[C@@H](Oc1cccc(Cl)c1Cl)C(=O)Nc1cccc([O-])c1F ZINC000129084433 1047287180 /nfs/dbraw/zinc/28/71/80/1047287180.db2.gz RCNGJAXEXQCEQK-MRVPVSSYSA-N -1 3 344.169 4.244 20 0 EIADHM O=C(Nc1cccc([O-])c1F)[C@H](Oc1ccccc1)c1ccccc1 ZINC000129093582 1047295397 /nfs/dbraw/zinc/29/53/97/1047295397.db2.gz UWZJUZKKMYNHRF-LJQANCHMSA-N -1 3 337.350 4.290 20 0 EIADHM C[C@@H](C(=O)Nc1ccc([O-])c(C(F)(F)F)c1)c1ccc(F)c(F)c1 ZINC000476150348 1047378923 /nfs/dbraw/zinc/37/89/23/1047378923.db2.gz JYQYDFUWIDQOJU-MRVPVSSYSA-N -1 3 345.267 4.431 20 0 EIADHM CSc1nc(NC(=O)CC2(CCc3ccccc3)CCCC2)n[n-]1 ZINC000498183193 1047405122 /nfs/dbraw/zinc/40/51/22/1047405122.db2.gz OQFQEVUGJQUKGT-UHFFFAOYSA-N -1 3 344.484 4.048 20 0 EIADHM Cc1cc(=O)[n-]c(-c2cccc(OC(=O)[C@H]3CCCCC3(C)C)c2)n1 ZINC000789435846 1047423237 /nfs/dbraw/zinc/42/32/37/1047423237.db2.gz UKAJVWMJXNHNGT-MRXNPFEDSA-N -1 3 340.423 4.279 20 0 EIADHM C[C@@H](Sc1ccc(Cl)cc1)C(=O)Nc1cccc([O-])c1F ZINC000129656303 1047458198 /nfs/dbraw/zinc/45/81/98/1047458198.db2.gz NSMBJVGTOJSHNS-SECBINFHSA-N -1 3 325.792 4.304 20 0 EIADHM COc1cc(-c2ccccc2)sc1C(=O)[N-]c1ccnc(F)c1F ZINC001131210421 1047849386 /nfs/dbraw/zinc/84/93/86/1047849386.db2.gz IWVWQWQYIVUVQU-UHFFFAOYSA-N -1 3 346.358 4.349 20 0 EIADHM C[C@H](OC(=O)c1cc2ccsc2[n-]1)C(=O)C1(c2ccccc2)CC1 ZINC000808494467 1047971114 /nfs/dbraw/zinc/97/11/14/1047971114.db2.gz ZWGJDUNPOUSOFG-LBPRGKRZSA-N -1 3 339.416 4.076 20 0 EIADHM CCC[C@@H](Cc1ccccc1)NC(=O)c1cc(SC)ccc1[O-] ZINC001143696657 1048158889 /nfs/dbraw/zinc/15/88/89/1048158889.db2.gz MIFCRKJWIOOUMZ-HNNXBMFYSA-N -1 3 329.465 4.255 20 0 EIADHM O=C([N-]c1ccccc1SC(F)(F)F)c1noc2c1CCCC2 ZINC000920002952 1048378563 /nfs/dbraw/zinc/37/85/63/1048378563.db2.gz FXXKQYQHHGFWAE-UHFFFAOYSA-N -1 3 342.342 4.418 20 0 EIADHM CCc1cc([N-]C(=O)c2c(F)ccc(SCC3CC3)c2F)no1 ZINC001135191987 1048596566 /nfs/dbraw/zinc/59/65/66/1048596566.db2.gz LDSJGDHEBTZAOD-UHFFFAOYSA-N -1 3 338.379 4.270 20 0 EIADHM C[C@H]1CN(Cc2c(F)cc([O-])cc2F)CC[C@@]1(C)c1cccc(O)c1 ZINC001144554756 1048723501 /nfs/dbraw/zinc/72/35/01/1048723501.db2.gz GGKDVNKBLNNFCR-RNODOKPDSA-N -1 3 347.405 4.176 20 0 EIADHM CN(C(=O)Cc1ccc([O-])c(F)c1)C(c1ccccc1)c1ccccc1 ZINC001144616329 1048758066 /nfs/dbraw/zinc/75/80/66/1048758066.db2.gz JCHMBILAGXFUJS-UHFFFAOYSA-N -1 3 349.405 4.322 20 0 EIADHM Cc1c(Cl)cccc1NC(=O)c1c[n-]c2c(Cl)cccc2c1=O ZINC001135566003 1048801995 /nfs/dbraw/zinc/80/19/95/1048801995.db2.gz NAVSUKBLUHIMEI-UHFFFAOYSA-N -1 3 347.201 4.396 20 0 EIADHM O=C(OCc1nc2ccccc2o1)c1cc2cc(Cl)sc2[n-]1 ZINC000810570600 1048821576 /nfs/dbraw/zinc/82/15/76/1048821576.db2.gz JKTLXOAHTNXSAT-UHFFFAOYSA-N -1 3 332.768 4.381 20 0 EIADHM O=C([N-]Cc1cccc(Cl)c1)C(F)(F)c1cccc(Cl)c1 ZINC000920999025 1048827080 /nfs/dbraw/zinc/82/70/80/1048827080.db2.gz ALPBBCFGNOOYJS-UHFFFAOYSA-N -1 3 330.161 4.402 20 0 EIADHM CC1(C)[C@H](OC(=O)c2cc3cc(Cl)sc3[n-]2)[C@H]2CCCO[C@H]21 ZINC000810597246 1048827190 /nfs/dbraw/zinc/82/71/90/1048827190.db2.gz ZYTHVSVKKJDROE-ZWKOPEQDSA-N -1 3 339.844 4.243 20 0 EIADHM [O-]c1ccc(F)c(CNc2cc(F)c(N3CCCC3)c(F)c2)c1F ZINC000816523246 1048830109 /nfs/dbraw/zinc/83/01/09/1048830109.db2.gz JJEBUHPAZSGVDP-UHFFFAOYSA-N -1 3 340.320 4.161 20 0 EIADHM COc1ccc(NCc2c(F)ccc([O-])c2F)c(Br)c1 ZINC000816527841 1048830845 /nfs/dbraw/zinc/83/08/45/1048830845.db2.gz AUMQXPLHOUMUQR-UHFFFAOYSA-N -1 3 344.155 4.054 20 0 EIADHM O=C([O-])[C@H](c1cc(Cl)cc(Cl)c1)N1CCC2(CCCC2)C1 ZINC000846244227 1048846471 /nfs/dbraw/zinc/84/64/71/1048846471.db2.gz GYZSEZPVHYUGOF-AWEZNQCLSA-N -1 3 328.239 4.385 20 0 EIADHM O=C(CCc1ccc(-c2ccccc2F)o1)[N-]Oc1ccccc1 ZINC000816683988 1048853215 /nfs/dbraw/zinc/85/32/15/1048853215.db2.gz HOOKSEXIKWDLNL-UHFFFAOYSA-N -1 3 325.339 4.129 20 0 EIADHM CC[C@H](C)[C@H](C)N(C(=O)c1cc([O-])cc(Br)c1)C1CC1 ZINC001144848417 1048868887 /nfs/dbraw/zinc/86/88/87/1048868887.db2.gz AJNJDORXZXPXGE-QWRGUYRKSA-N -1 3 340.261 4.194 20 0 EIADHM CC(=O)c1cccc([O-])c1NC(=O)Cc1ccc(C(C)(C)C)cc1 ZINC001144869230 1048874844 /nfs/dbraw/zinc/87/48/44/1048874844.db2.gz VQXSLGOEZBRRDK-UHFFFAOYSA-N -1 3 325.408 4.074 20 0 EIADHM CCC[C@@H](C(=O)Nc1cccc(-c2nc(CC)cc(=O)[n-]2)c1)C(C)C ZINC000134318893 1048933384 /nfs/dbraw/zinc/93/33/84/1048933384.db2.gz NZEPNYQOGXUPDI-QGZVFWFLSA-N -1 3 341.455 4.010 20 0 EIADHM Cc1ccc(C(=O)Nc2cc(Br)c(F)cc2C)c([O-])c1 ZINC000232102755 1048934899 /nfs/dbraw/zinc/93/48/99/1048934899.db2.gz JCWOPKJKQYWEGX-UHFFFAOYSA-N -1 3 338.176 4.163 20 0 EIADHM O=C(CCC(=O)c1ccc(-c2ccccc2)cc1)[N-]OCCC1CC1 ZINC000817408558 1048962894 /nfs/dbraw/zinc/96/28/94/1048962894.db2.gz XGPWYZIPIONWSG-UHFFFAOYSA-N -1 3 337.419 4.164 20 0 EIADHM O=C([N-]OCCC1CC1)[C@H]1CC=CC[C@H]1c1nc2ccccc2s1 ZINC000817388536 1048966062 /nfs/dbraw/zinc/96/60/62/1048966062.db2.gz YMZUXNMYJKHLNU-LSDHHAIUSA-N -1 3 342.464 4.194 20 0 EIADHM O=C([N-]OCCC(F)(F)F)C1(Cc2cccs2)CCCCC1 ZINC000811230766 1049000232 /nfs/dbraw/zinc/00/02/32/1049000232.db2.gz UOTRPXNTLGZSQS-UHFFFAOYSA-N -1 3 335.391 4.241 20 0 EIADHM CCC(F)(F)c1ccccc1NC(=O)c1c[n-]c2ccccc2c1=O ZINC001132770034 1049038139 /nfs/dbraw/zinc/03/81/39/1049038139.db2.gz PEWVTVSNZWJIIK-UHFFFAOYSA-N -1 3 342.345 4.282 20 0 EIADHM Cc1nccn1CCCCOC(=O)c1cc2cc(Cl)sc2[n-]1 ZINC000811394285 1049050524 /nfs/dbraw/zinc/05/05/24/1049050524.db2.gz OZBLIABUCNKKKO-UHFFFAOYSA-N -1 3 337.832 4.025 20 0 EIADHM O=C(COC(=O)c1cc2cc(Cl)sc2[n-]1)c1cccc(F)c1 ZINC000811394513 1049050883 /nfs/dbraw/zinc/05/08/83/1049050883.db2.gz DTRUKTVICWTVPK-UHFFFAOYSA-N -1 3 337.759 4.062 20 0 EIADHM Cc1cccc(C(=O)Nc2nc3c(s2)c(Cl)ccc3F)c1[O-] ZINC001171284386 1049051502 /nfs/dbraw/zinc/05/15/02/1049051502.db2.gz IXUCIQUZUAXUKD-UHFFFAOYSA-N -1 3 336.775 4.355 20 0 EIADHM Cc1ccc(NC(=O)c2cc3c(cc2[O-])CCCC3)cc1OC(F)F ZINC001147418263 1049152424 /nfs/dbraw/zinc/15/24/24/1049152424.db2.gz NHYGMSYAQPORJK-UHFFFAOYSA-N -1 3 347.361 4.433 20 0 EIADHM O=C(N[C@H](c1ccccc1)C1CC1)c1cc([O-])cc(Br)c1 ZINC001136149513 1049175107 /nfs/dbraw/zinc/17/51/07/1049175107.db2.gz NIISXCYJGXKFSQ-MRXNPFEDSA-N -1 3 346.224 4.036 20 0 EIADHM Cc1ccc(C(=O)Nc2cc(C3CCCCCC3)[nH]n2)c([O-])c1C ZINC001147721948 1049210223 /nfs/dbraw/zinc/21/02/23/1049210223.db2.gz LLJPSOHVURVIMT-UHFFFAOYSA-N -1 3 327.428 4.422 20 0 EIADHM CCC[C@H](C(=O)Nc1ccc(Br)cc1[O-])c1ccccn1 ZINC001136219446 1049322355 /nfs/dbraw/zinc/32/23/55/1049322355.db2.gz TXZVYVIZVLBJJZ-LBPRGKRZSA-N -1 3 349.228 4.072 20 0 EIADHM O=C(Nc1ccc(F)c([O-])c1)c1ccc(Cl)cc1C(F)(F)F ZINC001148959517 1049406051 /nfs/dbraw/zinc/40/60/51/1049406051.db2.gz WIRWSMUSZRZDOP-UHFFFAOYSA-N -1 3 333.668 4.456 20 0 EIADHM CCN(C(=O)c1ccc(C(C)C)cc1[O-])[C@H](C)[C@H](O)c1ccccc1 ZINC000820108203 1049435030 /nfs/dbraw/zinc/43/50/30/1049435030.db2.gz LWVGKEMPVLUZKE-QRWLVFNGSA-N -1 3 341.451 4.100 20 0 EIADHM Cc1sc2[n-]c([C@H](C)OC(=O)CCCC3CC3)nc(=O)c2c1C ZINC000812601757 1049517630 /nfs/dbraw/zinc/51/76/30/1049517630.db2.gz FTKAPYLBOWQIOK-JTQLQIEISA-N -1 3 334.441 4.198 20 0 EIADHM CC(C)Oc1ccc([N-]S(=O)(=O)c2ccc(OC(C)C)cc2)cc1 ZINC000243183783 1049531258 /nfs/dbraw/zinc/53/12/58/1049531258.db2.gz JXSISGHUBSJRSR-UHFFFAOYSA-N -1 3 349.452 4.062 20 0 EIADHM CCc1ccc(C(=O)NCCc2c[nH]c3cc(Cl)ccc23)c([O-])c1 ZINC001136477166 1049666368 /nfs/dbraw/zinc/66/63/68/1049666368.db2.gz ZFQUWGXRBQEMGA-UHFFFAOYSA-N -1 3 342.826 4.062 20 0 EIADHM CCCCN(Cc1ccccc1F)C(=O)c1ccc(C(C)=O)c([O-])c1 ZINC001136558588 1049743136 /nfs/dbraw/zinc/74/31/36/1049743136.db2.gz VSGVQZFFGBZIET-UHFFFAOYSA-N -1 3 343.398 4.176 20 0 EIADHM Cc1ccc(C(=O)Nc2cccc(Br)c2C)c([O-])c1C ZINC001136556244 1049744628 /nfs/dbraw/zinc/74/46/28/1049744628.db2.gz VWYTVMQEAKGCJA-UHFFFAOYSA-N -1 3 334.213 4.332 20 0 EIADHM COC(=O)c1c(F)ccc(SC)c1-c1cc(Cl)ccc1[O-] ZINC001245057286 1049801744 /nfs/dbraw/zinc/80/17/44/1049801744.db2.gz MJTGMAQVKFLEBT-UHFFFAOYSA-N -1 3 326.776 4.360 20 0 EIADHM Cc1ccccc1C(F)(F)C(=O)[N-][C@H](C)c1c(F)cccc1F ZINC001133892835 1049809765 /nfs/dbraw/zinc/80/97/65/1049809765.db2.gz XVTGKBQNUQHFBK-LLVKDONJSA-N -1 3 325.305 4.242 20 0 EIADHM Cc1ccc(CCNC(=O)c2cc(Oc3ccccc3)ccc2[O-])cc1 ZINC001136792358 1049885360 /nfs/dbraw/zinc/88/53/60/1049885360.db2.gz YJXYKTTXKWZREY-UHFFFAOYSA-N -1 3 347.414 4.465 20 0 EIADHM COc1ccc(C(=O)NCC(C)(C)CCCc2ccccc2)c([O-])c1 ZINC001136815386 1049893698 /nfs/dbraw/zinc/89/36/98/1049893698.db2.gz MSLWQRLFERSNHX-UHFFFAOYSA-N -1 3 341.451 4.180 20 0 EIADHM CCCCCC[C@H](CCCC)n1c2[n-]c(=O)sc2c(=O)nc1N ZINC001172511771 1049927249 /nfs/dbraw/zinc/92/72/49/1049927249.db2.gz WQWOGHQOOFDUQP-NSHDSACASA-N -1 3 338.477 4.085 20 0 EIADHM Cc1cccc(C)c1[C@@H]1CCCN1C(=O)Cc1ccc([O-])c(F)c1 ZINC000617173983 1049962107 /nfs/dbraw/zinc/96/21/07/1049962107.db2.gz PQSSJOCGHHOVGU-KRWDZBQOSA-N -1 3 327.399 4.054 20 0 EIADHM CC(=O)OCc1cccc(Cl)c1Nc1cc([O-])c(F)cc1F ZINC001212777476 1050274631 /nfs/dbraw/zinc/27/46/31/1050274631.db2.gz NTWZIEJGTAKFLO-UHFFFAOYSA-N -1 3 327.714 4.131 20 0 EIADHM C[C@H](NC(=O)Nc1c([O-])cccc1Br)C1CCCCC1 ZINC001186395284 1050307350 /nfs/dbraw/zinc/30/73/50/1050307350.db2.gz ZLZRAWUGWPGNGY-JTQLQIEISA-N -1 3 341.249 4.245 20 0 EIADHM O=C(/C=C/c1ccc(F)cc1C(F)(F)F)Nc1ccc(F)c([O-])c1 ZINC001179799258 1050780502 /nfs/dbraw/zinc/78/05/02/1050780502.db2.gz FIJOMCDRFZCXJS-QHHAFSJGSA-N -1 3 343.251 4.341 20 0 EIADHM Cc1ccc(C(=O)N[C@H](c2ccc(F)cc2F)C(C)(C)C)c([O-])c1 ZINC001150882226 1050781017 /nfs/dbraw/zinc/78/10/17/1050781017.db2.gz XCMVELPJNMCEPT-QGZVFWFLSA-N -1 3 333.378 4.496 20 0 EIADHM COc1cccc([C@H](NC(=O)c2c(C)cccc2[O-])c2ccccc2)c1 ZINC001188660085 1050813880 /nfs/dbraw/zinc/81/38/80/1050813880.db2.gz VTOLPFFUHJJQGH-OAQYLSRUSA-N -1 3 347.414 4.229 20 0 EIADHM O=C(c1cccc(Nc2c(F)cc([O-])cc2F)c1)N1CCCCC1 ZINC001174175755 1050816901 /nfs/dbraw/zinc/81/69/01/1050816901.db2.gz ABDOGVATJACWDT-UHFFFAOYSA-N -1 3 332.350 4.040 20 0 EIADHM O=C(NC1CCCC1)c1cccc(Nc2ccc([O-])c(F)c2F)c1 ZINC001174197856 1050832724 /nfs/dbraw/zinc/83/27/24/1050832724.db2.gz UMLXGVNDOZOGIJ-UHFFFAOYSA-N -1 3 332.350 4.086 20 0 EIADHM Cc1cccc(C)c1C(=O)Nc1ccc(C(=O)OC(C)(C)C)cc1[O-] ZINC001189056874 1050895476 /nfs/dbraw/zinc/89/54/76/1050895476.db2.gz URYNOCNMKGPCSZ-UHFFFAOYSA-N -1 3 341.407 4.217 20 0 EIADHM O=C(Nc1ccc(F)c([O-])c1)c1cc(F)c(F)c(C(F)(F)F)c1 ZINC001189349392 1050978133 /nfs/dbraw/zinc/97/81/33/1050978133.db2.gz MTHGLIMGLXUAMM-UHFFFAOYSA-N -1 3 335.203 4.081 20 0 EIADHM CCc1cc(Oc2cccc(NC(=O)c3cnn[n-]3)c2)ccc1Cl ZINC001189351514 1050979032 /nfs/dbraw/zinc/97/90/32/1050979032.db2.gz HPUDDUPRWHMZRD-UHFFFAOYSA-N -1 3 342.786 4.065 20 0 EIADHM CCc1cc(Oc2cccc(NC(=O)c3c[n-]nn3)c2)ccc1Cl ZINC001189351514 1050979044 /nfs/dbraw/zinc/97/90/44/1050979044.db2.gz HPUDDUPRWHMZRD-UHFFFAOYSA-N -1 3 342.786 4.065 20 0 EIADHM CCc1cc(Oc2cccc(NC(=O)c3cn[n-]n3)c2)ccc1Cl ZINC001189351514 1050979052 /nfs/dbraw/zinc/97/90/52/1050979052.db2.gz HPUDDUPRWHMZRD-UHFFFAOYSA-N -1 3 342.786 4.065 20 0 EIADHM O=C(Nc1ccc([O-])c(F)c1)NC(c1ccccc1)c1ccccc1 ZINC001189533417 1051015510 /nfs/dbraw/zinc/01/55/10/1051015510.db2.gz BGDUCKLIQNUDMP-UHFFFAOYSA-N -1 3 336.366 4.442 20 0 EIADHM CC(C)c1cccc(NC(=O)c2cccc(OC(F)(F)F)c2[O-])n1 ZINC001189749770 1051051997 /nfs/dbraw/zinc/05/19/97/1051051997.db2.gz VDNGAKPOFXODQH-UHFFFAOYSA-N -1 3 340.301 4.062 20 0 EIADHM CCC(C)(C)c1ccc(S(=O)(=O)[N-]c2c(C)ccnc2F)cc1 ZINC001190424396 1051181051 /nfs/dbraw/zinc/18/10/51/1051181051.db2.gz ZIHUJIXOXIBARR-UHFFFAOYSA-N -1 3 336.432 4.018 20 0 EIADHM [O-]c1c(F)cc(Br)cc1Nc1cccc(CO)c1Cl ZINC001212766675 1051196757 /nfs/dbraw/zinc/19/67/57/1051196757.db2.gz RQJOOAKJZMHIAN-UHFFFAOYSA-N -1 3 346.583 4.183 20 0 EIADHM CN(Cc1cccc([O-])c1Br)c1ccc2cc[nH]c2c1 ZINC001181435199 1051235062 /nfs/dbraw/zinc/23/50/62/1051235062.db2.gz AKJKUXTVOLIGOY-UHFFFAOYSA-N -1 3 331.213 4.272 20 0 EIADHM Cc1ccc(N(C)[C@@H]2CCCN(Cc3c(F)ccc([O-])c3F)C2)cc1 ZINC001181515011 1051244077 /nfs/dbraw/zinc/24/40/77/1051244077.db2.gz PFIYHGHKKFYDSQ-MRXNPFEDSA-N -1 3 346.421 4.080 20 0 EIADHM Cc1ccc(N(C)[C@H]2CCCN(Cc3c(F)ccc([O-])c3F)C2)cc1 ZINC001181515010 1051245707 /nfs/dbraw/zinc/24/57/07/1051245707.db2.gz PFIYHGHKKFYDSQ-INIZCTEOSA-N -1 3 346.421 4.080 20 0 EIADHM Cc1cc(OC(F)F)c(C(=O)[N-]c2c(C)noc2C2CC2)s1 ZINC000154066194 1051262770 /nfs/dbraw/zinc/26/27/70/1051262770.db2.gz HAUFEIXNYMVLFE-UHFFFAOYSA-N -1 3 328.340 4.084 20 0 EIADHM COc1cc(Nc2cc(Br)cc(F)c2[O-])ccc1C ZINC001175017880 1051296742 /nfs/dbraw/zinc/29/67/42/1051296742.db2.gz KZXFBKPUXQMVRT-UHFFFAOYSA-N -1 3 326.165 4.354 20 0 EIADHM COC(=O)c1cccc2nc([N-]c3c(F)ccc(F)c3F)sc21 ZINC001175025474 1051302044 /nfs/dbraw/zinc/30/20/44/1051302044.db2.gz LUQNAWXGJANLFZ-UHFFFAOYSA-N -1 3 338.310 4.244 20 0 EIADHM CCOc1ccc(F)c([N-]c2cc(-c3ccccc3O)no2)c1F ZINC001175039299 1051332293 /nfs/dbraw/zinc/33/22/93/1051332293.db2.gz PDAYCUKEULXYMX-UHFFFAOYSA-N -1 3 332.306 4.468 20 0 EIADHM [O-]c1cc(F)c(Nc2cc(F)ccc2OC[C@@H]2CCCO2)c(F)c1 ZINC001175100583 1051347386 /nfs/dbraw/zinc/34/73/86/1051347386.db2.gz WWYYRJLCOFUTRL-LBPRGKRZSA-N -1 3 339.313 4.111 20 0 EIADHM COC(=O)c1ccc(-c2cccc(Nc3c(F)cc([O-])cc3F)c2)o1 ZINC001175100695 1051348114 /nfs/dbraw/zinc/34/81/14/1051348114.db2.gz VRQDZOFEKKKNBY-UHFFFAOYSA-N -1 3 345.301 4.461 20 0 EIADHM [O-]c1cc(F)c(Nc2cc(F)c(Br)c(F)c2)c(F)c1 ZINC001175100601 1051348511 /nfs/dbraw/zinc/34/85/11/1051348511.db2.gz XPMSNAJKZCMRIA-UHFFFAOYSA-N -1 3 336.082 4.455 20 0 EIADHM COC(=O)c1cc2cccc(Nc3c(F)cc([O-])cc3F)c2s1 ZINC001175103091 1051351720 /nfs/dbraw/zinc/35/17/20/1051351720.db2.gz SYQXFSNVSYLUFT-UHFFFAOYSA-N -1 3 335.331 4.415 20 0 EIADHM CCOC(=O)c1cnc2cc(Nc3c(F)cc([O-])cc3F)ccc2c1 ZINC001175103706 1051353003 /nfs/dbraw/zinc/35/30/03/1051353003.db2.gz WRSIGSUVIHOCRN-UHFFFAOYSA-N -1 3 344.317 4.139 20 0 EIADHM COC(=O)c1cccc([O-])c1NC(=O)Nc1ccc(C(C)(C)C)cc1 ZINC001191152046 1051364771 /nfs/dbraw/zinc/36/47/71/1051364771.db2.gz QQEUGCBRURMXFE-UHFFFAOYSA-N -1 3 342.395 4.120 20 0 EIADHM CCCCc1ccc(S(=O)(=O)[N-]c2cccc(F)c2F)cc1 ZINC001191224142 1051401841 /nfs/dbraw/zinc/40/18/41/1051401841.db2.gz NELFMQFUGXKCHU-UHFFFAOYSA-N -1 3 325.380 4.108 20 0 EIADHM CCC(CC)Oc1cccc(F)c1[N-]S(=O)(=O)CC1CCCC1 ZINC001191536073 1051477525 /nfs/dbraw/zinc/47/75/25/1051477525.db2.gz WJSKCITZDAIYKU-UHFFFAOYSA-N -1 3 343.464 4.325 20 0 EIADHM Cc1cc(=O)[n-]c([C@@H](C)Sc2ncc(-c3ccc(F)cc3)o2)n1 ZINC000155925032 1051478255 /nfs/dbraw/zinc/47/82/55/1051478255.db2.gz UUCAGPZQNKUYAR-SNVBAGLBSA-N -1 3 331.372 4.138 20 0 EIADHM COc1ccc(OCc2ccccc2)c([N-]c2nonc2C2CC2)c1 ZINC001175294002 1051489794 /nfs/dbraw/zinc/48/97/94/1051489794.db2.gz MWYFLRWNYGLZSC-UHFFFAOYSA-N -1 3 337.379 4.278 20 0 EIADHM [O-]c1ccc(F)c(Nc2cc(Cl)ncc2Br)c1F ZINC001175263944 1051501314 /nfs/dbraw/zinc/50/13/14/1051501314.db2.gz ZAEZYNOMXKJDKV-UHFFFAOYSA-N -1 3 335.535 4.225 20 0 EIADHM [O-]c1ccc(F)c(Nc2ccc3nc(-c4ccccc4)nn3c2)c1F ZINC001175266694 1051502751 /nfs/dbraw/zinc/50/27/51/1051502751.db2.gz XHICDTOFTBLCEY-UHFFFAOYSA-N -1 3 338.317 4.124 20 0 EIADHM COc1c(F)cc(Br)cc1Nc1c(F)ccc([O-])c1F ZINC001175269961 1051508039 /nfs/dbraw/zinc/50/80/39/1051508039.db2.gz OTSNIBVBNMZWAO-UHFFFAOYSA-N -1 3 348.118 4.324 20 0 EIADHM [O-]c1ccc(F)c(Nc2c(F)cccc2OC2CCOCC2)c1F ZINC001175270640 1051508948 /nfs/dbraw/zinc/50/89/48/1051508948.db2.gz GJEJJIPVWWVSOF-UHFFFAOYSA-N -1 3 339.313 4.111 20 0 EIADHM CCCCOc1c(Nc2ccc(-c3nn[n-]n3)cc2)ccc(F)c1F ZINC001175430423 1051586859 /nfs/dbraw/zinc/58/68/59/1051586859.db2.gz QAUZAGMGWHADMP-UHFFFAOYSA-N -1 3 345.353 4.067 20 0 EIADHM O=C([N-]c1csc2cnccc12)c1nc(C(F)(F)F)cs1 ZINC001192449443 1051737586 /nfs/dbraw/zinc/73/75/86/1051737586.db2.gz DQZKIIGOBWDGGB-UHFFFAOYSA-N -1 3 329.328 4.024 20 0 EIADHM CCCCOc1ccc(C(=O)N2CCCC3(CCCC3)C2)c([O-])c1 ZINC001183219419 1051807766 /nfs/dbraw/zinc/80/77/66/1051807766.db2.gz VVQKDSQCHMMRRB-UHFFFAOYSA-N -1 3 331.456 4.368 20 0 EIADHM CCOC(=O)c1nnsc1[N-]c1ccc2[nH]c3ccccc3c2c1 ZINC001175856171 1051822199 /nfs/dbraw/zinc/82/21/99/1051822199.db2.gz XWSHQIGEQHGBGA-UHFFFAOYSA-N -1 3 338.392 4.093 20 0 EIADHM Cc1cccc(Cl)c1NC(=O)[N-]c1cc(-c2ccccn2)no1 ZINC001183717951 1051888703 /nfs/dbraw/zinc/88/87/03/1051888703.db2.gz LUMBWRONAYXUOB-UHFFFAOYSA-N -1 3 328.759 4.342 20 0 EIADHM Cc1cc(S(=O)(=O)[N-]Cc2ccc(C(C)(C)C)o2)sc1Cl ZINC001193668252 1051972251 /nfs/dbraw/zinc/97/22/51/1051972251.db2.gz AQEBQARSGSRCSF-UHFFFAOYSA-N -1 3 347.889 4.079 20 0 EIADHM CN(C(=O)c1ccc([O-])cc1C(F)(F)F)[C@H]1CCc2ccccc21 ZINC001193745371 1051978436 /nfs/dbraw/zinc/97/84/36/1051978436.db2.gz HVGUGGNKFODVIL-INIZCTEOSA-N -1 3 335.325 4.171 20 0 EIADHM O=C(c1ccc([O-])cc1C(F)(F)F)N1C[C@@H]2C[C@H](C1)c1ccccc12 ZINC001193744956 1051979870 /nfs/dbraw/zinc/97/98/70/1051979870.db2.gz BEJLNNFYIGSJTJ-TXEJJXNPSA-N -1 3 347.336 4.138 20 0 EIADHM CC(C)(C)c1ccnc(C(=O)Nc2cc(Br)ccc2[O-])c1 ZINC001184569622 1052045400 /nfs/dbraw/zinc/04/54/00/1052045400.db2.gz YGRHDDVCTIWGGG-UHFFFAOYSA-N -1 3 349.228 4.100 20 0 EIADHM CC[C@@H](C)n1ncc(NC(=O)c2cc([O-])cc(C(F)(F)F)c2)c1C ZINC000621971122 1052045493 /nfs/dbraw/zinc/04/54/93/1052045493.db2.gz CLDPLOHRBQRJBZ-SECBINFHSA-N -1 3 341.333 4.139 20 0 EIADHM Cc1cc(S(=O)(=O)[N-][C@@H]2CC[C@H]3CCCC[C@@H]3C2)sc1Cl ZINC001184928599 1052131968 /nfs/dbraw/zinc/13/19/68/1052131968.db2.gz RLANXSVPPLSSQQ-JHJVBQTASA-N -1 3 347.933 4.347 20 0 EIADHM C[C@@H](NC(=O)Nc1cc(Br)ccc1[O-])c1ccccc1 ZINC001185013848 1052144912 /nfs/dbraw/zinc/14/49/12/1052144912.db2.gz XVKUYHNBTSCACW-SNVBAGLBSA-N -1 3 335.201 4.037 20 0 EIADHM C[C@@H](NC(=O)Nc1ccc([O-])c(Br)c1)c1ccccc1 ZINC001185013209 1052145459 /nfs/dbraw/zinc/14/54/59/1052145459.db2.gz NCCUFLWOAYICNB-SNVBAGLBSA-N -1 3 335.201 4.037 20 0 EIADHM O=C([N-]c1nnc(C(F)(F)F)s1)c1coc2ccc(Cl)cc12 ZINC001124862518 1052158987 /nfs/dbraw/zinc/15/89/87/1052158987.db2.gz GSKFKGABRWVFNV-UHFFFAOYSA-N -1 3 347.705 4.209 20 0 EIADHM Cc1cccc(C)c1S(=O)(=O)[N-]c1c(F)cccc1C(F)(F)F ZINC001194602989 1052176880 /nfs/dbraw/zinc/17/68/80/1052176880.db2.gz MDMQOTGFZPAVDC-UHFFFAOYSA-N -1 3 347.333 4.262 20 0 EIADHM Cc1cccc(C)c1S(=O)(=O)[N-]c1ccc(OC(C)C)c(F)c1 ZINC001194643556 1052185654 /nfs/dbraw/zinc/18/56/54/1052185654.db2.gz ZOIUIMAREOZHCH-UHFFFAOYSA-N -1 3 337.416 4.031 20 0 EIADHM CCc1cccc(C(=O)N(C)Cc2ccccc2C(F)(F)F)c1[O-] ZINC000622292902 1052186855 /nfs/dbraw/zinc/18/68/55/1052186855.db2.gz PQNTYYATZPHPNT-UHFFFAOYSA-N -1 3 337.341 4.246 20 0 EIADHM Cc1ccccc1[C@H](N=c1ncnc2[nH][n-]cc1-2)[C@@H]1CCC[C@@H](C)C1 ZINC001185323830 1052219881 /nfs/dbraw/zinc/21/98/81/1052219881.db2.gz ZFOCHIUOUTYFEW-DDUZABMNSA-N -1 3 335.455 4.014 20 0 EIADHM Cc1ccccc1[C@H](N=c1ncnc2[nH][n-]cc1-2)[C@@H]1CCC[C@H](C)C1 ZINC001185323832 1052221024 /nfs/dbraw/zinc/22/10/24/1052221024.db2.gz ZFOCHIUOUTYFEW-JCKWVBRZSA-N -1 3 335.455 4.014 20 0 EIADHM CCc1cccc(C(=O)N(C)[C@H](C)Cc2ccc(Cl)cc2)c1[O-] ZINC000622381895 1052238133 /nfs/dbraw/zinc/23/81/33/1052238133.db2.gz DXYRNPQVCYTEKO-CYBMUJFWSA-N -1 3 331.843 4.311 20 0 EIADHM CCc1ccc([O-])c(C(=O)N(C)[C@@H](C)Cc2ccc(Cl)cc2)c1 ZINC000622382266 1052238338 /nfs/dbraw/zinc/23/83/38/1052238338.db2.gz OZXXTANWDBHZGY-ZDUSSCGKSA-N -1 3 331.843 4.311 20 0 EIADHM CC(C)P(CCNC(=O)C=C([O-])c1ccccc1Cl)C(C)C ZINC001185443997 1052239910 /nfs/dbraw/zinc/23/99/10/1052239910.db2.gz JVQNHQSPURVSRD-UHFFFAOYSA-N -1 3 341.819 4.328 20 0 EIADHM CC(C)c1ccc(C(=O)N(Cc2ccccc2)CC(F)F)c([O-])c1 ZINC000622402205 1052246081 /nfs/dbraw/zinc/24/60/81/1052246081.db2.gz OVCSXDWEBGKNPP-UHFFFAOYSA-N -1 3 333.378 4.423 20 0 EIADHM COc1cccc(Cl)c1[N-]S(=O)(=O)c1ccc(Cl)c(C)c1 ZINC001185529552 1052257992 /nfs/dbraw/zinc/25/79/92/1052257992.db2.gz GXIGGPJUNKYCPQ-UHFFFAOYSA-N -1 3 346.235 4.111 20 0 EIADHM O=C(Nc1ccc2c(c1)CCC2)Nc1cc(Br)ccc1[O-] ZINC001185757593 1052293093 /nfs/dbraw/zinc/29/30/93/1052293093.db2.gz BYBAHPITBBVFAF-UHFFFAOYSA-N -1 3 347.212 4.287 20 0 EIADHM O=C(Cc1ccc([O-])c(F)c1)NC1(Cc2ccccc2)CCCCC1 ZINC000622515461 1052310695 /nfs/dbraw/zinc/31/06/95/1052310695.db2.gz WGLGZWISOPGTNP-UHFFFAOYSA-N -1 3 341.426 4.136 20 0 EIADHM CCc1ccc(C(=O)N2CCC[C@@H]2c2ccc(F)cc2C)c([O-])c1 ZINC000622667693 1052381327 /nfs/dbraw/zinc/38/13/27/1052381327.db2.gz PFNDXXSXCJZJOW-GOSISDBHSA-N -1 3 327.399 4.379 20 0 EIADHM O=C(c1cc([O-])cc(C(F)(F)F)c1)N1CC[C@@H](C2CCCCC2)C1 ZINC000622750520 1052423957 /nfs/dbraw/zinc/42/39/57/1052423957.db2.gz JXZNSFKFZQEBJV-CYBMUJFWSA-N -1 3 341.373 4.453 20 0 EIADHM C[C@@H](NCc1cccc2c1OCO2)c1ccc(Cl)c(Cl)c1[O-] ZINC000185099793 1052425177 /nfs/dbraw/zinc/42/51/77/1052425177.db2.gz DZBXULOMLSQMBO-SECBINFHSA-N -1 3 340.206 4.279 20 0 EIADHM Clc1ccc(-c2ccc(C[N-]c3nnc([C@H]4CCCO4)o3)o2)cc1 ZINC000181796604 1052898260 /nfs/dbraw/zinc/89/82/60/1052898260.db2.gz APMSOFQGQPLBRV-OAHLLOKOSA-N -1 3 345.786 4.447 20 0 EIADHM CC[C@@H](c1ccc(Cl)cc1)N(C)Cc1nc(=O)c2sccc2[n-]1 ZINC000194985094 1053049742 /nfs/dbraw/zinc/04/97/42/1053049742.db2.gz UDHCCBFXLZLEPI-AWEZNQCLSA-N -1 3 347.871 4.221 20 0 EIADHM O=C([N-][C@@H]1CCCc2ccc(Cl)cc21)C(F)(F)c1nccs1 ZINC000863809029 1053079684 /nfs/dbraw/zinc/07/96/84/1053079684.db2.gz LRPNLMFNEFEIBQ-GFCCVEGCSA-N -1 3 342.798 4.082 20 0 EIADHM Cc1ccc([C@@H](C)NCc2cc(=O)oc3cc([O-])c(Cl)cc23)cc1 ZINC000794561712 1053080570 /nfs/dbraw/zinc/08/05/70/1053080570.db2.gz JDBKWPOAIFJQRX-GFCCVEGCSA-N -1 3 343.810 4.311 20 0 EIADHM Cc1ccc(Cl)cc1N(C)Cc1cc(=O)[n-]c(-c2ccccc2)n1 ZINC001194715801 1053084418 /nfs/dbraw/zinc/08/44/18/1053084418.db2.gz YEWKPAXYAFZJGX-UHFFFAOYSA-N -1 3 339.826 4.447 20 0 EIADHM CN(C)c1ccc(NC(=O)c2cc([O-])ccc2Cl)cc1Cl ZINC000764406676 1053087383 /nfs/dbraw/zinc/08/73/83/1053087383.db2.gz QSPOIDCJYABVPC-UHFFFAOYSA-N -1 3 325.195 4.017 20 0 EIADHM [O-]C(=NO[C@H]1CCCCO1)Nc1cccc(Sc2ccccc2)c1 ZINC000775609199 1053092136 /nfs/dbraw/zinc/09/21/36/1053092136.db2.gz RRVNESABZCROIG-KRWDZBQOSA-N -1 3 344.436 4.418 20 0 EIADHM O=C([N-]O[C@H]1CCCCO1)Nc1cccc(Sc2ccccc2)c1 ZINC000775609199 1053092154 /nfs/dbraw/zinc/09/21/54/1053092154.db2.gz RRVNESABZCROIG-KRWDZBQOSA-N -1 3 344.436 4.418 20 0 EIADHM O=C([O-])c1occc1CN1CCC(Cc2ccccc2Cl)CC1 ZINC000864361731 1053251404 /nfs/dbraw/zinc/25/14/04/1053251404.db2.gz PKNKAHXWHKNVJS-UHFFFAOYSA-N -1 3 333.815 4.086 20 0 EIADHM O=C([O-])CCCCCCCNCc1ccsc1Br ZINC000864504259 1053297439 /nfs/dbraw/zinc/29/74/39/1053297439.db2.gz CZCPQFVWPAMNOJ-UHFFFAOYSA-N -1 3 334.279 4.025 20 0 EIADHM COc1ccccc1OC(=O)Nc1ccc(C(F)(F)F)cc1[O-] ZINC001195265368 1053351879 /nfs/dbraw/zinc/35/18/79/1053351879.db2.gz UMCHVCJLHVHMAM-UHFFFAOYSA-N -1 3 327.258 4.031 20 0 EIADHM Cc1ccc(Oc2ccccc2)c(NC([O-])=NO[C@@H]2CCCCO2)c1 ZINC000775666541 1053442963 /nfs/dbraw/zinc/44/29/63/1053442963.db2.gz FBNRIQMMCZKGMI-GOSISDBHSA-N -1 3 342.395 4.367 20 0 EIADHM Cc1ccc(Oc2ccccc2)c(NC(=O)[N-]O[C@@H]2CCCCO2)c1 ZINC000775666541 1053442978 /nfs/dbraw/zinc/44/29/78/1053442978.db2.gz FBNRIQMMCZKGMI-GOSISDBHSA-N -1 3 342.395 4.367 20 0 EIADHM CCCCC[C@@H](CC)C(=O)Nc1ccc(-c2nc(C)cc(=O)[n-]2)cc1 ZINC000775672948 1053500296 /nfs/dbraw/zinc/50/02/96/1053500296.db2.gz VJDIDBJWAHRXRO-OAHLLOKOSA-N -1 3 341.455 4.290 20 0 EIADHM [O-]c1cc(NC(=S)Nc2ccc(C(F)(F)F)cc2)ccc1F ZINC001196188165 1053598147 /nfs/dbraw/zinc/59/81/47/1053598147.db2.gz SHLDKMKESCCURS-UHFFFAOYSA-N -1 3 330.306 4.359 20 0 EIADHM CC(C)(C)c1csc(CO[N-]C(=O)CCCc2ccccc2)n1 ZINC000120923630 1053647655 /nfs/dbraw/zinc/64/76/55/1053647655.db2.gz LIIOWPRLGQYMNV-UHFFFAOYSA-N -1 3 332.469 4.011 20 0 EIADHM [O-]c1ccc(NC(=S)Nc2ccc(Br)cc2)cc1F ZINC001196621880 1053715930 /nfs/dbraw/zinc/71/59/30/1053715930.db2.gz OARLTUJAUBKEMA-UHFFFAOYSA-N -1 3 341.205 4.103 20 0 EIADHM Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)Nc1ncccc1[O-] ZINC000022264926 1053754229 /nfs/dbraw/zinc/75/42/29/1053754229.db2.gz HZFMYSBQMRPTJE-UHFFFAOYSA-N -1 3 345.811 4.125 20 0 EIADHM COc1cc(C)c(S(=O)(=O)[N-]c2ccc3sccc3c2)c(C)c1 ZINC001196887868 1053789101 /nfs/dbraw/zinc/78/91/01/1053789101.db2.gz LJIZENUPOCMNCV-UHFFFAOYSA-N -1 3 347.461 4.328 20 0 EIADHM COc1ccc(F)cc1[C@@H](C)NC(=O)c1cc([O-])c2ccccc2c1 ZINC000471787658 1053832749 /nfs/dbraw/zinc/83/27/49/1053832749.db2.gz NINWGTLZGLLGCV-GFCCVEGCSA-N -1 3 339.366 4.184 20 0 EIADHM O=C([N-]c1nc(-c2ccc(F)cc2)ns1)c1ccc(Cl)s1 ZINC000112595543 1053840401 /nfs/dbraw/zinc/84/04/01/1053840401.db2.gz JGLQWEJWZAJGFQ-UHFFFAOYSA-N -1 3 339.804 4.311 20 0 EIADHM CC(C)c1ccc([C@@H](C)N2CC[C@@](C)([N-]C(=O)C(F)(F)F)C2)cc1 ZINC001197168147 1053847369 /nfs/dbraw/zinc/84/73/69/1053847369.db2.gz QFAKUHHXLRQCMP-CXAGYDPISA-N -1 3 342.405 4.014 20 0 EIADHM Cc1cc2nc(-c3cc(F)cc(Br)c3[O-])[nH]c2cc1F ZINC001251406892 1053922187 /nfs/dbraw/zinc/92/21/87/1053922187.db2.gz UXSWQQRKLVXZLV-UHFFFAOYSA-N -1 3 339.139 4.285 20 0 EIADHM C[C@H](CN(Cc1cc(C(F)(F)F)ccc1Cl)C1CC1)C(=O)[O-] ZINC000901993444 1053922570 /nfs/dbraw/zinc/92/25/70/1053922570.db2.gz UFACUXDDRUXGMT-SECBINFHSA-N -1 3 335.753 4.044 20 0 EIADHM [O-]c1cc(NC(=S)Nc2ccccc2Br)ccc1F ZINC001197786681 1053996912 /nfs/dbraw/zinc/99/69/12/1053996912.db2.gz IJVLECFNCHOHBB-UHFFFAOYSA-N -1 3 341.205 4.103 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N1CCC2(CCSCC2)CC1 ZINC000870251876 1054077060 /nfs/dbraw/zinc/07/70/60/1054077060.db2.gz ZUSRMLGDUGZUMR-UHFFFAOYSA-N -1 3 341.476 4.295 20 0 EIADHM CCOc1cccc([C@@H](C)NC(=O)c2cc([O-])c3ccccc3c2)c1 ZINC000471913406 1054198487 /nfs/dbraw/zinc/19/84/87/1054198487.db2.gz VOHHFGZMHSKNKY-CQSZACIVSA-N -1 3 335.403 4.435 20 0 EIADHM Cc1ccc(NC(=O)c2[n-]cnc2C(F)(F)F)cc1C(F)(F)F ZINC000857433509 1054237439 /nfs/dbraw/zinc/23/74/39/1054237439.db2.gz FJKQRPQVNOHYMD-UHFFFAOYSA-N -1 3 337.223 4.008 20 0 EIADHM Cc1ccc(NC(=O)c2nc[n-]c2C(F)(F)F)cc1C(F)(F)F ZINC000857433509 1054237460 /nfs/dbraw/zinc/23/74/60/1054237460.db2.gz FJKQRPQVNOHYMD-UHFFFAOYSA-N -1 3 337.223 4.008 20 0 EIADHM CON(Cc1ccccc1)C(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000857483408 1054271662 /nfs/dbraw/zinc/27/16/62/1054271662.db2.gz WKKXPLGJZVKNQX-UHFFFAOYSA-N -1 3 347.414 4.187 20 0 EIADHM CC[C@@H](C)c1ccccc1[N-]S(=O)(=O)c1ccc(OC)cc1C ZINC001198896162 1054289119 /nfs/dbraw/zinc/28/91/19/1054289119.db2.gz HFLMJYRANUMTBC-CYBMUJFWSA-N -1 3 333.453 4.318 20 0 EIADHM COc1ccc(S(=O)(=O)[N-]c2ccc(F)cc2C(C)C)c(C)c1 ZINC001198944118 1054317702 /nfs/dbraw/zinc/31/77/02/1054317702.db2.gz ZUDIHZZIDYKSGM-UHFFFAOYSA-N -1 3 337.416 4.067 20 0 EIADHM CC(C)c1ccc(C(=O)COC(=O)c2cc(Cl)c(Cl)[n-]2)cc1 ZINC000011809998 1054322317 /nfs/dbraw/zinc/32/23/17/1054322317.db2.gz LJQJGDPTERDIOX-UHFFFAOYSA-N -1 3 340.206 4.485 20 0 EIADHM CCCOc1ccc(CN[C@@H](C)c2cccc([O-])c2F)cc1OC ZINC000872022441 1054337020 /nfs/dbraw/zinc/33/70/20/1054337020.db2.gz WVCWEGAFLBCHHR-ZDUSSCGKSA-N -1 3 333.403 4.180 20 0 EIADHM COc1cc(C)c([C@H](C)N[C@H](C)c2cccc([O-])c2F)cc1OC ZINC000872022892 1054337875 /nfs/dbraw/zinc/33/78/75/1054337875.db2.gz MTMDLQBREFYGTO-OLZOCXBDSA-N -1 3 333.403 4.269 20 0 EIADHM O=C(OCc1ncc(-c2cccs2)o1)c1cccc(Cl)c1[O-] ZINC000775935990 1054349307 /nfs/dbraw/zinc/34/93/07/1054349307.db2.gz SISBXIRQLSLNHW-UHFFFAOYSA-N -1 3 335.768 4.119 20 0 EIADHM C[C@@H](Nc1ccc(OC[C@@H]2CCCO2)cc1)c1cccc([O-])c1F ZINC000872055815 1054366639 /nfs/dbraw/zinc/36/66/39/1054366639.db2.gz LHBTWPCLQUBBLG-CJNGLKHVSA-N -1 3 331.387 4.262 20 0 EIADHM C[C@@H](N[C@@H](C)c1nc(C(F)(F)F)cs1)c1cccc([O-])c1F ZINC000872067114 1054375091 /nfs/dbraw/zinc/37/50/91/1054375091.db2.gz OIRLPHZSJBWKGY-SFYZADRCSA-N -1 3 334.338 4.418 20 0 EIADHM C[C@@H](N[C@H](CCO)c1ccc(Cl)c(F)c1)c1cccc([O-])c1F ZINC000872093672 1054387291 /nfs/dbraw/zinc/38/72/91/1054387291.db2.gz WCUCVJJZWBXGOR-MEBBXXQBSA-N -1 3 341.785 4.098 20 0 EIADHM CC(C)c1ccc(C(=O)NC[C@H]2SCCc3ccccc32)c([O-])c1 ZINC001137057025 1054387110 /nfs/dbraw/zinc/38/71/10/1054387110.db2.gz NRIFCCSUVWXJCW-LJQANCHMSA-N -1 3 341.476 4.276 20 0 EIADHM CC[C@@H](N[C@@H](C)c1cccc([O-])c1F)c1cccc(OC)c1OC ZINC000872092457 1054387171 /nfs/dbraw/zinc/38/71/71/1054387171.db2.gz NPFMRCCQLGYZRF-SWLSCSKDSA-N -1 3 333.403 4.350 20 0 EIADHM CCC(F)(F)c1ccccc1[N-]S(=O)(=O)CCc1cccs1 ZINC000872409535 1054442895 /nfs/dbraw/zinc/44/28/95/1054442895.db2.gz AYOYQQLJKQFIBZ-UHFFFAOYSA-N -1 3 345.436 4.234 20 0 EIADHM [O-]C(=NO[C@@H]1CCCCO1)Nc1ccc(-c2cccc(F)c2)c(F)c1 ZINC000124420566 1054500051 /nfs/dbraw/zinc/50/00/51/1054500051.db2.gz NAVUQOQYZQJUMR-QGZVFWFLSA-N -1 3 348.349 4.212 20 0 EIADHM O=C([N-]O[C@@H]1CCCCO1)Nc1ccc(-c2cccc(F)c2)c(F)c1 ZINC000124420566 1054500056 /nfs/dbraw/zinc/50/00/56/1054500056.db2.gz NAVUQOQYZQJUMR-QGZVFWFLSA-N -1 3 348.349 4.212 20 0 EIADHM CCc1ccccc1NC(=S)Nc1nc2c(cccc2[O-])s1 ZINC001201137085 1054681488 /nfs/dbraw/zinc/68/14/88/1054681488.db2.gz BKAUESGTOXAOKV-UHFFFAOYSA-N -1 3 329.450 4.373 20 0 EIADHM O=C([O-])/C=C\c1ccc(CN2CCC(c3cccc(Cl)c3)CC2)o1 ZINC000902341791 1054806935 /nfs/dbraw/zinc/80/69/35/1054806935.db2.gz FRCSRHALFRNIMW-SREVYHEPSA-N -1 3 345.826 4.410 20 0 EIADHM CCCCCc1nnc([N-]C(=O)c2csc(CC(C)C)n2)s1 ZINC000063570507 1054817259 /nfs/dbraw/zinc/81/72/59/1054817259.db2.gz LZFAIBBVHNDUPI-UHFFFAOYSA-N -1 3 338.502 4.178 20 0 EIADHM Cc1ccc(C(=O)[C@H](C)OC(=O)c2cc(Cl)c(Cl)[n-]2)cc1C ZINC000021730139 1054934170 /nfs/dbraw/zinc/93/41/70/1054934170.db2.gz GDUNKNBOCSNBEF-JTQLQIEISA-N -1 3 340.206 4.367 20 0 EIADHM CC[C@H](C)[C@H](NC(=O)c1cc([O-])c2ccccc2c1)C(F)(F)F ZINC000473229203 1055012778 /nfs/dbraw/zinc/01/27/78/1055012778.db2.gz IERJHJZCMZWPLI-BONVTDFDSA-N -1 3 325.330 4.252 20 0 EIADHM O=C(Nc1cccc(C(F)(F)F)c1)Nc1ncc([O-])cc1Cl ZINC001202292584 1055128528 /nfs/dbraw/zinc/12/85/28/1055128528.db2.gz VUGSFINCJDHMQV-UHFFFAOYSA-N -1 3 331.681 4.103 20 0 EIADHM Cc1nc(-c2ccccn2)sc1C(=O)[N-]c1c(F)cc(F)cc1F ZINC000072506771 1055133801 /nfs/dbraw/zinc/13/38/01/1055133801.db2.gz RBLUVYXRXVIKTP-UHFFFAOYSA-N -1 3 349.337 4.183 20 0 EIADHM Cc1ccnc(N[C@@H](C)c2cc(Br)cc(F)c2[O-])c1 ZINC000186242860 1055266334 /nfs/dbraw/zinc/26/63/34/1055266334.db2.gz BXPIDKIZVAIVFV-VIFPVBQESA-N -1 3 325.181 4.170 20 0 EIADHM C[C@H](c1cccc(Br)c1)N1CCC(CCC(=O)[O-])CC1 ZINC000086755726 1055267304 /nfs/dbraw/zinc/26/73/04/1055267304.db2.gz BJYBQKRUKXQQBI-GFCCVEGCSA-N -1 3 340.261 4.087 20 0 EIADHM Cc1ccc(-c2nc3cccc(C)c3c(=O)[n-]2)cc1Br ZINC000507034149 1056033911 /nfs/dbraw/zinc/03/39/11/1056033911.db2.gz GFRAXNNWZNMQLO-UHFFFAOYSA-N -1 3 329.197 4.382 20 0 EIADHM CCc1nc([C@H](C)NC(=O)c2cc([O-])c3ccccc3c2)cs1 ZINC000354208142 1056380314 /nfs/dbraw/zinc/38/03/14/1056380314.db2.gz OHVOHZVLNFRKME-NSHDSACASA-N -1 3 326.421 4.055 20 0 EIADHM CC(C)c1ccccc1[N-]S(=O)(=O)c1ccc2c(c1)CCCC2 ZINC000007056203 1056761184 /nfs/dbraw/zinc/76/11/84/1056761184.db2.gz HRZMRXNTXNJOFM-UHFFFAOYSA-N -1 3 329.465 4.490 20 0 EIADHM CCC(CC)c1cc(C[N-]C(=O)C(F)(F)c2ccc(F)cc2)on1 ZINC000741968174 1058489127 /nfs/dbraw/zinc/48/91/27/1058489127.db2.gz FWQVKMKZROBSOK-UHFFFAOYSA-N -1 3 340.345 4.126 20 0 EIADHM Cc1cc(=O)[n-]c(-c2cccc(OC(=O)c3coc4ccccc34)c2)n1 ZINC000744218987 1059335272 /nfs/dbraw/zinc/33/52/72/1059335272.db2.gz WRPAVXHGSLMRPG-UHFFFAOYSA-N -1 3 346.342 4.123 20 0 EIADHM Cc1cc(=O)[n-]c(-c2cccc(OC(=O)[C@H](C)CC3CCCC3)c2)n1 ZINC000744219991 1059336106 /nfs/dbraw/zinc/33/61/06/1059336106.db2.gz ZNEVTJGQJRGZRY-CYBMUJFWSA-N -1 3 340.423 4.279 20 0 EIADHM Cc1sc2[n-]c([C@H](C)OC(=O)[C@@H]3CCC[C@H](C)C3)nc(=O)c2c1C ZINC000745157870 1059758964 /nfs/dbraw/zinc/75/89/64/1059758964.db2.gz LAGDXQHAZKKHFH-XHVZSJERSA-N -1 3 348.468 4.444 20 0 EIADHM Cc1sc2[n-]c([C@@H](C)OC(=O)C3C(C)(C)C3(C)C)nc(=O)c2c1C ZINC000746082588 1060005271 /nfs/dbraw/zinc/00/52/71/1060005271.db2.gz QCTXCHCGHDWVJR-SECBINFHSA-N -1 3 348.468 4.300 20 0 EIADHM O=C([O-])C[C@H](NCc1ccc(F)cc1C(F)(F)F)c1cccs1 ZINC000391533242 1060305271 /nfs/dbraw/zinc/30/52/71/1060305271.db2.gz SYICLYZRZQIIDE-LBPRGKRZSA-N -1 3 347.333 4.212 20 0 EIADHM COc1c(Cl)ccc(Nc2ncc(Br)cc2[O-])c1F ZINC001212581955 1060486863 /nfs/dbraw/zinc/48/68/63/1060486863.db2.gz DPDQITLMKKFEGU-UHFFFAOYSA-N -1 3 347.571 4.094 20 0 EIADHM COC(=O)c1c(Cl)cc(Cl)nc1Nc1ccc(Cl)c([O-])c1 ZINC001212589615 1060786200 /nfs/dbraw/zinc/78/62/00/1060786200.db2.gz VNIMUIGXUSPNTN-UHFFFAOYSA-N -1 3 347.585 4.278 20 0 EIADHM COc1ccccc1Cn1ncc(C)c1Nc1ccc(Cl)c([O-])c1 ZINC001212590273 1060818636 /nfs/dbraw/zinc/81/86/36/1060818636.db2.gz DORQOQXPYJYTJG-UHFFFAOYSA-N -1 3 343.814 4.351 20 0 EIADHM COC(=O)c1cnc2ccc(Nc3ccc(Cl)c([O-])c3)cc2c1 ZINC001212594210 1060927769 /nfs/dbraw/zinc/92/77/69/1060927769.db2.gz UTHRNLSWVIXXQM-UHFFFAOYSA-N -1 3 328.755 4.124 20 0 EIADHM COC(=O)c1c(Nc2ccc(Cl)c([O-])c2)ccc2c1OC[C@H]1C[C@@H]21 ZINC001212594323 1060932117 /nfs/dbraw/zinc/93/21/17/1060932117.db2.gz WLXUSQUKTLXWNU-BXKDBHETSA-N -1 3 345.782 4.072 20 0 EIADHM [O-]c1cccnc1CNc1nc(Cl)c(Cl)cc1C(F)(F)F ZINC001169732058 1060932822 /nfs/dbraw/zinc/93/28/22/1060932822.db2.gz GPDUOZHTURKOHZ-UHFFFAOYSA-N -1 3 338.116 4.120 20 0 EIADHM Nc1ccc(F)c(Br)c1Nc1ccc(Cl)c([O-])c1 ZINC001212595412 1060974998 /nfs/dbraw/zinc/97/49/98/1060974998.db2.gz SDVUMAIDVVKGTJ-UHFFFAOYSA-N -1 3 331.572 4.273 20 0 EIADHM O=C([O-])C[C@@H]1CCCCN1CCSc1cc(Cl)ccc1Cl ZINC000038027917 202088851 /nfs/dbraw/zinc/08/88/51/202088851.db2.gz XQPLNGNIROFACR-LBPRGKRZSA-N -1 3 348.295 4.415 20 0 EIADHM CC(C)(C)c1csc([N-]C(=O)c2snc(Cl)c2Cl)n1 ZINC000845266552 1048633126 /nfs/dbraw/zinc/63/31/26/1048633126.db2.gz LTHOOOLRHMMHFU-UHFFFAOYSA-N -1 3 336.269 4.456 20 0 EIADHM C[C@@H](c1ccccc1Cl)N(C)C(=O)c1c[n-]c2ccccc2c1=O ZINC000065054544 1032247496 /nfs/dbraw/zinc/24/74/96/1032247496.db2.gz MNXBLPFSNUFBSW-LBPRGKRZSA-N -1 3 340.810 4.015 20 0 EIADHM O=C(Nc1ccc(Cl)cc1[O-])c1ccc(F)c(Br)c1 ZINC000532837536 1032342414 /nfs/dbraw/zinc/34/24/14/1032342414.db2.gz OLYWCFSRPOGQPL-UHFFFAOYSA-N -1 3 344.567 4.200 20 0 EIADHM O=C(Cc1c[nH]c2ccc(Cl)cc12)Nc1ccc(Cl)cc1[O-] ZINC000532838746 1032343826 /nfs/dbraw/zinc/34/38/26/1032343826.db2.gz AMHIILZQOYIFJO-UHFFFAOYSA-N -1 3 335.190 4.362 20 0 EIADHM COc1ccc2cc(C(=O)Nc3ccc(Cl)cc3[O-])c(C)nc2c1 ZINC000532840776 1032345717 /nfs/dbraw/zinc/34/57/17/1032345717.db2.gz XQEZWXDPGIKTPU-UHFFFAOYSA-N -1 3 342.782 4.163 20 0 EIADHM Cc1cc(C(C#N)=C([O-])C=Cc2ccc(C(C)(C)C)cc2)nc(C)n1 ZINC000049405705 1018724698 /nfs/dbraw/zinc/72/46/98/1018724698.db2.gz POXDJUQMHPTNJT-MZEUMTGBSA-N -1 3 333.435 4.281 20 0 EIADHM CCCCc1nnc([N-]C(=O)c2cc(C)oc2C(F)(F)F)s1 ZINC000274498702 1018726750 /nfs/dbraw/zinc/72/67/50/1018726750.db2.gz KCTAHOVTMGPCOM-UHFFFAOYSA-N -1 3 333.335 4.053 20 0 EIADHM Cc1c([O-])ccc2c(CSc3ccc(N)cc3Cl)cc(=O)oc12 ZINC000753858814 1018802793 /nfs/dbraw/zinc/80/27/93/1018802793.db2.gz PMUZDIKIEJKAQB-UHFFFAOYSA-N -1 3 347.823 4.335 20 0 EIADHM CC(C)Sc1ccccc1[N-]S(=O)(=O)CCc1ccccc1 ZINC000471135773 1019077334 /nfs/dbraw/zinc/07/73/34/1019077334.db2.gz DWKHWKBIXNIIGZ-UHFFFAOYSA-N -1 3 335.494 4.172 20 0 EIADHM CCSc1cccc(CN[C@H](CC(=O)[O-])c2ccc(OC)cc2)c1 ZINC000683172040 1019089560 /nfs/dbraw/zinc/08/95/60/1019089560.db2.gz UPQKQIVDLOVOIV-GOSISDBHSA-N -1 3 345.464 4.113 20 0 EIADHM C[C@@H](CCCCC(=O)[O-])NCc1c(Cl)cccc1OC(F)F ZINC000683176089 1019102158 /nfs/dbraw/zinc/10/21/58/1019102158.db2.gz GDNZJJPOOHCDRL-JTQLQIEISA-N -1 3 335.778 4.065 20 0 EIADHM COc1ccc(-c2noc(-c3cc4ccccc4cc3[O-])n2)cc1OC ZINC000109037363 1019363794 /nfs/dbraw/zinc/36/37/94/1019363794.db2.gz UMHHHAANKRRQLP-UHFFFAOYSA-N -1 3 348.358 4.280 20 0 EIADHM CC[C@H]([N-]S(=O)(=O)c1c(F)cccc1F)c1ccc(Cl)cc1 ZINC000021871559 1032830466 /nfs/dbraw/zinc/83/04/66/1032830466.db2.gz GQCSLRGQUDOUCM-AWEZNQCLSA-N -1 3 345.798 4.048 20 0 EIADHM O=S(=O)([N-]c1ccc(Cl)cc1F)c1ccc(F)c(Cl)c1 ZINC000016130033 1020088753 /nfs/dbraw/zinc/08/87/53/1020088753.db2.gz VGPBFSRQTQEDKM-UHFFFAOYSA-N -1 3 338.162 4.072 20 0 EIADHM O=C(Nc1nc(-c2cccs2)cs1)c1cc([O-])ccc1Cl ZINC000340076589 1020290684 /nfs/dbraw/zinc/29/06/84/1020290684.db2.gz KHMVSZDRWNUDSU-UHFFFAOYSA-N -1 3 336.825 4.483 20 0 EIADHM CCCCc1nnc([N-]C(=O)c2oc(-c3ccccc3)nc2C)s1 ZINC000155262975 1020407997 /nfs/dbraw/zinc/40/79/97/1020407997.db2.gz KSDZVNGXTWFYGD-UHFFFAOYSA-N -1 3 342.424 4.096 20 0 EIADHM CN(Cc1ccc(C(F)(F)F)cc1)C(=O)c1cc([O-])ccc1Cl ZINC000683372356 1020440362 /nfs/dbraw/zinc/44/03/62/1020440362.db2.gz BLVRQVORVCYKMS-UHFFFAOYSA-N -1 3 343.732 4.337 20 0 EIADHM CSc1ccc([O-])c(C(=O)N(C)[C@@H](C)Cc2ccccc2C)c1 ZINC000614077705 1032906179 /nfs/dbraw/zinc/90/61/79/1032906179.db2.gz KRBVKPPJAYGNKW-AWEZNQCLSA-N -1 3 329.465 4.126 20 0 EIADHM O=C(c1cc([O-])ccc1Cl)N(CCc1ccc(F)cc1)C1CC1 ZINC000340438145 1021026187 /nfs/dbraw/zinc/02/61/87/1021026187.db2.gz FFAIDEQGFBILGJ-UHFFFAOYSA-N -1 3 333.790 4.032 20 0 EIADHM O=C(Nc1nc2ccsc2s1)c1cnc(-c2ccccc2)[n-]1 ZINC000340489738 1021127058 /nfs/dbraw/zinc/12/70/58/1021127058.db2.gz QDLBJCFKUZTUCP-UHFFFAOYSA-N -1 3 326.406 4.000 20 0 EIADHM CCOc1ccc(-c2nc3ccc(OC)cc3c(=O)[n-]2)cc1Cl ZINC000570182689 1021198721 /nfs/dbraw/zinc/19/87/21/1021198721.db2.gz OSGCZWNEXDDXCU-UHFFFAOYSA-N -1 3 330.771 4.063 20 0 EIADHM CC(=O)c1ccc(C(=O)N2C[C@@H](c3ccccc3)C3(CCC3)C2)cc1[O-] ZINC000412679802 1021250257 /nfs/dbraw/zinc/25/02/57/1021250257.db2.gz RXTAMLYGXZAUNX-IBGZPJMESA-N -1 3 349.430 4.005 20 0 EIADHM O=C(COc1cccc2ccccc21)Nc1c([O-])cccc1Cl ZINC000580106362 1021655814 /nfs/dbraw/zinc/65/58/14/1021655814.db2.gz MQCOLLJJJSUENK-UHFFFAOYSA-N -1 3 327.767 4.216 20 0 EIADHM Cc1oc(-c2cccs2)nc1CN1CCC[C@H](C(C)(C)C(=O)[O-])C1 ZINC000325460259 1021760931 /nfs/dbraw/zinc/76/09/31/1021760931.db2.gz RBFBTJLZTSEACX-ZDUSSCGKSA-N -1 3 348.468 4.034 20 0 EIADHM O=C(NCCc1cc(Cl)cc(Cl)c1)c1cc([O-])ccc1Cl ZINC000431793355 1021859835 /nfs/dbraw/zinc/85/98/35/1021859835.db2.gz GVHCOGBVVNGRDU-UHFFFAOYSA-N -1 3 344.625 4.325 20 0 EIADHM O=C(NCC1(c2ccc(Cl)cc2)CC1)c1cc([O-])ccc1Cl ZINC000580369353 1021918491 /nfs/dbraw/zinc/91/84/91/1021918491.db2.gz IBANPHKNJLGGRV-UHFFFAOYSA-N -1 3 336.218 4.161 20 0 EIADHM Cc1noc(-c2ccccc2)c1[N-]C(=O)c1cc(F)c(C)cc1F ZINC000122723919 1022000753 /nfs/dbraw/zinc/00/07/53/1022000753.db2.gz PEODUWYGRABTJL-UHFFFAOYSA-N -1 3 328.318 4.489 20 0 EIADHM O=c1nc(COC2CCCC2)[n-]c2sc(-c3ccccc3)cc21 ZINC000174446760 1022087027 /nfs/dbraw/zinc/08/70/27/1022087027.db2.gz NEYJJUJPLUYTAG-UHFFFAOYSA-N -1 3 326.421 4.111 20 0 EIADHM Cc1cc(NC(=O)c2c[n-]c3ccccc3c2=O)ccc1C(F)(F)F ZINC000174674926 1022139986 /nfs/dbraw/zinc/13/99/86/1022139986.db2.gz WFTAKOWUGKKQJL-UHFFFAOYSA-N -1 3 346.308 4.108 20 0 EIADHM CC(=O)c1cc(F)c(Br)cc1Nc1ccc(F)c([O-])c1 ZINC001211220651 1022241682 /nfs/dbraw/zinc/24/16/82/1022241682.db2.gz OTARKRVFDZPMGM-UHFFFAOYSA-N -1 3 342.139 4.379 20 0 EIADHM O=C(N[C@H](c1ccccc1)C(F)F)c1cc([O-])c2ccccc2c1 ZINC000481901178 1022266626 /nfs/dbraw/zinc/26/66/26/1022266626.db2.gz PYQNTYVMIIOIGQ-QGZVFWFLSA-N -1 3 327.330 4.282 20 0 EIADHM O=C(N[C@@H](c1ccccc1)C(F)F)c1cc([O-])c2ccccc2c1 ZINC000481901177 1022276389 /nfs/dbraw/zinc/27/63/89/1022276389.db2.gz PYQNTYVMIIOIGQ-KRWDZBQOSA-N -1 3 327.330 4.282 20 0 EIADHM CCCc1cc(=O)[n-]c(C(=Cc2nc3c(s2)CCCC3)CC)n1 ZINC000684032996 1022392468 /nfs/dbraw/zinc/39/24/68/1022392468.db2.gz JFLLCVABDSCLIU-BENRWUELSA-N -1 3 329.469 4.421 20 0 EIADHM C[C@H]1CCN([C@H](C(=O)[O-])c2cccc(Cl)c2Cl)CC1(C)C ZINC000568771916 1022539561 /nfs/dbraw/zinc/53/95/61/1022539561.db2.gz HLBSSYQLFMMTAD-HZMBPMFUSA-N -1 3 330.255 4.487 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)N1CCC[C@H]1c1ccccc1 ZINC000468517940 1022611252 /nfs/dbraw/zinc/61/12/52/1022611252.db2.gz NLJNQHITRUBOKH-SFHVURJKSA-N -1 3 327.399 4.218 20 0 EIADHM O=C([N-]c1cnccc1Oc1ccccc1)c1ocnc1C(F)F ZINC001125487524 1022885959 /nfs/dbraw/zinc/88/59/59/1022885959.db2.gz VHDTWMBMRIVPQK-UHFFFAOYSA-N -1 3 331.278 4.052 20 0 EIADHM [O-]c1cccc(CNc2cncc3ccccc32)c1Br ZINC000396447008 1023024488 /nfs/dbraw/zinc/02/44/88/1023024488.db2.gz QKAWDTOGJTXEEE-UHFFFAOYSA-N -1 3 329.197 4.315 20 0 EIADHM [O-]C(=Cc1nc(-c2ccc(F)cc2F)no1)c1ccccc1Cl ZINC001211645371 1023129434 /nfs/dbraw/zinc/12/94/34/1023129434.db2.gz SWQAVRDIPVRBOI-UHFFFAOYSA-N -1 3 334.709 4.094 20 0 EIADHM Cc1ccc(-c2noc(C=C([O-])c3ccccc3Cl)n2)c(F)c1F ZINC001211647614 1023233720 /nfs/dbraw/zinc/23/37/20/1023233720.db2.gz YXONTFVFKIRZQV-UHFFFAOYSA-N -1 3 348.736 4.402 20 0 EIADHM CSc1ccccc1S(=O)(=O)[N-]c1cc(F)ccc1Cl ZINC000188425068 1023327690 /nfs/dbraw/zinc/32/76/90/1023327690.db2.gz ZUGGOYNQIKJXKJ-UHFFFAOYSA-N -1 3 331.821 4.002 20 0 EIADHM COc1ccc([C@H](NCc2ccc(C3CCC3)cc2)C(=O)[O-])cc1F ZINC000417572244 1023357601 /nfs/dbraw/zinc/35/76/01/1023357601.db2.gz OXUHVZYWIBPKNF-IBGZPJMESA-N -1 3 343.398 4.017 20 0 EIADHM Cc1sccc1CN[C@@H](CC(=O)[O-])c1cccc(C(F)(F)F)c1 ZINC000417577140 1023361673 /nfs/dbraw/zinc/36/16/73/1023361673.db2.gz ISIBMVSBIOOGNG-AWEZNQCLSA-N -1 3 343.370 4.381 20 0 EIADHM C[C@H](CCC[C@H](C)C(=O)[O-])NCc1csc(-c2ccsc2)n1 ZINC000388324375 1023455715 /nfs/dbraw/zinc/45/57/15/1023455715.db2.gz DWLKVSLUGRHQBB-NWDGAFQWSA-N -1 3 338.498 4.241 20 0 EIADHM O=C([O-])[C@@H](c1cc(Cl)cc(Cl)c1)N1CCC[C@@H](CCF)C1 ZINC000656763099 1023503310 /nfs/dbraw/zinc/50/33/10/1023503310.db2.gz LBRUJEXJEDEFEF-IINYFYTJSA-N -1 3 334.218 4.191 20 0 EIADHM Cc1ccc2ncc(CN3CC[C@H](C(=O)[O-])[C@H]4CCCC[C@H]43)cc2c1 ZINC000656765117 1023509203 /nfs/dbraw/zinc/50/92/03/1023509203.db2.gz IXYCBNNYUIMPQN-WSTZPKSXSA-N -1 3 338.451 4.009 20 0 EIADHM CC(C)CN1C(=O)c2ccccc2N[C@H]1c1cc(Cl)ccc1[O-] ZINC000024098868 1023558136 /nfs/dbraw/zinc/55/81/36/1023558136.db2.gz DZOCMLBIUMQZGT-QGZVFWFLSA-N -1 3 330.815 4.268 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2ccc(COC(C)C)cc2)c(C)c1 ZINC000511697087 1023829659 /nfs/dbraw/zinc/82/96/59/1023829659.db2.gz HBDNFDSQHLDUBG-UHFFFAOYSA-N -1 3 333.453 4.029 20 0 EIADHM Cc1cc(=O)[n-]c(C(C)(C)NCc2ccc(C3CCCC3)cc2)n1 ZINC000660749392 1024047971 /nfs/dbraw/zinc/04/79/71/1024047971.db2.gz JHESMAFXEVOFMH-UHFFFAOYSA-N -1 3 325.456 4.173 20 0 EIADHM O=C([O-])[C@H]1CN(CC2CCC(C(F)(F)F)CC2)Cc2ccccc21 ZINC000652470539 1024843181 /nfs/dbraw/zinc/84/31/81/1024843181.db2.gz ZVPXXGYOFXKQQE-PXCJXSSVSA-N -1 3 341.373 4.039 20 0 EIADHM CC(C)C[C@@H](C(=O)[O-])N(C)Cc1ccc(Cl)cc1Br ZINC000652485046 1024853027 /nfs/dbraw/zinc/85/30/27/1024853027.db2.gz NGMYJUBKFQQRCU-ZDUSSCGKSA-N -1 3 348.668 4.034 20 0 EIADHM COc1c(F)cc(Nc2cccc([O-])c2Br)cc1F ZINC001211688556 1024878055 /nfs/dbraw/zinc/87/80/55/1024878055.db2.gz PHLGPTXAPBBBKO-UHFFFAOYSA-N -1 3 330.128 4.185 20 0 EIADHM O=C([O-])C[C@H](NCc1ccc(F)c(C(F)(F)F)c1)c1ccsc1 ZINC000276995543 1024980151 /nfs/dbraw/zinc/98/01/51/1024980151.db2.gz KMFJSAFWYLUDQQ-ZDUSSCGKSA-N -1 3 347.333 4.212 20 0 EIADHM CCSc1cccc(CN[C@H](CC(=O)[O-])c2cccc(OC)c2)c1 ZINC000277125624 1025077015 /nfs/dbraw/zinc/07/70/15/1025077015.db2.gz BGDPGIRWCSTQGE-GOSISDBHSA-N -1 3 345.464 4.113 20 0 EIADHM Cc1nc2ccc(S(=O)(=O)[N-]c3ccsc3Cl)cc2s1 ZINC000427307701 1025210095 /nfs/dbraw/zinc/21/00/95/1025210095.db2.gz JIZNKCBCCOGZBF-UHFFFAOYSA-N -1 3 344.870 4.120 20 0 EIADHM CCOc1ccc(NC(=O)c2cc([O-])ccc2Cl)cc1OCC ZINC000323550402 1025289211 /nfs/dbraw/zinc/28/92/11/1025289211.db2.gz GHBKRIIXOPMRIP-UHFFFAOYSA-N -1 3 335.787 4.095 20 0 EIADHM CCCc1nnc([N-]C(=O)c2c(Cl)cc(F)cc2Cl)s1 ZINC000277295466 1025521957 /nfs/dbraw/zinc/52/19/57/1025521957.db2.gz UXJSMLJZGPTRFC-UHFFFAOYSA-N -1 3 334.203 4.189 20 0 EIADHM [O-]c1cc(F)cc(CN[C@H](CCc2ccccc2)C(F)(F)F)c1 ZINC000472065429 1025585933 /nfs/dbraw/zinc/58/59/33/1025585933.db2.gz MGTOKUVBDBFLGI-MRXNPFEDSA-N -1 3 327.321 4.185 20 0 EIADHM O=c1[n-]c(SC2CCCCC2)nc2c1cnn2Cc1ccccc1 ZINC000657283195 1025588588 /nfs/dbraw/zinc/58/85/88/1025588588.db2.gz BFAJZKYZOAGHPY-UHFFFAOYSA-N -1 3 340.452 4.005 20 0 EIADHM Cc1c(CSC(C)C)cccc1NC(=O)NCc1ncccc1[O-] ZINC000344005615 1025868926 /nfs/dbraw/zinc/86/89/26/1025868926.db2.gz BIBICUKBSCKIIN-UHFFFAOYSA-N -1 3 345.468 4.059 20 0 EIADHM CC(=O)c1cc(F)c([N-]C(=O)c2csc(Cl)c2)c(F)c1F ZINC000344083303 1025977149 /nfs/dbraw/zinc/97/71/49/1025977149.db2.gz YUMIUEMDVJYCGH-UHFFFAOYSA-N -1 3 333.718 4.274 20 0 EIADHM O=C(COc1ccc(C(F)(F)F)cc1)Nc1cc(Cl)ccc1[O-] ZINC000111211225 1026096521 /nfs/dbraw/zinc/09/65/21/1026096521.db2.gz UDCGBWUAUIXQKL-UHFFFAOYSA-N -1 3 345.704 4.082 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1cc(Cl)cc2cccnc21 ZINC000111210950 1026099035 /nfs/dbraw/zinc/09/90/35/1026099035.db2.gz KADNNKLFNVQIBN-UHFFFAOYSA-N -1 3 333.174 4.500 20 0 EIADHM O=C(COc1ccccc1C(F)(F)F)Nc1cc(Cl)ccc1[O-] ZINC000111210463 1026099206 /nfs/dbraw/zinc/09/92/06/1026099206.db2.gz XNXCYOSQAIEACF-UHFFFAOYSA-N -1 3 345.704 4.082 20 0 EIADHM O=S(=O)([N-][C@H]1CCc2c1cccc2Cl)c1ccc(Cl)s1 ZINC000049336197 1026165729 /nfs/dbraw/zinc/16/57/29/1026165729.db2.gz GCGNVKYEZBJFLG-NSHDSACASA-N -1 3 348.276 4.021 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1ccc(Br)c(F)c1 ZINC000049400408 1026195636 /nfs/dbraw/zinc/19/56/36/1026195636.db2.gz RCFBBHRXMCRNJB-UHFFFAOYSA-N -1 3 344.567 4.200 20 0 EIADHM CC1CCC(OC2CCN(Cc3ccc(F)cc3C(=O)[O-])CC2)CC1 ZINC000563277199 1026311158 /nfs/dbraw/zinc/31/11/58/1026311158.db2.gz KHGQTNAEFUXCNK-UHFFFAOYSA-N -1 3 349.446 4.084 20 0 EIADHM Cc1cc(=O)[n-]c([C@H](C)Sc2nnc(CCC3CCCCC3)o2)n1 ZINC000158176830 1026326249 /nfs/dbraw/zinc/32/62/49/1026326249.db2.gz MUAGXQMUQCPPLW-LBPRGKRZSA-N -1 3 348.472 4.240 20 0 EIADHM Cc1ccc(NC(=O)C(C)(C)C)cc1NC(=O)c1cccc(C)c1[O-] ZINC000112020499 1026356484 /nfs/dbraw/zinc/35/64/84/1026356484.db2.gz UTODKCBKELKGLP-UHFFFAOYSA-N -1 3 340.423 4.246 20 0 EIADHM Cc1sc(C(=O)[O-])cc1CN1CC[C@@H](c2c(F)cccc2F)C1 ZINC000582306230 1026428336 /nfs/dbraw/zinc/42/83/36/1026428336.db2.gz HAGAKMNIWBNAGV-LLVKDONJSA-N -1 3 337.391 4.022 20 0 EIADHM C[C@H](CCC[C@H](C)C(=O)[O-])NCc1ncc(-c2ccccc2)s1 ZINC000426685064 1026473566 /nfs/dbraw/zinc/47/35/66/1026473566.db2.gz FSVGFJKYAQCEPG-UONOGXRCSA-N -1 3 332.469 4.179 20 0 EIADHM CO[C@@H](c1ccccc1Cl)[C@H](C)NCc1c(F)ccc([O-])c1F ZINC000512216079 1026488397 /nfs/dbraw/zinc/48/83/97/1026488397.db2.gz ADUDVOGXVIOVFR-DYZYQPBXSA-N -1 3 341.785 4.190 20 0 EIADHM Cc1ccc2[nH]c(CN[C@H](C(=O)[O-])c3cccc(Cl)c3)cc2c1C ZINC000426725961 1026505316 /nfs/dbraw/zinc/50/53/16/1026505316.db2.gz GFWXEKPPTYMLQF-SFHVURJKSA-N -1 3 342.826 4.354 20 0 EIADHM Cc1cc(CN[C@H](C(=O)[O-])c2cccc(Cl)c2)cc2cccnc12 ZINC000426744596 1026527893 /nfs/dbraw/zinc/52/78/93/1026527893.db2.gz XISWQPHZTLQKLR-SFHVURJKSA-N -1 3 340.810 4.112 20 0 EIADHM Cc1cc(CN[C@@H](C(=O)[O-])c2cccc(Cl)c2)cc2cccnc12 ZINC000426744595 1026528366 /nfs/dbraw/zinc/52/83/66/1026528366.db2.gz XISWQPHZTLQKLR-GOSISDBHSA-N -1 3 340.810 4.112 20 0 EIADHM CC(C)COc1cccc(CN[C@H](C(=O)[O-])c2cccc(Cl)c2)c1 ZINC000426748153 1026531679 /nfs/dbraw/zinc/53/16/79/1026531679.db2.gz VFZODKJSMYYNRV-SFHVURJKSA-N -1 3 347.842 4.290 20 0 EIADHM COc1ccc([C@H](CCC(=O)[O-])NCc2ccc(Cl)s2)cc1 ZINC000426754186 1026537744 /nfs/dbraw/zinc/53/77/44/1026537744.db2.gz OICULOGFDCENJA-AWEZNQCLSA-N -1 3 339.844 4.106 20 0 EIADHM COc1cccc([C@H](CC(=O)[O-])NCc2ccc(C(C)(C)C)s2)c1 ZINC000426805554 1026560481 /nfs/dbraw/zinc/56/04/81/1026560481.db2.gz CLSRCMPLNYJACQ-INIZCTEOSA-N -1 3 347.480 4.360 20 0 EIADHM O=C([O-])C[C@H](NCc1ccc(Cl)c(F)c1)c1cccc(Cl)c1 ZINC000426794357 1026567549 /nfs/dbraw/zinc/56/75/49/1026567549.db2.gz UFWGLSPZJBVWEJ-HNNXBMFYSA-N -1 3 342.197 4.438 20 0 EIADHM Cc1cc([C@@H](NCc2ccc(OC(C)C)cc2)C(=O)[O-])ccc1Cl ZINC000426804739 1026570586 /nfs/dbraw/zinc/57/05/86/1026570586.db2.gz WFZYAZAWHZOKRE-GOSISDBHSA-N -1 3 347.842 4.351 20 0 EIADHM O=C(Nc1ccc(Cl)cc1[O-])c1c[nH]cc1-c1ccccc1F ZINC000426987943 1026661353 /nfs/dbraw/zinc/66/13/53/1026661353.db2.gz XAGDZSBDQYBUDF-UHFFFAOYSA-N -1 3 330.746 4.432 20 0 EIADHM CCN(C(=O)c1c[n-]c2ccccc2c1=O)c1ccc2ccccc2c1 ZINC001125604717 1026786716 /nfs/dbraw/zinc/78/67/16/1026786716.db2.gz MTDXNTGVTNEJBE-UHFFFAOYSA-N -1 3 342.398 4.348 20 0 EIADHM COc1c(C)cc(C=C(Cc2ccccc2)c2nccc(=O)[n-]2)cc1C ZINC000432703284 1026803567 /nfs/dbraw/zinc/80/35/67/1026803567.db2.gz LHGVUIGSBYQBTB-RGEXLXHISA-N -1 3 346.430 4.179 20 0 EIADHM O=c1ccnc(C(=CC2=Cc3ccccc3OC2)Cc2ccccc2)[n-]1 ZINC000432708273 1026808995 /nfs/dbraw/zinc/80/89/95/1026808995.db2.gz FXBSNMXEFKQLRU-RGEXLXHISA-N -1 3 342.398 4.284 20 0 EIADHM Cc1cccc(O[C@H](C)C(=O)Nc2ccc([O-])c(C(F)(F)F)c2)c1 ZINC000440993704 1027175789 /nfs/dbraw/zinc/17/57/89/1027175789.db2.gz RRSXQYIXAPLMMA-LLVKDONJSA-N -1 3 339.313 4.125 20 0 EIADHM Cc1ccc(C(=O)Nc2cc(Br)ccc2[O-])c(Cl)c1 ZINC000191876243 1027276669 /nfs/dbraw/zinc/27/66/69/1027276669.db2.gz UQNQPENXFLNQHE-UHFFFAOYSA-N -1 3 340.604 4.369 20 0 EIADHM CCc1cccc(C(=O)N2CC[C@H](C(F)(F)F)C(C)(C)C2)c1[O-] ZINC000520305269 1027419481 /nfs/dbraw/zinc/41/94/81/1027419481.db2.gz RKPWTJROIGJBFA-ZDUSSCGKSA-N -1 3 329.362 4.005 20 0 EIADHM CCCc1nnc([N-]C(=O)c2csc(-c3ccc(C)cc3)n2)s1 ZINC000017367874 1027574741 /nfs/dbraw/zinc/57/47/41/1027574741.db2.gz BESQIHFIJYBGFH-UHFFFAOYSA-N -1 3 344.465 4.175 20 0 EIADHM COc1ccc(N(C(=O)c2cc([O-])ccc2Cl)[C@H](C)C2CC2)cc1 ZINC000550339835 1027577908 /nfs/dbraw/zinc/57/79/08/1027577908.db2.gz XZGDOMVXQWELMX-GFCCVEGCSA-N -1 3 345.826 4.500 20 0 EIADHM CC(C)[C@H]1C[C@H](CC(=O)Nc2ccc([O-])c(C(F)(F)F)c2)CCO1 ZINC000330809624 1027888393 /nfs/dbraw/zinc/88/83/93/1027888393.db2.gz LHAIQIUCLNSKLF-IAQYHMDHSA-N -1 3 345.361 4.191 20 0 EIADHM CC(C)[C@@H]1C[C@@H](CC(=O)Nc2ccc([O-])c(C(F)(F)F)c2)CCO1 ZINC000330809625 1027888870 /nfs/dbraw/zinc/88/88/70/1027888870.db2.gz LHAIQIUCLNSKLF-NHYWBVRUSA-N -1 3 345.361 4.191 20 0 EIADHM COc1ccccc1[C@H](NCc1cccc(-c2ccccc2)c1)C(=O)[O-] ZINC000426768843 1028082220 /nfs/dbraw/zinc/08/22/20/1028082220.db2.gz CRTURHZAMZXJOI-NRFANRHFSA-N -1 3 347.414 4.278 20 0 EIADHM C[C@@H]1CCN(C(=O)c2ccc3c(c2)CCCCC3=O)c2c([O-])cccc21 ZINC000330125225 1028208745 /nfs/dbraw/zinc/20/87/45/1028208745.db2.gz BKOQVXSNVYFZNT-CQSZACIVSA-N -1 3 349.430 4.455 20 0 EIADHM O=C(Nc1cccc(Oc2ccccn2)c1)c1cc([O-])ccc1Cl ZINC000583352676 1028564405 /nfs/dbraw/zinc/56/44/05/1028564405.db2.gz HYDQGDVGPGZODU-UHFFFAOYSA-N -1 3 340.766 4.485 20 0 EIADHM C[C@H](Oc1ncc(Cl)cc1[O-])c1ccc(Br)cc1 ZINC001227981149 1028687978 /nfs/dbraw/zinc/68/79/78/1028687978.db2.gz SUINPFMTMMJGCK-QMMMGPOBSA-N -1 3 328.593 4.343 20 0 EIADHM O=C([N-]c1nnc(C2CC2)s1)c1occc1-c1ccc(F)cc1 ZINC000159255062 1028936455 /nfs/dbraw/zinc/93/64/55/1028936455.db2.gz LPJJGBSMDSRCPQ-UHFFFAOYSA-N -1 3 329.356 4.067 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@@H]3CCCC[C@@H]3CC)nc2)n1 ZINC000524685220 1029155111 /nfs/dbraw/zinc/15/51/11/1029155111.db2.gz MTPLIHZKUCVPKA-XJKSGUPXSA-N -1 3 326.444 4.187 20 0 EIADHM CCC(=O)c1ccc(-c2nc3cc(C(F)(F)F)ccc3c(=O)[n-]2)cc1 ZINC000446144589 1029173400 /nfs/dbraw/zinc/17/34/00/1029173400.db2.gz DBOKVLBHHQCLGW-UHFFFAOYSA-N -1 3 346.308 4.202 20 0 EIADHM O=C(/C=C/c1ccc(Br)o1)Nc1cc(Cl)ccc1[O-] ZINC000759654361 1029219022 /nfs/dbraw/zinc/21/90/22/1029219022.db2.gz CCNFNPMEWLWWBT-ZZXKWVIFSA-N -1 3 342.576 4.053 20 0 EIADHM COc1ccc([C@H](C)N(C)C(=O)CCCc2ccc([O-])c(F)c2)cc1 ZINC000468367872 1029607303 /nfs/dbraw/zinc/60/73/03/1029607303.db2.gz PKBOAWGMQZSFKG-AWEZNQCLSA-N -1 3 345.414 4.082 20 0 EIADHM O=C(Nc1cc(F)ccc1[O-])c1ccccc1C(=O)c1cccs1 ZINC000151723981 1029680557 /nfs/dbraw/zinc/68/05/57/1029680557.db2.gz UJMYZSDCJLPFCC-UHFFFAOYSA-N -1 3 341.363 4.076 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@@H](C)CCC(C)(C)C)nc2)n1 ZINC000301273793 1029697440 /nfs/dbraw/zinc/69/74/40/1029697440.db2.gz LEMUQQWLQGVAFI-ZDUSSCGKSA-N -1 3 328.460 4.433 20 0 EIADHM O=C(Nc1cc(Br)ccc1[O-])c1sccc1C1CC1 ZINC000085588187 1029834832 /nfs/dbraw/zinc/83/48/32/1029834832.db2.gz RACQRCNWVULIQH-UHFFFAOYSA-N -1 3 338.226 4.346 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N3Cc4ccccc4[C@H]3CC)nc2)n1 ZINC000897353424 1029984896 /nfs/dbraw/zinc/98/48/96/1029984896.db2.gz AQRMWXNDGHWCLY-GOSISDBHSA-N -1 3 346.434 4.278 20 0 EIADHM C[C@@H]1CC(F)(F)CCN1C(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000530011240 1030035763 /nfs/dbraw/zinc/03/57/63/1030035763.db2.gz LUTZFSQUDWGRNH-CQSZACIVSA-N -1 3 345.389 4.243 20 0 EIADHM O=C(NCc1ncccc1[O-])Nc1ccc2oc3ccccc3c2c1 ZINC000525830198 1030050372 /nfs/dbraw/zinc/05/03/72/1030050372.db2.gz CTFPANKWEXYYSG-UHFFFAOYSA-N -1 3 333.347 4.008 20 0 EIADHM C[C@@H]1CC(C(=O)[O-])C[C@@H](C)N1CCc1cc(Cl)cc(Cl)c1 ZINC000530173128 1030194215 /nfs/dbraw/zinc/19/42/15/1030194215.db2.gz CRTFCTLAUXDXBM-GHMZBOCLSA-N -1 3 330.255 4.110 20 0 EIADHM CC(C)Oc1ccc(CN2[C@H](C)CC(C(=O)[O-])C[C@H]2C)cc1Cl ZINC000530174304 1030196630 /nfs/dbraw/zinc/19/66/30/1030196630.db2.gz JZMHWLCSOXAIJC-CHWSQXEVSA-N -1 3 339.863 4.201 20 0 EIADHM CSCc1cccc(NC(=O)CCCc2ccc([O-])c(F)c2)c1 ZINC000526049079 1030231564 /nfs/dbraw/zinc/23/15/64/1030231564.db2.gz JDFVSLCTIAJIEV-UHFFFAOYSA-N -1 3 333.428 4.356 20 0 EIADHM CC[C@H](C)Sc1ccc(NC(=O)c2cccc3n[n-]nc32)c(C)c1 ZINC000526113675 1030284090 /nfs/dbraw/zinc/28/40/90/1030284090.db2.gz OXTBNYVNTHKWIN-LBPRGKRZSA-N -1 3 340.452 4.409 20 0 EIADHM C[C@@H](CCC[C@H](C)C(=O)[O-])NCc1csc(-c2ccccc2)n1 ZINC000321391216 1030334397 /nfs/dbraw/zinc/33/43/97/1030334397.db2.gz WSGVRSMBBFXEKW-KBPBESRZSA-N -1 3 332.469 4.179 20 0 EIADHM C[C@@H](C[N-]S(=O)(=O)c1cccc(Cl)c1Cl)c1ccccc1 ZINC000007309614 1030782746 /nfs/dbraw/zinc/78/27/46/1030782746.db2.gz CFNKZFWJQZQAHJ-NSHDSACASA-N -1 3 344.263 4.075 20 0 EIADHM CC(C)Oc1cc(Cl)c(CNCc2ncccc2[O-])cc1Cl ZINC000527700335 1030818119 /nfs/dbraw/zinc/81/81/19/1030818119.db2.gz JWTGBZGUMYRDCB-UHFFFAOYSA-N -1 3 341.238 4.171 20 0 EIADHM CCCOc1ccc([C@H](C)NCc2cccc(C(=O)[O-])c2)cc1OC ZINC000263476718 1030883631 /nfs/dbraw/zinc/88/36/31/1030883631.db2.gz MTKQCYNIDLHWIG-AWEZNQCLSA-N -1 3 343.423 4.033 20 0 EIADHM CCCOCc1ccccc1CNC(=O)c1ccc(C(C)C)cc1[O-] ZINC001625969809 1030887651 /nfs/dbraw/zinc/88/76/51/1030887651.db2.gz LGCOCQSARVPFRE-UHFFFAOYSA-N -1 3 341.451 4.372 20 0 EIADHM C[C@@H](c1ccccc1Cl)N(C(=O)Cc1ccc([O-])c(F)c1)C1CC1 ZINC000448758224 1031048193 /nfs/dbraw/zinc/04/81/93/1031048193.db2.gz BWHRUKSPVKBCRM-LBPRGKRZSA-N -1 3 347.817 4.479 20 0 EIADHM CCN(C(=O)Cc1ccc([O-])c(F)c1)[C@H](C)c1cc2ccccc2o1 ZINC000448779837 1031089401 /nfs/dbraw/zinc/08/94/01/1031089401.db2.gz HRLBENWZGBHNPO-CYBMUJFWSA-N -1 3 341.382 4.430 20 0 EIADHM CC1CCC(N(C)Cc2ccc(C(=O)[O-])cc2Br)CC1 ZINC000226722324 1031103825 /nfs/dbraw/zinc/10/38/25/1031103825.db2.gz VWSNEUDTTUXJKS-UHFFFAOYSA-N -1 3 340.261 4.158 20 0 EIADHM CC(C)n1ncc2cc(NC(=O)c3cc([O-])ccc3Cl)ccc21 ZINC000685745499 1031220025 /nfs/dbraw/zinc/22/00/25/1031220025.db2.gz JDPYMLCOAOVEFN-UHFFFAOYSA-N -1 3 329.787 4.229 20 0 EIADHM O=S(=O)([N-][C@@H](c1c(Cl)cccc1Cl)C1CC1)c1ccco1 ZINC000570010359 1031564426 /nfs/dbraw/zinc/56/44/26/1031564426.db2.gz WLIPPZKOTJUIKE-CQSZACIVSA-N -1 3 346.235 4.016 20 0 EIADHM CCOc1cc(CNc2cc(F)cc(F)c2OC)cc(Cl)c1[O-] ZINC000459344174 1031862620 /nfs/dbraw/zinc/86/26/20/1031862620.db2.gz AXSOZGVJJFANTG-UHFFFAOYSA-N -1 3 343.757 4.343 20 0 EIADHM O=C([N-]c1cc(Cl)ccc1SCC(F)(F)F)c1cnccn1 ZINC000133377409 1031962252 /nfs/dbraw/zinc/96/22/52/1031962252.db2.gz QCSPDYPUYFEKHB-UHFFFAOYSA-N -1 3 347.749 4.037 20 0 EIADHM CCOc1cc(CNc2cccc(OCCF)c2)cc(Cl)c1[O-] ZINC000459369662 1031976360 /nfs/dbraw/zinc/97/63/60/1031976360.db2.gz ZLODIOLEKHURFG-UHFFFAOYSA-N -1 3 339.794 4.405 20 0 EIADHM CCOc1ccc([N-]S(=O)(=O)c2ccc(C)c(C)c2)cc1Cl ZINC000614840355 1032013791 /nfs/dbraw/zinc/01/37/91/1032013791.db2.gz CJDAVTFAACGGHB-UHFFFAOYSA-N -1 3 339.844 4.156 20 0 EIADHM [O-]c1cccc(CN2CCC3(CC2)OCCc2ccccc23)c1Cl ZINC000453584082 1032033215 /nfs/dbraw/zinc/03/32/15/1032033215.db2.gz ZQDGEPXAMMVNPS-UHFFFAOYSA-N -1 3 343.854 4.110 20 0 EIADHM [O-]c1cc(F)cc(CNc2ccc3c(c2)CN(CC(F)(F)F)C3)c1 ZINC000453617318 1032047647 /nfs/dbraw/zinc/04/76/47/1032047647.db2.gz QSXWNABHUZHLGW-UHFFFAOYSA-N -1 3 340.320 4.021 20 0 EIADHM Cc1cc(S(=O)(=O)[N-]c2c(C)c(F)ccc2Cl)c(C)s1 ZINC000433124883 1033897276 /nfs/dbraw/zinc/89/72/76/1033897276.db2.gz GQZAMHWESAUVRN-UHFFFAOYSA-N -1 3 333.837 4.267 20 0 EIADHM CSc1ccccc1S(=O)(=O)[N-]c1c(C)c(F)ccc1Cl ZINC000433159857 1033949988 /nfs/dbraw/zinc/94/99/88/1033949988.db2.gz NBOTWFMLHBZFEM-UHFFFAOYSA-N -1 3 345.848 4.310 20 0 EIADHM Cc1cc(C)c(NC(=O)c2c[n-]c3c(C)cc(F)cc3c2=O)c(C)c1 ZINC000433312033 1034206489 /nfs/dbraw/zinc/20/64/89/1034206489.db2.gz PBIGVFRGYWGOMM-UHFFFAOYSA-N -1 3 338.382 4.153 20 0 EIADHM Cc1ccc([C@H](C)N(C)Cc2nc3c4ccccc4oc3c(=O)[n-]2)cc1 ZINC000052907506 1034796866 /nfs/dbraw/zinc/79/68/66/1034796866.db2.gz GYFYAHHGGFDUQL-AWEZNQCLSA-N -1 3 347.418 4.171 20 0 EIADHM COc1cc(NCc2c(F)ccc([O-])c2F)ccc1C(F)(F)F ZINC000513329016 1034883268 /nfs/dbraw/zinc/88/32/68/1034883268.db2.gz JAVCAGHDLGOOFB-UHFFFAOYSA-N -1 3 333.256 4.310 20 0 EIADHM COc1ccc([O-])c(C(=O)Nc2ccc(-c3nc(C)cs3)cc2)c1 ZINC000513332092 1034884372 /nfs/dbraw/zinc/88/43/72/1034884372.db2.gz MERIFAUULVRAHV-UHFFFAOYSA-N -1 3 340.404 4.085 20 0 EIADHM Cc1ccc(-c2csc3[n-]c(-c4ccncn4)nc(=O)c23)cc1C ZINC000345347867 1035203318 /nfs/dbraw/zinc/20/33/18/1035203318.db2.gz OFRRHIQUCHNALD-UHFFFAOYSA-N -1 3 334.404 4.138 20 0 EIADHM CC(=O)c1cccc(NC(=O)c2ccc(OC3CCCC3)cc2)c1[O-] ZINC000646215705 1035525088 /nfs/dbraw/zinc/52/50/88/1035525088.db2.gz ZAFZYHYDAUJDJZ-UHFFFAOYSA-N -1 3 339.391 4.169 20 0 EIADHM O=C(OCCCOc1ccc(F)cc1)c1cc(Cl)c(Cl)[n-]1 ZINC000913286607 1035634194 /nfs/dbraw/zinc/63/41/94/1035634194.db2.gz BXQFVDDKYYFRTG-UHFFFAOYSA-N -1 3 332.158 4.087 20 0 EIADHM Cc1ccc(-c2nc(-c3ccc(C(F)(F)F)s3)no2)c([O-])c1 ZINC000904972890 1035689655 /nfs/dbraw/zinc/68/96/55/1035689655.db2.gz ODQPRRPYUDNYRY-UHFFFAOYSA-N -1 3 326.299 4.498 20 0 EIADHM CCSc1cccc(CN2CCC(C(=O)[O-])(C(F)(F)F)CC2)c1 ZINC000905737094 1035879783 /nfs/dbraw/zinc/87/97/83/1035879783.db2.gz GQXWGYIGYJRMKH-UHFFFAOYSA-N -1 3 347.402 4.028 20 0 EIADHM CC(C)=CCC[C@@H](C)CCN1CCOc2c(cccc2C(=O)[O-])C1 ZINC000905739641 1035880585 /nfs/dbraw/zinc/88/05/85/1035880585.db2.gz MIGWHGQDOUTABV-MRXNPFEDSA-N -1 3 331.456 4.352 20 0 EIADHM O=C([O-])c1ccccc1CN1CCC[C@H](Oc2ccccc2Cl)C1 ZINC000570934207 1035888542 /nfs/dbraw/zinc/88/85/42/1035888542.db2.gz ZOUXEMZCGRAEFL-HNNXBMFYSA-N -1 3 345.826 4.082 20 0 EIADHM O=C([N-]c1cc([N+](=O)[O-])ccc1F)c1cc2c(cccc2F)s1 ZINC000060516918 1036197489 /nfs/dbraw/zinc/19/74/89/1036197489.db2.gz XVWZOERRDPHZGS-UHFFFAOYSA-N -1 3 334.303 4.340 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@@H]3CCc4ccc(C)cc43)nc2)n1 ZINC000597947943 1036397261 /nfs/dbraw/zinc/39/72/61/1036397261.db2.gz MKBZZDDKESXLRH-GOSISDBHSA-N -1 3 346.434 4.214 20 0 EIADHM O=c1cc(C=Cc2cc(Cl)ccc2Cl)nc(-c2ccncc2)[n-]1 ZINC000485999989 1036417274 /nfs/dbraw/zinc/41/72/74/1036417274.db2.gz DHMCTIJAUBTQFI-IWQZZHSRSA-N -1 3 344.201 4.309 20 0 EIADHM CCSc1cccc(C=Cc2cc(=O)[n-]c(-c3ccncc3)n2)c1 ZINC000486055299 1036460181 /nfs/dbraw/zinc/46/01/81/1036460181.db2.gz YUSTXMYONMWMAN-VOTSOKGWSA-N -1 3 335.432 4.114 20 0 EIADHM Cc1cscc1NC(=O)c1c[n-]c(=NC(=O)OC(C)(C)C)s1 ZINC000907099589 1036503093 /nfs/dbraw/zinc/50/30/93/1036503093.db2.gz XVKZYWISIWBOCP-UHFFFAOYSA-N -1 3 339.442 4.112 20 0 EIADHM [O-]c1cccc(CN2CC3(CCOCC3)[C@H]2c2ccccc2)c1Cl ZINC000414561684 1036880007 /nfs/dbraw/zinc/88/00/07/1036880007.db2.gz SHYJGHYGGLVTKZ-LJQANCHMSA-N -1 3 343.854 4.399 20 0 EIADHM CCCCC[C@@H]1CCCN1c1ccc(-c2nc(CC)cc(=O)[n-]2)cn1 ZINC000486928031 1036893512 /nfs/dbraw/zinc/89/35/12/1036893512.db2.gz RVJPUOWJHNJVAN-QGZVFWFLSA-N -1 3 340.471 4.356 20 0 EIADHM CC(=O)c1ccc(C(=O)N2CC[C@H](c3ccccc3)C2(C)C)cc1[O-] ZINC000422142049 1036945058 /nfs/dbraw/zinc/94/50/58/1036945058.db2.gz WRHWHDGTXINITF-GOSISDBHSA-N -1 3 337.419 4.003 20 0 EIADHM Cc1cccc2c1CCCN2Cc1nc2c3ccccc3oc2c(=O)[n-]1 ZINC000603943365 1037103301 /nfs/dbraw/zinc/10/33/01/1037103301.db2.gz ORDRETGNROJQMS-UHFFFAOYSA-N -1 3 345.402 4.343 20 0 EIADHM O=C(N=c1cc(-c2cccc(Cl)c2)[n-][nH]1)c1cccc(C(F)F)c1 ZINC000591450096 1037432282 /nfs/dbraw/zinc/43/22/82/1037432282.db2.gz KMCXFCGGHFPZGL-UHFFFAOYSA-N -1 3 347.752 4.342 20 0 EIADHM Cc1oc(C(=O)[O-])cc1CN1CCC(Cc2ccc(F)c(F)c2)CC1 ZINC000573499365 1037573632 /nfs/dbraw/zinc/57/36/32/1037573632.db2.gz SXANUOXSDPFPQG-UHFFFAOYSA-N -1 3 349.377 4.019 20 0 EIADHM Cc1ccc(C(=O)Cc2nc(=O)c3c4ccccc4sc3[n-]2)s1 ZINC000591831138 1037609737 /nfs/dbraw/zinc/60/97/37/1037609737.db2.gz QMFODPNAOFOPPB-UHFFFAOYSA-N -1 3 340.429 4.345 20 0 EIADHM CC(C)n1ncc(C(=O)Nc2cc(F)ccc2[O-])c1-c1ccccc1 ZINC000488734782 1037731660 /nfs/dbraw/zinc/73/16/60/1037731660.db2.gz MQTDGUPAEVBAKE-UHFFFAOYSA-N -1 3 339.370 4.228 20 0 EIADHM Cc1ccc(C(=O)Nc2cccc(C3SCCS3)c2)c([O-])c1 ZINC000058442746 1037784447 /nfs/dbraw/zinc/78/44/47/1037784447.db2.gz SVPLZHJEHQINKB-UHFFFAOYSA-N -1 3 331.462 4.432 20 0 EIADHM [O-]c1ccc(Br)cc1/C=N/Cc1cc2ccccc2[nH]1 ZINC000058464351 1037787994 /nfs/dbraw/zinc/78/79/94/1037787994.db2.gz DTJDLUMVDPUINN-GIJQJNRQSA-N -1 3 329.197 4.255 20 0 EIADHM CSc1cc(O)ccc1[N-]C(=O)c1cc(-c2ccccc2)ns1 ZINC000489116353 1037872430 /nfs/dbraw/zinc/87/24/30/1037872430.db2.gz MXGABSWQXLLWFF-UHFFFAOYSA-N -1 3 342.445 4.490 20 0 EIADHM CC(C)(COCc1ccccc1)C(=O)Nc1cc(Cl)ccc1[O-] ZINC000503692256 1037874053 /nfs/dbraw/zinc/87/40/53/1037874053.db2.gz KGKQAWIRQBWYNX-UHFFFAOYSA-N -1 3 333.815 4.227 20 0 EIADHM CSc1ccsc1C(=O)[N-]c1nnc(Cc2ccccc2)s1 ZINC000592993012 1037898927 /nfs/dbraw/zinc/89/89/27/1037898927.db2.gz ZWTSGYPWULROFS-UHFFFAOYSA-N -1 3 347.490 4.165 20 0 EIADHM O=C(Nc1ncccc1[O-])c1ccc(Oc2ccc(F)c(F)c2)cc1 ZINC000489307714 1037954895 /nfs/dbraw/zinc/95/48/95/1037954895.db2.gz ZQKZXULQXHJNNQ-UHFFFAOYSA-N -1 3 342.301 4.110 20 0 EIADHM Cc1ccc(-c2noc(-c3cc([O-])cc(Br)c3)n2)cc1 ZINC000700841851 1037973567 /nfs/dbraw/zinc/97/35/67/1037973567.db2.gz UJYDZBLWJCAQKZ-UHFFFAOYSA-N -1 3 331.169 4.180 20 0 EIADHM Cc1cc([C@@H](C)N2CC[C@H](c3c(F)cccc3F)C2)oc1C(=O)[O-] ZINC000574524873 1038289371 /nfs/dbraw/zinc/28/93/71/1038289371.db2.gz KDLIARKEFABJAP-NEPJUHHUSA-N -1 3 335.350 4.115 20 0 EIADHM CCN(C(=O)N=c1cc2ccccn2[n-]1)[C@H](C)c1cc2ccccc2o1 ZINC000574543524 1038293297 /nfs/dbraw/zinc/29/32/97/1038293297.db2.gz SEKHSQJTSODHJN-CQSZACIVSA-N -1 3 348.406 4.117 20 0 EIADHM Cc1cc(C)cc(-c2nc3cc(Br)c(F)cc3c(=O)[n-]2)c1 ZINC000504507971 1038391118 /nfs/dbraw/zinc/39/11/18/1038391118.db2.gz QHEFGPGCQANWBY-UHFFFAOYSA-N -1 3 347.187 4.109 20 0 EIADHM CC(=O)c1cccc(NC(=O)CSCc2cccc(Cl)c2)c1[O-] ZINC000552288207 1039341875 /nfs/dbraw/zinc/34/18/75/1039341875.db2.gz IIDPXDVXDOATBP-UHFFFAOYSA-N -1 3 349.839 4.120 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)N1CC2(CCC2)[C@H]1c1ccco1 ZINC000456564680 1039462578 /nfs/dbraw/zinc/46/25/78/1039462578.db2.gz JWPSFBFUXVCEAA-LJQANCHMSA-N -1 3 343.398 4.201 20 0 EIADHM CCc1cccc(C(=O)Nc2ccc(OC)cc2C(F)(F)F)c1[O-] ZINC000552406762 1039478792 /nfs/dbraw/zinc/47/87/92/1039478792.db2.gz MRWRIMIDNPPRGG-UHFFFAOYSA-N -1 3 339.313 4.234 20 0 EIADHM O=C(N[C@H](c1ccccc1)C(F)(F)F)c1cc([O-])ccc1Cl ZINC000555739577 1039571983 /nfs/dbraw/zinc/57/19/83/1039571983.db2.gz ZQAVWEGEIBZBBE-CYBMUJFWSA-N -1 3 329.705 4.079 20 0 EIADHM Cc1cccc(CN(Cc2ccccn2)Cc2nc(C)ccc2[O-])c1 ZINC000093086564 1039629191 /nfs/dbraw/zinc/62/91/91/1039629191.db2.gz FMZBUUCOJXOJSG-UHFFFAOYSA-N -1 3 333.435 4.001 20 0 EIADHM O=C(Nc1ccc(Cl)cc1[O-])c1ccc(Cl)c2cccnc12 ZINC000535420953 1040251859 /nfs/dbraw/zinc/25/18/59/1040251859.db2.gz YNOXIELZJQMMOO-UHFFFAOYSA-N -1 3 333.174 4.500 20 0 EIADHM COc1ccccc1[C@@H](C)NCc1cccc([O-])c1Br ZINC000315150271 1040263928 /nfs/dbraw/zinc/26/39/28/1040263928.db2.gz DCSPSFUTKCDTMH-LLVKDONJSA-N -1 3 336.229 4.014 20 0 EIADHM Cc1ccc(Cl)c([N-]S(=O)(=O)c2c(C)ccc3cccnc32)c1 ZINC000477321505 1040408025 /nfs/dbraw/zinc/40/80/25/1040408025.db2.gz TXMXCDILKRHQLC-UHFFFAOYSA-N -1 3 346.839 4.306 20 0 EIADHM CCc1cc(=O)[n-]c(CSCc2csc(-c3cccs3)n2)n1 ZINC000477357895 1040434356 /nfs/dbraw/zinc/43/43/56/1040434356.db2.gz UPPLGCRYBFMXTF-UHFFFAOYSA-N -1 3 349.506 4.363 20 0 EIADHM COc1cc(C)c([N-]S(=O)(=O)c2cccc(C(C)C)c2)cc1C ZINC000435730897 1040565654 /nfs/dbraw/zinc/56/56/54/1040565654.db2.gz GUJHQQFBQPWXMW-UHFFFAOYSA-N -1 3 333.453 4.236 20 0 EIADHM C[C@@H](C(=O)Nc1ccc(Cl)cc1[O-])c1cn(C)c2ccccc12 ZINC000477690182 1040726655 /nfs/dbraw/zinc/72/66/55/1040726655.db2.gz DXYZVERJEXPONU-LLVKDONJSA-N -1 3 328.799 4.280 20 0 EIADHM Cc1cc(F)ccc1S(=O)(=O)[N-]c1cccc(C(C)(F)F)c1 ZINC000436172701 1040936257 /nfs/dbraw/zinc/93/62/57/1040936257.db2.gz QMFPKQJYACOGJP-UHFFFAOYSA-N -1 3 329.343 4.047 20 0 EIADHM CCOc1ccc([N-]S(=O)(=O)c2ccc3ccccc3c2)c(C)c1 ZINC000515694389 1041000943 /nfs/dbraw/zinc/00/09/43/1041000943.db2.gz NFDMVCWQKVVNNX-UHFFFAOYSA-N -1 3 341.432 4.348 20 0 EIADHM [O-]c1ccc(CN=c2[nH]c3cc(C(F)(F)F)ccc3s2)cc1F ZINC000462862681 1041044074 /nfs/dbraw/zinc/04/40/74/1041044074.db2.gz XJRGIWOWLQYBNA-UHFFFAOYSA-N -1 3 342.317 4.194 20 0 EIADHM CSc1ccc([O-])c(C(=O)N2CCC(OC3CCCCC3)CC2)c1 ZINC000667637610 1041076880 /nfs/dbraw/zinc/07/68/80/1041076880.db2.gz ZGJRPZKDYLTOTN-UHFFFAOYSA-N -1 3 349.496 4.068 20 0 EIADHM CCc1cc(=O)[n-]c(CN[C@@H](c2ccc(Cl)cc2)[C@H](C)CC)n1 ZINC000538214628 1041171867 /nfs/dbraw/zinc/17/18/67/1041171867.db2.gz UGMCSMNLINVPEZ-KZULUSFZSA-N -1 3 333.863 4.275 20 0 EIADHM CC(=O)c1cc(F)c([N-]C(=O)c2cccc(F)c2Cl)c(F)c1F ZINC000461090521 1041211347 /nfs/dbraw/zinc/21/13/47/1041211347.db2.gz AGDABWNFYZRYHF-UHFFFAOYSA-N -1 3 345.679 4.351 20 0 EIADHM CCc1nc(CNC/C(C)=C\c2ccc(Cl)cc2)ccc1C(=O)[O-] ZINC000903996304 1041254691 /nfs/dbraw/zinc/25/46/91/1041254691.db2.gz CJPAVXQZXSLWHH-RAXLEYEMSA-N -1 3 344.842 4.189 20 0 EIADHM O=C(c1ccccc1[O-])N1CCC[C@H]1Cc1c(F)cccc1Cl ZINC000436484632 1041284444 /nfs/dbraw/zinc/28/44/44/1041284444.db2.gz HICHSSUTSFUZIC-LBPRGKRZSA-N -1 3 333.790 4.032 20 0 EIADHM [O-]c1cc2ccccc2cc1-c1nc(-c2nccc3[nH]ccc32)no1 ZINC000436521714 1041305521 /nfs/dbraw/zinc/30/55/21/1041305521.db2.gz GRDXIBPVNSKZCO-UHFFFAOYSA-N -1 3 328.331 4.139 20 0 EIADHM CC(C)Sc1cccc(Cl)c1CNC1CC(CC(=O)[O-])C1 ZINC000904062633 1041312217 /nfs/dbraw/zinc/31/22/17/1041312217.db2.gz PURCPYRMHPSPJL-UHFFFAOYSA-N -1 3 327.877 4.183 20 0 EIADHM COc1ccc(C(=O)N([C@H](C)c2ccccc2Cl)C2CC2)c([O-])c1 ZINC000436552779 1041327641 /nfs/dbraw/zinc/32/76/41/1041327641.db2.gz BEFJWKWMJOQMPJ-GFCCVEGCSA-N -1 3 345.826 4.420 20 0 EIADHM CSc1cccc(N(C)C(=O)c2cc3c(cc2[O-])CCCC3)c1 ZINC000436541710 1041336718 /nfs/dbraw/zinc/33/67/18/1041336718.db2.gz ZHHCGEFFVJWUQR-UHFFFAOYSA-N -1 3 327.449 4.270 20 0 EIADHM COc1cc(-c2nc([C@@H]3CCCC(C)(C)C3)no2)cc(OC)c1[O-] ZINC000436561767 1041343102 /nfs/dbraw/zinc/34/31/02/1041343102.db2.gz CQOFMFZMFJEZFZ-LLVKDONJSA-N -1 3 332.400 4.143 20 0 EIADHM COc1ccc(NC(=O)c2ccc(C)c(C)c2[O-])c(C(F)(F)F)c1 ZINC000436566338 1041345616 /nfs/dbraw/zinc/34/56/16/1041345616.db2.gz UHKGZGJCGBYDNF-UHFFFAOYSA-N -1 3 339.313 4.289 20 0 EIADHM CO[C@@H](C)CN(C(=O)c1cc(Oc2ccccc2)ccc1[O-])C(C)C ZINC000436565268 1041346759 /nfs/dbraw/zinc/34/67/59/1041346759.db2.gz UTMLDYALOLKEQE-HNNXBMFYSA-N -1 3 343.423 4.070 20 0 EIADHM CCN(C(=O)c1ccccc1[O-])[C@H](Cc1ccc(F)cc1)C(C)C ZINC000436570556 1041348935 /nfs/dbraw/zinc/34/89/35/1041348935.db2.gz AFKIGYYFYDWBEM-GOSISDBHSA-N -1 3 329.415 4.261 20 0 EIADHM CC(C)N(CC(F)F)C(=O)c1cc(CCc2ccccc2)ccc1[O-] ZINC000436598589 1041355979 /nfs/dbraw/zinc/35/59/79/1041355979.db2.gz AYMDLWWLKLFRQS-UHFFFAOYSA-N -1 3 347.405 4.293 20 0 EIADHM CC[C@@H](OC)C(=O)Nc1ccc([O-])c(-c2nc3ccccc3s2)c1 ZINC000436599803 1041356729 /nfs/dbraw/zinc/35/67/29/1041356729.db2.gz DKMDMHUBOLCHEV-OAHLLOKOSA-N -1 3 342.420 4.032 20 0 EIADHM COc1ccc(N(C)C(=O)c2cc3c(cc2[O-])CCCC3)cc1Cl ZINC000436592017 1041365827 /nfs/dbraw/zinc/36/58/27/1041365827.db2.gz ZAOZTAVJVMURCE-UHFFFAOYSA-N -1 3 345.826 4.210 20 0 EIADHM CC[C@H](C)n1ncc(NC(=O)c2ccc(C)c(C)c2[O-])c1C1CC1 ZINC000436605447 1041368005 /nfs/dbraw/zinc/36/80/05/1041368005.db2.gz PKOPGMQSKMYUHN-LBPRGKRZSA-N -1 3 327.428 4.306 20 0 EIADHM CN(Cc1ccccc1)C(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436608243 1041370365 /nfs/dbraw/zinc/37/03/65/1041370365.db2.gz GYUPPAZMJFRZDY-UHFFFAOYSA-N -1 3 331.415 4.255 20 0 EIADHM CC1=C(c2ccco2)CN(C(=O)c2ccc(C(C)C)cc2[O-])CC1 ZINC000436683831 1041419636 /nfs/dbraw/zinc/41/96/36/1041419636.db2.gz WFEVYRBSFGUOQV-UHFFFAOYSA-N -1 3 325.408 4.428 20 0 EIADHM Cc1ccccc1OCCCN(C)C(=O)c1ccc(C(C)C)cc1[O-] ZINC000436686304 1041422821 /nfs/dbraw/zinc/42/28/21/1041422821.db2.gz OCFIZSQYJOKPMP-UHFFFAOYSA-N -1 3 341.451 4.365 20 0 EIADHM Cc1ccc(C(=O)Nc2cn(CC(C)C)nc2C(F)F)c([O-])c1C ZINC000436700348 1041430978 /nfs/dbraw/zinc/43/09/78/1041430978.db2.gz VKBHKGNVGOBARJ-UHFFFAOYSA-N -1 3 337.370 4.051 20 0 EIADHM Cc1ccc(C(=O)N2C[C@@H]3CCCCN3c3ccccc32)c([O-])c1C ZINC000436738439 1041448046 /nfs/dbraw/zinc/44/80/46/1041448046.db2.gz NWJMBJDTGFJGOB-INIZCTEOSA-N -1 3 336.435 4.028 20 0 EIADHM Cc1ccoc1CN(C)C(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436739866 1041449196 /nfs/dbraw/zinc/44/91/96/1041449196.db2.gz PBUPMPXLUBZSEG-UHFFFAOYSA-N -1 3 337.375 4.358 20 0 EIADHM C[C@@H](Cc1ccccc1C(F)(F)F)N(C)C(=O)c1ccccc1[O-] ZINC000436787893 1041482419 /nfs/dbraw/zinc/48/24/19/1041482419.db2.gz ZPGSCPFLTGPZAV-LBPRGKRZSA-N -1 3 337.341 4.114 20 0 EIADHM Cc1ccc(C(=O)N2CCCc3cc(Br)ccc32)c([O-])c1 ZINC000436824286 1041501699 /nfs/dbraw/zinc/50/16/99/1041501699.db2.gz GJMOTYFCBXOREB-UHFFFAOYSA-N -1 3 346.224 4.056 20 0 EIADHM CCc1ccc(-c2nc(-c3cccc(C(F)(F)F)n3)no2)c([O-])c1 ZINC000436862484 1041522454 /nfs/dbraw/zinc/52/24/54/1041522454.db2.gz HMOFQTCADVEMKM-UHFFFAOYSA-N -1 3 335.285 4.085 20 0 EIADHM COc1ccccc1[C@H]1CC[C@@H](C)CN1C(=O)c1ccccc1[O-] ZINC000436857684 1041534649 /nfs/dbraw/zinc/53/46/49/1041534649.db2.gz BRDZOWUCKBBGEP-RHSMWYFYSA-N -1 3 325.408 4.014 20 0 EIADHM COC(=O)c1ccc(-c2noc(-c3cc4ccccc4cc3[O-])n2)cc1 ZINC000436894681 1041536310 /nfs/dbraw/zinc/53/63/10/1041536310.db2.gz GBFLRFAUSPQOHQ-UHFFFAOYSA-N -1 3 346.342 4.049 20 0 EIADHM Cc1cncc(-c2noc(-c3cc(Cc4ccccc4)ccc3[O-])n2)c1 ZINC000436890678 1041544391 /nfs/dbraw/zinc/54/43/91/1041544391.db2.gz CNTCSWIUDWENBJ-UHFFFAOYSA-N -1 3 343.386 4.403 20 0 EIADHM Cc1ccncc1CN(C)C(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436905596 1041546625 /nfs/dbraw/zinc/54/66/25/1041546625.db2.gz BBMNWQYGIPVEGZ-UHFFFAOYSA-N -1 3 348.402 4.160 20 0 EIADHM CCOc1ncccc1-c1noc(-c2ccc(C(C)C)cc2[O-])n1 ZINC000436911362 1041548211 /nfs/dbraw/zinc/54/82/11/1041548211.db2.gz AHGDEBUORCEALZ-UHFFFAOYSA-N -1 3 325.368 4.026 20 0 EIADHM CCc1nc(Cc2noc(-c3cc4ccccc4cc3[O-])n2)cs1 ZINC000436920453 1041559092 /nfs/dbraw/zinc/55/90/92/1041559092.db2.gz PGUVXRHPHLTXJT-UHFFFAOYSA-N -1 3 337.404 4.205 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1ccc(Oc2ccccc2)nc1 ZINC000516395250 1041562365 /nfs/dbraw/zinc/56/23/65/1041562365.db2.gz VBFABXDLNGNQKL-UHFFFAOYSA-N -1 3 340.766 4.485 20 0 EIADHM C[C@@H](NC(=O)c1cc(Oc2ccccc2)ccc1[O-])c1cccnc1 ZINC000436926801 1041562409 /nfs/dbraw/zinc/56/24/09/1041562409.db2.gz NNLPIWNZFMCBDS-CQSZACIVSA-N -1 3 334.375 4.071 20 0 EIADHM Cn1cnc2cc(-c3noc(-c4cc5ccccc5cc4[O-])n3)ccc21 ZINC000436935043 1041565371 /nfs/dbraw/zinc/56/53/71/1041565371.db2.gz ZJAUVOQHZOCHAM-UHFFFAOYSA-N -1 3 342.358 4.149 20 0 EIADHM C[C@@H]1CN(C(=O)c2cc(Cc3ccccc3)ccc2[O-])CCC1(F)F ZINC000436936481 1041566463 /nfs/dbraw/zinc/56/64/63/1041566463.db2.gz GAISIBJEBZLMEG-CQSZACIVSA-N -1 3 345.389 4.100 20 0 EIADHM Cc1ccc(C(=O)N2CCc3c2cccc3C(F)(F)F)c([O-])c1C ZINC000436961762 1041572164 /nfs/dbraw/zinc/57/21/64/1041572164.db2.gz UTOHKFUXWSJPKV-UHFFFAOYSA-N -1 3 335.325 4.231 20 0 EIADHM CO[C@H](c1noc(-c2ccc(C(C)C)cc2[O-])n1)c1ccc(F)cc1 ZINC000436954153 1041573007 /nfs/dbraw/zinc/57/30/07/1041573007.db2.gz UQUKHAIZXLHAFL-KRWDZBQOSA-N -1 3 342.370 4.441 20 0 EIADHM Cc1cc(S(=O)(=O)[N-]c2cc(Cl)c(C)cc2Cl)c(C)o1 ZINC000540648258 1041587096 /nfs/dbraw/zinc/58/70/96/1041587096.db2.gz XTGNPLVXMZMIAS-UHFFFAOYSA-N -1 3 334.224 4.312 20 0 EIADHM Cc1cc([C@@H](C)N(C)CCOc2cccc(Cl)c2)oc1C(=O)[O-] ZINC000516657282 1041693305 /nfs/dbraw/zinc/69/33/05/1041693305.db2.gz WKSDOFFGFVAQMO-GFCCVEGCSA-N -1 3 337.803 4.011 20 0 EIADHM O=C(Nc1ncccc1[O-])c1cccnc1SCC1CCCCC1 ZINC000541237927 1041860403 /nfs/dbraw/zinc/86/04/03/1041860403.db2.gz PVTZGOCSTBUEJG-UHFFFAOYSA-N -1 3 343.452 4.107 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)c1cscc1-c1ccccc1 ZINC000517206601 1041906866 /nfs/dbraw/zinc/90/68/66/1041906866.db2.gz XQQYATRMAUKFQL-UHFFFAOYSA-N -1 3 327.380 4.190 20 0 EIADHM CC(=O)c1cccc(NC(=O)[C@H](C)CCCc2ccccc2)c1[O-] ZINC000517228733 1041917791 /nfs/dbraw/zinc/91/77/91/1041917791.db2.gz XWURGWUKIAUKGR-CQSZACIVSA-N -1 3 325.408 4.192 20 0 EIADHM COc1cc(C)c([N-]S(=O)(=O)c2ccc(C)cc2C)c(C)c1C ZINC000517774695 1042176476 /nfs/dbraw/zinc/17/64/76/1042176476.db2.gz INVFMXZNTCRDCH-UHFFFAOYSA-N -1 3 333.453 4.038 20 0 EIADHM C[C@@H]1C[C@H](c2ccccc2)CCN1C(=O)NCc1ccc([O-])c(F)c1 ZINC000542184828 1042323670 /nfs/dbraw/zinc/32/36/70/1042323670.db2.gz FTXRKAJAJSWZGJ-RHSMWYFYSA-N -1 3 342.414 4.009 20 0 EIADHM O=C(N[C@H](c1ccc(F)cc1)C(F)(F)F)c1cc([O-])ccc1Cl ZINC000506660226 1042747925 /nfs/dbraw/zinc/74/79/25/1042747925.db2.gz BAKFYRXZNCJURP-CYBMUJFWSA-N -1 3 347.695 4.218 20 0 EIADHM CC(C)c1ccc(/C=C/CC(=O)Nc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000492944229 1042775628 /nfs/dbraw/zinc/77/56/28/1042775628.db2.gz JYEALABGEGMEMA-HWKANZROSA-N -1 3 347.422 4.032 20 0 EIADHM CC(C)c1ccc(/C=C/CC(=O)Nc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000492944229 1042775633 /nfs/dbraw/zinc/77/56/33/1042775633.db2.gz JYEALABGEGMEMA-HWKANZROSA-N -1 3 347.422 4.032 20 0 EIADHM CN(Cc1cc(C(=O)[O-])ccc1Cl)CC1(c2ccccc2)CC1 ZINC000518990837 1042787225 /nfs/dbraw/zinc/78/72/25/1042787225.db2.gz SQXGWCPKPWEDNJ-UHFFFAOYSA-N -1 3 329.827 4.202 20 0 EIADHM COc1ccc(S(=O)(=O)[N-]c2cc(Cl)c(C)c(Cl)c2)cc1 ZINC000519059809 1042802980 /nfs/dbraw/zinc/80/29/80/1042802980.db2.gz VIPOKMRONHUMIG-UHFFFAOYSA-N -1 3 346.235 4.111 20 0 EIADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)CC[C@H](C)CC)c2)n1 ZINC000506718601 1042806878 /nfs/dbraw/zinc/80/68/78/1042806878.db2.gz JANAQRXTNOILEP-CYBMUJFWSA-N -1 3 327.428 4.176 20 0 EIADHM CC(C)(C)c1nnsc1C(=O)[N-]c1cc(Cl)cc(F)c1F ZINC000441578519 1042896588 /nfs/dbraw/zinc/89/65/88/1042896588.db2.gz BKLZBKHWWKHWGM-UHFFFAOYSA-N -1 3 331.775 4.020 20 0 EIADHM COCCCCN(Cc1ccccc1)Cc1c(F)ccc([O-])c1F ZINC000507788316 1042940390 /nfs/dbraw/zinc/94/03/90/1042940390.db2.gz ZXSJXIVDDMLDKL-UHFFFAOYSA-N -1 3 335.394 4.099 20 0 EIADHM CCc1ccc(C(=O)N2CC[C@H](C(F)(F)F)C(C)(C)C2)c([O-])c1 ZINC000190695881 1042968284 /nfs/dbraw/zinc/96/82/84/1042968284.db2.gz DUGBDJXINNEMTA-AWEZNQCLSA-N -1 3 329.362 4.005 20 0 EIADHM Cc1ccc(NC(=O)c2ccccc2C(=O)c2cccs2)c([O-])c1 ZINC000162481541 1043072324 /nfs/dbraw/zinc/07/23/24/1043072324.db2.gz KBTWAIWYDBJOMX-UHFFFAOYSA-N -1 3 337.400 4.245 20 0 EIADHM CC(C)(C)c1nnc(C(=O)[N-]c2csc(-c3ccccc3)n2)s1 ZINC000672335245 1043122799 /nfs/dbraw/zinc/12/27/99/1043122799.db2.gz PRJDROUEWIMSQN-UHFFFAOYSA-N -1 3 344.465 4.211 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N1CCC(OC2CCCC2)CC1 ZINC000279451355 1043158897 /nfs/dbraw/zinc/15/88/97/1043158897.db2.gz GAIFMAUJTSADFI-UHFFFAOYSA-N -1 3 339.435 4.109 20 0 EIADHM C[C@@H]1CN(Cc2nc3c4ccccc4oc3c(=O)[n-]2)Cc2ccccc21 ZINC000727240244 1043174749 /nfs/dbraw/zinc/17/47/49/1043174749.db2.gz HNQHNSKORSPVTE-CYBMUJFWSA-N -1 3 345.402 4.201 20 0 EIADHM CC[C@@H](NC(=O)NCc1ccc([O-])c(F)c1)C(C)(C)c1ccccc1 ZINC000465968187 1043195139 /nfs/dbraw/zinc/19/51/39/1043195139.db2.gz MSCVRWPLTUFUTB-GOSISDBHSA-N -1 3 344.430 4.087 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)C1c2ccccc2Oc2ccccc21 ZINC000132867373 1043206585 /nfs/dbraw/zinc/20/65/85/1043206585.db2.gz LFNFDQVWFPMDDL-UHFFFAOYSA-N -1 3 349.361 4.085 20 0 EIADHM CCc1cc(=O)[n-]c(CSC[C@H](OC(C)C)c2ccccc2)n1 ZINC000427825542 1043219035 /nfs/dbraw/zinc/21/90/35/1043219035.db2.gz KAIIIHBXPCTXRG-INIZCTEOSA-N -1 3 332.469 4.144 20 0 EIADHM O=C(N[C@H]1COc2ccc(Cl)cc21)c1cc([O-])c2ccccc2c1 ZINC000526914994 1043245247 /nfs/dbraw/zinc/24/52/47/1043245247.db2.gz QSLKSPJREUASCB-INIZCTEOSA-N -1 3 339.778 4.062 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N1CC=C(c2ccccc2F)C1 ZINC000526924698 1043245985 /nfs/dbraw/zinc/24/59/85/1043245985.db2.gz NJLDPBDMIOCFAE-UHFFFAOYSA-N -1 3 333.362 4.224 20 0 EIADHM O=C(N[C@H]1CCO[C@H](c2ccccc2)C1)c1cc([O-])c2ccccc2c1 ZINC000526924232 1043246416 /nfs/dbraw/zinc/24/64/16/1043246416.db2.gz CMVQPHPTKPPJOI-RXVVDRJESA-N -1 3 347.414 4.196 20 0 EIADHM C[C@@]1(c2ccccc2)CCN(C(=O)c2cc([O-])c3ccccc3c2)C1 ZINC000527176131 1043253936 /nfs/dbraw/zinc/25/39/36/1043253936.db2.gz CSWXCGQXZHBUSF-JOCHJYFZSA-N -1 3 331.415 4.349 20 0 EIADHM C[C@@H]1CN(C(=O)c2cc([O-])c3ccccc3c2)[C@@H](c2ccccc2)CO1 ZINC000527467085 1043262132 /nfs/dbraw/zinc/26/21/32/1043262132.db2.gz CLGBJWCFUCWNSZ-FOIQADDNSA-N -1 3 347.414 4.148 20 0 EIADHM C[C@H](C(=O)[N-][C@H](c1ccc(F)c(Cl)c1)C(F)(F)F)C(C)(F)F ZINC000508175420 1043302847 /nfs/dbraw/zinc/30/28/47/1043302847.db2.gz WGWWYWUMZRONPR-LHLIQPBNSA-N -1 3 347.686 4.490 20 0 EIADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)CC3CC(C)(C)C3)c2)n1 ZINC000428171414 1043363675 /nfs/dbraw/zinc/36/36/75/1043363675.db2.gz SISNCIWMKOWRLI-UHFFFAOYSA-N -1 3 339.439 4.176 20 0 EIADHM C[C@@H]1C[C@@H](CCNC(=O)c2c[n-]c3ccccc3c2=O)CC(C)(C)C1 ZINC001128609582 1043413964 /nfs/dbraw/zinc/41/39/64/1043413964.db2.gz ZSAGKENWMUIUFA-HUUCEWRRSA-N -1 3 340.467 4.110 20 0 EIADHM C[C@@H](NC(=O)c1c[n-]c2ccccc2c1=O)c1csc2ccccc21 ZINC000729976725 1043423290 /nfs/dbraw/zinc/42/32/90/1043423290.db2.gz FBJBCWRGVLEGDR-GFCCVEGCSA-N -1 3 348.427 4.234 20 0 EIADHM C[C@@H](NC(=O)c1cc(=O)c2ccccc2[n-]1)c1csc2ccccc21 ZINC000729976414 1043423316 /nfs/dbraw/zinc/42/33/16/1043423316.db2.gz ATZIIHPSVXUHTP-GFCCVEGCSA-N -1 3 348.427 4.234 20 0 EIADHM O=C(CCC1CCCCC1)[N-]OCc1cc(-c2cccs2)on1 ZINC000730100551 1043447769 /nfs/dbraw/zinc/44/77/69/1043447769.db2.gz OITZPVYCCIIQKK-UHFFFAOYSA-N -1 3 334.441 4.311 20 0 EIADHM CC(=O)c1cc(Nc2cc(F)cc(F)c2[O-])ccc1Br ZINC001212491160 1043581852 /nfs/dbraw/zinc/58/18/52/1043581852.db2.gz KVAJGJQBPUBLNL-UHFFFAOYSA-N -1 3 342.139 4.379 20 0 EIADHM [O-]c1c(F)cc(Br)cc1Nc1cc(F)cc(F)c1O ZINC001212489593 1043582356 /nfs/dbraw/zinc/58/23/56/1043582356.db2.gz UABZAWZIBVYSSO-UHFFFAOYSA-N -1 3 334.091 4.021 20 0 EIADHM CC[C@H](C)c1ccc(S(=O)(=O)[N-]c2cccc(F)c2F)cc1 ZINC000521414505 1043756262 /nfs/dbraw/zinc/75/62/62/1043756262.db2.gz PXLMUZKELTVBJC-NSHDSACASA-N -1 3 325.380 4.279 20 0 EIADHM COc1ccc2oc(C)c(C(=O)Nc3cc(Cl)ccc3[O-])c2c1 ZINC000731456676 1043762705 /nfs/dbraw/zinc/76/27/05/1043762705.db2.gz BKAGEXBBDWNBPE-UHFFFAOYSA-N -1 3 331.755 4.361 20 0 EIADHM O=C(O[C@@H]1CCCc2ccccc2C1=O)c1cc(Cl)c(Cl)[n-]1 ZINC000731508946 1043781107 /nfs/dbraw/zinc/78/11/07/1043781107.db2.gz JYNGWRACQUDIRN-CYBMUJFWSA-N -1 3 338.190 4.066 20 0 EIADHM Cc1ccc(Oc2nc3ccccc3c(=O)[n-]2)c(Br)c1 ZINC000731916684 1043845050 /nfs/dbraw/zinc/84/50/50/1043845050.db2.gz HAUTYQOKZCEPHV-UHFFFAOYSA-N -1 3 331.169 4.199 20 0 EIADHM O=c1[n-]c(Oc2ccc(Br)cc2F)nc2ccccc12 ZINC000731916762 1043845455 /nfs/dbraw/zinc/84/54/55/1043845455.db2.gz RXMBNPCCVXESEI-UHFFFAOYSA-N -1 3 335.132 4.029 20 0 EIADHM O=C(CCCc1ccccc1)[N-]OCc1csc(C2CCCC2)n1 ZINC000732806133 1044010558 /nfs/dbraw/zinc/01/05/58/1044010558.db2.gz WWRRHBWUNOZWDM-UHFFFAOYSA-N -1 3 344.480 4.371 20 0 EIADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)C[C@H](C)CC(C)C)c2)n1 ZINC000067815678 1044042839 /nfs/dbraw/zinc/04/28/39/1044042839.db2.gz QQFDFVAVMMZXFU-CQSZACIVSA-N -1 3 341.455 4.010 20 0 EIADHM CSc1ccc(Cl)cc1[N-]C(=O)c1cc(F)cc2nccnc21 ZINC000194337375 1044290794 /nfs/dbraw/zinc/29/07/94/1044290794.db2.gz GXEDRVTXPYUXGD-UHFFFAOYSA-N -1 3 347.802 4.397 20 0 EIADHM [O-]c1ccc(-c2nc(-c3cc(Cl)ccc3C(F)(F)F)no2)nc1 ZINC001212558012 1044306238 /nfs/dbraw/zinc/30/62/38/1044306238.db2.gz NBAHTQXJFUOGBH-UHFFFAOYSA-N -1 3 341.676 4.176 20 0 EIADHM COC(=O)c1cnc(SC[C@H](C)c2ccc(C(F)(F)F)cc2)[n-]1 ZINC000443467895 1044355625 /nfs/dbraw/zinc/35/56/25/1044355625.db2.gz NMWWGFNMPCQNTN-VIFPVBQESA-N -1 3 344.358 4.111 20 0 EIADHM C[C@H](c1ccccn1)N(C)C(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000094063016 1044503385 /nfs/dbraw/zinc/50/33/85/1044503385.db2.gz BIPBLHOICGYIKH-MRXNPFEDSA-N -1 3 346.430 4.211 20 0 EIADHM O=C(Nc1c(F)cccc1N1CCCC1)c1cc([O-])ccc1Cl ZINC000550524940 1044512140 /nfs/dbraw/zinc/51/21/40/1044512140.db2.gz UKUTWEQDYIMVCK-UHFFFAOYSA-N -1 3 334.778 4.037 20 0 EIADHM O=c1[n-]c(N[C@@H](c2ccccn2)C(F)(F)F)c(Cl)cc1Cl ZINC001168476386 1044620622 /nfs/dbraw/zinc/62/06/22/1044620622.db2.gz CZOGBZAYCVXVQK-VIFPVBQESA-N -1 3 338.116 4.205 20 0 EIADHM O=C(Nc1ccc(Br)cc1[O-])[C@H]1CCCc2ccccc21 ZINC000642323595 1044662219 /nfs/dbraw/zinc/66/22/19/1044662219.db2.gz UKNDNNXNSKEHLO-AWEZNQCLSA-N -1 3 346.224 4.213 20 0 EIADHM O=C([O-])c1sc2ccccc2c1CN1CCC[C@H](C(F)(F)F)C1 ZINC000390125420 1044863744 /nfs/dbraw/zinc/86/37/44/1044863744.db2.gz ZASABJPLTJWYGB-JTQLQIEISA-N -1 3 343.370 4.374 20 0 EIADHM Cc1ccc(C)c(CN(C)Cc2nc3c4ccccc4oc3c(=O)[n-]2)c1 ZINC000429312790 1044932284 /nfs/dbraw/zinc/93/22/84/1044932284.db2.gz TYMFXLMJFYTEAE-UHFFFAOYSA-N -1 3 347.418 4.330 20 0 EIADHM N#CC(=C([O-])C1=CCCCCC1)c1nc2ccccc2n1C(F)F ZINC000187143884 1045066010 /nfs/dbraw/zinc/06/60/10/1045066010.db2.gz PTTYAZXFHWCPCF-ZDUSSCGKSA-N -1 3 329.350 4.498 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)NC(C1CCCC1)C1CCCC1 ZINC000739019709 1045117065 /nfs/dbraw/zinc/11/70/65/1045117065.db2.gz LNZCFIFOHSFTAJ-UHFFFAOYSA-N -1 3 334.435 4.080 20 0 EIADHM Cn1c2ccccc2c2cc(C(=O)Nc3cccc([O-])c3F)sc21 ZINC000762316425 1045178715 /nfs/dbraw/zinc/17/87/15/1045178715.db2.gz KBXMOAVQBSJVOD-UHFFFAOYSA-N -1 3 340.379 4.490 20 0 EIADHM O=C([N-]c1nnc(CC2CCCCC2)s1)c1coc(C(F)F)c1 ZINC000625263301 1045201137 /nfs/dbraw/zinc/20/11/37/1045201137.db2.gz ZHINEOHLVUWCTL-UHFFFAOYSA-N -1 3 341.383 4.444 20 0 EIADHM CCOc1ccc([N-]S(=O)(=O)c2ccc(Cl)cc2C)c(C)c1 ZINC000614867832 1045544711 /nfs/dbraw/zinc/54/47/11/1045544711.db2.gz YDLQFJFTDCPFFB-UHFFFAOYSA-N -1 3 339.844 4.156 20 0 EIADHM Cc1c(Br)cccc1C(=O)Nc1ccc(Cl)cc1[O-] ZINC000533618518 1045639811 /nfs/dbraw/zinc/63/98/11/1045639811.db2.gz POAPDGVAXUNTQF-UHFFFAOYSA-N -1 3 340.604 4.369 20 0 EIADHM CCCCN(CC(F)(F)F)C(=O)c1cc2sccc2c([O-])c1 ZINC000791331192 1045723292 /nfs/dbraw/zinc/72/32/92/1045723292.db2.gz CZUXPKAVFPTXEI-UHFFFAOYSA-N -1 3 331.359 4.412 20 0 EIADHM Cc1cc(=O)[n-]c(CSCc2c(Cl)ccc3cccnc32)n1 ZINC000763216187 1045766711 /nfs/dbraw/zinc/76/67/11/1045766711.db2.gz OQVWRYJYRGHIRB-UHFFFAOYSA-N -1 3 331.828 4.126 20 0 EIADHM Cc1cc(Br)c(Nc2ccc([O-])c(F)c2F)nc1C ZINC001212003383 1045824457 /nfs/dbraw/zinc/82/44/57/1045824457.db2.gz ZMIVOJVXSSQAGL-UHFFFAOYSA-N -1 3 329.144 4.188 20 0 EIADHM Cc1cccc([O-])c1C(=O)N1CCC(c2c[nH]c3ccccc32)CC1 ZINC000623626993 1045827256 /nfs/dbraw/zinc/82/72/56/1045827256.db2.gz NOVUUFUSSGYATN-UHFFFAOYSA-N -1 3 334.419 4.202 20 0 EIADHM CC(=O)Nc1ccc(Nc2ccc([O-])c(F)c2F)cc1C(F)(F)F ZINC001212007547 1045827369 /nfs/dbraw/zinc/82/73/69/1045827369.db2.gz MPSOEXJDXHGUOU-UHFFFAOYSA-N -1 3 346.255 4.391 20 0 EIADHM Cc1cc(O)c(Nc2ccc([O-])c(F)c2F)cc1Br ZINC001212010831 1045831378 /nfs/dbraw/zinc/83/13/78/1045831378.db2.gz AZSUGUJQQLBEBR-UHFFFAOYSA-N -1 3 330.128 4.191 20 0 EIADHM [O-]c1ccc(Nc2cc(F)ccc2OC[C@H]2CCCO2)c(F)c1F ZINC001212009490 1045831674 /nfs/dbraw/zinc/83/16/74/1045831674.db2.gz QXLZLDQPZWFHBJ-LLVKDONJSA-N -1 3 339.313 4.111 20 0 EIADHM COC(=O)c1cc(Cl)cc(Nc2ccc([O-])c(F)c2F)c1C ZINC001212016226 1045839318 /nfs/dbraw/zinc/83/93/18/1045839318.db2.gz FGVJFUWOCOQSDT-UHFFFAOYSA-N -1 3 327.714 4.162 20 0 EIADHM [O-]c1ccc(Nc2cc(F)c(OCC3CC3)c(F)c2)c(F)c1F ZINC001212016417 1045839550 /nfs/dbraw/zinc/83/95/50/1045839550.db2.gz OYIBXEFUUUDOSX-UHFFFAOYSA-N -1 3 327.277 4.481 20 0 EIADHM COC(=O)c1cc2cccc(Nc3ccc([O-])c(F)c3F)c2s1 ZINC001212016237 1045839726 /nfs/dbraw/zinc/83/97/26/1045839726.db2.gz FZVDSOXGJAWULM-UHFFFAOYSA-N -1 3 335.331 4.415 20 0 EIADHM CCN(C[C@H](O)c1ccc(C)cc1)C(=O)c1cc([O-])c2ccccc2c1 ZINC000792213814 1045882750 /nfs/dbraw/zinc/88/27/50/1045882750.db2.gz KZCLVHUCCGPOQN-NRFANRHFSA-N -1 3 349.430 4.050 20 0 EIADHM Cc1sc2[n-]c([C@H](C)OC(=O)C[C@H]3CCC[C@H]3C)nc(=O)c2c1C ZINC000769187059 1045891881 /nfs/dbraw/zinc/89/18/81/1045891881.db2.gz USZBYXZMYQEABX-SUZMYJTESA-N -1 3 348.468 4.444 20 0 EIADHM CC(C)(C)c1ccc(O)c([N-]S(=O)(=O)/C=C\c2ccccc2)c1 ZINC000916103637 1045912882 /nfs/dbraw/zinc/91/28/82/1045912882.db2.gz UFJKPEIGAFBINZ-QXMHVHEDSA-N -1 3 331.437 4.102 20 0 EIADHM CC(C)C[C@H](NC(=O)OC(C)(C)C)c1noc(-c2ccccc2[O-])n1 ZINC000496400038 1045934766 /nfs/dbraw/zinc/93/47/66/1045934766.db2.gz OUNUMJGQADMZJY-ZDUSSCGKSA-N -1 3 347.415 4.054 20 0 EIADHM O=c1[n-]c(CSc2ncccc2Cl)nc2c3ccccc3oc21 ZINC000253615285 1046062136 /nfs/dbraw/zinc/06/21/36/1046062136.db2.gz BWTBGQRPRFJBQR-UHFFFAOYSA-N -1 3 343.795 4.422 20 0 EIADHM O=C(Nc1ccc([O-])c(C(F)(F)F)c1)C1(c2ccc(F)cc2)CC1 ZINC000125315318 1046296987 /nfs/dbraw/zinc/29/69/87/1046296987.db2.gz GIYPUTHPCPJUJX-UHFFFAOYSA-N -1 3 339.288 4.220 20 0 EIADHM Fc1cc(-c2cc(C(F)(F)F)[n-]c(=S)n2)cc(F)c1Cl ZINC001242795282 1046728850 /nfs/dbraw/zinc/72/88/50/1046728850.db2.gz CLGGNGLRMYRHCK-UHFFFAOYSA-N -1 3 326.677 4.383 20 0 EIADHM CC[C@](C)(NC(=O)CCCc1ccc([O-])c(F)c1)c1ccccc1 ZINC000786918130 1046880954 /nfs/dbraw/zinc/88/09/54/1046880954.db2.gz STBSHIYNKGCPQL-FQEVSTJZSA-N -1 3 329.415 4.296 20 0 EIADHM Cc1ccc(N(C)C(=O)CCCc2ccc([O-])c(F)c2)cc1Cl ZINC000786979263 1046890633 /nfs/dbraw/zinc/89/06/33/1046890633.db2.gz KUDJEKZTXMTLBU-UHFFFAOYSA-N -1 3 335.806 4.479 20 0 EIADHM CCc1cc(=O)[n-]c(CN[C@@H](c2oc3ccccc3c2C)C(C)C)n1 ZINC000537059221 1046908550 /nfs/dbraw/zinc/90/85/50/1046908550.db2.gz UUNKXYRMPJZJST-LJQANCHMSA-N -1 3 339.439 4.286 20 0 EIADHM CCc1ccc(C(=O)N2CCC(c3ccc(F)cc3)CC2)c([O-])c1 ZINC000787115653 1046910800 /nfs/dbraw/zinc/91/08/00/1046910800.db2.gz HMBNMGZYNJCQPF-UHFFFAOYSA-N -1 3 327.399 4.114 20 0 EIADHM O=C(c1cc2sccc2c([O-])c1)N1CCc2[nH]c3ccccc3c2C1 ZINC000788271044 1047152624 /nfs/dbraw/zinc/15/26/24/1047152624.db2.gz QEJVFBYNPIWCDD-UHFFFAOYSA-N -1 3 348.427 4.287 20 0 EIADHM Cc1cc(N(C)C)ccc1NC(=O)c1cc2sccc2c([O-])c1 ZINC000788279838 1047156753 /nfs/dbraw/zinc/15/67/53/1047156753.db2.gz CCHIHWQANXXKHI-UHFFFAOYSA-N -1 3 326.421 4.234 20 0 EIADHM Cc1cc(=O)[n-]c(C=Cc2nc3ccc(Br)cc3s2)n1 ZINC000806574615 1047313371 /nfs/dbraw/zinc/31/33/71/1047313371.db2.gz SYZDPXPJQTXGAP-PLNGDYQASA-N -1 3 348.225 4.033 20 0 EIADHM Cc1nc(-c2ccc(F)cc2)sc1C(=O)Nc1cccc([O-])c1F ZINC000129256272 1047339051 /nfs/dbraw/zinc/33/90/51/1047339051.db2.gz HMKRFXIZHQAOAQ-UHFFFAOYSA-N -1 3 346.358 4.355 20 0 EIADHM O=C(CCC1CCCCC1)[N-]OCc1ncc(-c2cccs2)o1 ZINC000760438231 1047368694 /nfs/dbraw/zinc/36/86/94/1047368694.db2.gz KXAGZDGJNAFSTP-UHFFFAOYSA-N -1 3 334.441 4.311 20 0 EIADHM CC(C)C[C@@H](C)OCCC(=O)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000476158129 1047391231 /nfs/dbraw/zinc/39/12/31/1047391231.db2.gz NSPOHIJWMUFYCJ-LLVKDONJSA-N -1 3 333.350 4.191 20 0 EIADHM C[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)Nc1cccc([O-])c1F ZINC000129449738 1047393602 /nfs/dbraw/zinc/39/36/02/1047393602.db2.gz ANPVGRLFZSNYRR-GFCCVEGCSA-N -1 3 331.387 4.235 20 0 EIADHM O=C(Nc1ccc([O-])c(C(F)(F)F)c1)[C@H]1C[C@@]12CCc1ccccc12 ZINC000476174111 1047401976 /nfs/dbraw/zinc/40/19/76/1047401976.db2.gz UCLLGIWKTWAIKK-CRAIPNDOSA-N -1 3 347.336 4.254 20 0 EIADHM O=C(Nc1cccc([O-])c1F)c1csc(-c2ccccc2F)n1 ZINC000129721967 1047491089 /nfs/dbraw/zinc/49/10/89/1047491089.db2.gz XBRGAQQELVORSV-UHFFFAOYSA-N -1 3 332.331 4.046 20 0 EIADHM Cc1c([O-])ccc2c(CN(CC(C)C)c3ccccc3)cc(=O)oc12 ZINC001170129067 1047529627 /nfs/dbraw/zinc/52/96/27/1047529627.db2.gz URTJOMJIIKTUKQ-UHFFFAOYSA-N -1 3 337.419 4.470 20 0 EIADHM CC[C@H](C)Sc1ccc([N-]S(=O)(=O)CC)c(C(F)(F)F)c1 ZINC000130144443 1047616259 /nfs/dbraw/zinc/61/62/59/1047616259.db2.gz QLWGZQQWRLKJKY-VIFPVBQESA-N -1 3 341.420 4.358 20 0 EIADHM C[C@H]1C[C@H](c2ccc(F)cc2)CN1C(=O)c1cc([O-])ccc1Cl ZINC000556266311 1047644475 /nfs/dbraw/zinc/64/44/75/1047644475.db2.gz LFWLLEKFFDDUJN-AAEUAGOBSA-N -1 3 333.790 4.203 20 0 EIADHM Cc1ccc([N-]S(=O)(=O)c2c(C)ccc3cccnc32)c(Cl)c1 ZINC000476427855 1047805841 /nfs/dbraw/zinc/80/58/41/1047805841.db2.gz BFWAHWNPHUNIKV-UHFFFAOYSA-N -1 3 346.839 4.306 20 0 EIADHM O=C(c1cc([O-])ccc1Cl)N1CCC[C@@H]1/C=C\c1ccccc1 ZINC000498709840 1047819127 /nfs/dbraw/zinc/81/91/27/1047819127.db2.gz CJSJUPLEMRTMIV-WHLNPGIBSA-N -1 3 327.811 4.364 20 0 EIADHM CC1(c2nsc([N-]C(=O)c3csc(C4CCCCC4)n3)n2)CC1 ZINC001131246560 1047872532 /nfs/dbraw/zinc/87/25/32/1047872532.db2.gz LKXCHYGEUKJNLK-UHFFFAOYSA-N -1 3 348.497 4.346 20 0 EIADHM Cc1ccc(Br)c(C)c1C(=O)Nc1cccc([O-])c1F ZINC000556692968 1047877938 /nfs/dbraw/zinc/87/79/38/1047877938.db2.gz RXGDSSRUIPKGDS-UHFFFAOYSA-N -1 3 338.176 4.163 20 0 EIADHM C[C@H](CC(=O)[N-]OCc1ccccc1)c1ccc(C(F)(F)F)cc1 ZINC000920031475 1048397007 /nfs/dbraw/zinc/39/70/07/1048397007.db2.gz ATHYHVZVUKKCKA-CYBMUJFWSA-N -1 3 337.341 4.447 20 0 EIADHM CCOC(=O)c1cccc2[n-]c(NC(=O)C[C@@H](CC)C(C)(C)C)nc21 ZINC001134940352 1048400178 /nfs/dbraw/zinc/40/01/78/1048400178.db2.gz CKWLLWWFQMQXHU-GFCCVEGCSA-N -1 3 345.443 4.141 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)[C@@H]1C[C@@H]1c1cccc2ccccc21 ZINC000132667433 1048404225 /nfs/dbraw/zinc/40/42/25/1048404225.db2.gz VAXYOYNZFCLSDO-QZTJIDSGSA-N -1 3 335.378 4.104 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)[C@H]1C[C@H]1c1ccc2ccccc2c1 ZINC000132741861 1048480900 /nfs/dbraw/zinc/48/09/00/1048480900.db2.gz ILJDTIWIOAXYME-ROUUACIJSA-N -1 3 335.378 4.104 20 0 EIADHM O=C(Nc1cc(Br)ccc1[O-])c1ccsc1C(F)F ZINC001138017520 1048608307 /nfs/dbraw/zinc/60/83/07/1048608307.db2.gz MTAQIWVOWMDVGN-UHFFFAOYSA-N -1 3 348.168 4.406 20 0 EIADHM CC(F)(F)C(=O)[N-][C@H](c1cccc(F)c1)c1cccc(Cl)c1 ZINC000815787791 1048610037 /nfs/dbraw/zinc/61/00/37/1048610037.db2.gz NUTSBEFNLZTXAA-AWEZNQCLSA-N -1 3 327.733 4.340 20 0 EIADHM CCN(Cc1c(F)cc([O-])cc1F)[C@@H](C)Cc1ccc(OC)cc1 ZINC001144541198 1048718118 /nfs/dbraw/zinc/71/81/18/1048718118.db2.gz DDMNSSHNZJWXPS-ZDUSSCGKSA-N -1 3 335.394 4.132 20 0 EIADHM Cc1ccc([C@@H]2CCCCN2C(=O)Cc2ccc([O-])c(F)c2)cc1C ZINC001144628712 1048764632 /nfs/dbraw/zinc/76/46/32/1048764632.db2.gz CLYNEXVGRCFHLK-IBGZPJMESA-N -1 3 341.426 4.444 20 0 EIADHM O=C(Cc1ccc([O-])c(F)c1)NC1(c2cccc3ccccc32)CC1 ZINC001144633107 1048767117 /nfs/dbraw/zinc/76/71/17/1048767117.db2.gz FHMMIHCWTOBUBT-UHFFFAOYSA-N -1 3 335.378 4.033 20 0 EIADHM CC(C)c1scnc1C(=O)[N-]c1nc(-c2ccc(F)cc2)ns1 ZINC000810395975 1048771641 /nfs/dbraw/zinc/77/16/41/1048771641.db2.gz IFEZZQXFSHNMMY-UHFFFAOYSA-N -1 3 348.428 4.176 20 0 EIADHM O=C(N[C@@H]1CC2(CCC2)Oc2ccccc21)c1cc([O-])ccc1Cl ZINC000810523275 1048805844 /nfs/dbraw/zinc/80/58/44/1048805844.db2.gz GMAIDJLWFURAGV-MRXNPFEDSA-N -1 3 343.810 4.222 20 0 EIADHM [O-]c1ccc(F)c(CN2CCC[C@@H]3O[C@H](c4ccccc4)C[C@@H]32)c1F ZINC000846118789 1048815432 /nfs/dbraw/zinc/81/54/32/1048815432.db2.gz CEKIKZCJBPEHMD-WDSOQIARSA-N -1 3 345.389 4.165 20 0 EIADHM CCCN(CCC)c1ccc(NC(=O)c2cccc(OC)c2[O-])cc1 ZINC001144734512 1048835442 /nfs/dbraw/zinc/83/54/42/1048835442.db2.gz RGTUFBWEPKCAAE-UHFFFAOYSA-N -1 3 342.439 4.280 20 0 EIADHM O=C([O-])[C@H](c1cccc(Cl)c1Cl)N1CCC2(CCCC2)C1 ZINC000846245297 1048843709 /nfs/dbraw/zinc/84/37/09/1048843709.db2.gz UEYXNVWBKNIEEO-AWEZNQCLSA-N -1 3 328.239 4.385 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])C(F)(F)c1cccc(Cl)c1 ZINC000921076291 1048847111 /nfs/dbraw/zinc/84/71/11/1048847111.db2.gz NPBKCSPMMPNKJX-UHFFFAOYSA-N -1 3 332.133 4.430 20 0 EIADHM O=C([N-]c1nc(-c2cccs2)cs1)c1conc1C(F)(F)F ZINC000816832008 1048865313 /nfs/dbraw/zinc/86/53/13/1048865313.db2.gz MQNIJWBASQYYHY-UHFFFAOYSA-N -1 3 345.327 4.131 20 0 EIADHM O=C(Nc1nc2ccccc2[nH]1)c1cc(Oc2ccccc2)ccc1[O-] ZINC001135702418 1048868223 /nfs/dbraw/zinc/86/82/23/1048868223.db2.gz BRZPYGPNWBGZKD-UHFFFAOYSA-N -1 3 345.358 4.313 20 0 EIADHM O=S(=O)([N-]c1cc(F)ccc1Cl)c1ccc(F)cc1Cl ZINC000076195309 1048869514 /nfs/dbraw/zinc/86/95/14/1048869514.db2.gz BNRBFJBQAHSSAX-UHFFFAOYSA-N -1 3 338.162 4.072 20 0 EIADHM Cc1ccc(-c2csc([N-]C(=O)c3c(F)ccnc3F)n2)cc1 ZINC000816831765 1048870109 /nfs/dbraw/zinc/87/01/09/1048870109.db2.gz GCFNLDBESPOGBY-UHFFFAOYSA-N -1 3 331.347 4.044 20 0 EIADHM O=C(O[C@@H]1CCCC12CCOCC2)c1cc2cc(Cl)sc2[n-]1 ZINC000810860684 1048886956 /nfs/dbraw/zinc/88/69/56/1048886956.db2.gz AJUODKRKMINOLO-GFCCVEGCSA-N -1 3 339.844 4.389 20 0 EIADHM Cc1cccc([O-])c1C(=O)Nc1cccc(-c2nc3ccccc3[nH]2)c1 ZINC001135844083 1048916998 /nfs/dbraw/zinc/91/69/98/1048916998.db2.gz MDQQYUPOGODPOA-UHFFFAOYSA-N -1 3 343.386 4.496 20 0 EIADHM C[C@H]1CCc2ccccc2N1C(=O)CCCc1ccc([O-])c(F)c1 ZINC001135896718 1048958310 /nfs/dbraw/zinc/95/83/10/1048958310.db2.gz JXOQWIZGVWVKAI-AWEZNQCLSA-N -1 3 327.399 4.222 20 0 EIADHM O=C([N-]c1cc(F)c(F)c(F)c1F)c1sccc1OC(F)F ZINC001132719932 1049015584 /nfs/dbraw/zinc/01/55/84/1049015584.db2.gz GAXPPNIMCYXEGW-UHFFFAOYSA-N -1 3 341.232 4.158 20 0 EIADHM O=C(OCc1cnc(Cl)s1)c1cc2cc(Cl)sc2[n-]1 ZINC000811396170 1049051190 /nfs/dbraw/zinc/05/11/90/1049051190.db2.gz MHOAMSSUYMMCLL-UHFFFAOYSA-N -1 3 333.221 4.350 20 0 EIADHM O=C(CSCc1ccc(F)cc1)Nc1cc(Cl)ccc1[O-] ZINC000609442913 1049063657 /nfs/dbraw/zinc/06/36/57/1049063657.db2.gz VGBGIIJEFOGUFS-UHFFFAOYSA-N -1 3 325.792 4.057 20 0 EIADHM CC(C)CN(CCc1ccccc1)C(=O)c1cc([O-])ccc1Cl ZINC001136155296 1049188906 /nfs/dbraw/zinc/18/89/06/1049188906.db2.gz JNKAFUBOOJBAHE-UHFFFAOYSA-N -1 3 331.843 4.387 20 0 EIADHM O=C(Nc1cc(Br)ccc1[O-])c1ccccc1C1CC1 ZINC001148478781 1049322620 /nfs/dbraw/zinc/32/26/20/1049322620.db2.gz PURJDAGXRIUGHN-UHFFFAOYSA-N -1 3 332.197 4.284 20 0 EIADHM CCO[C@@H]1C[C@@H](NC(=O)c2cc3sccc3c([O-])c2)C12CCCC2 ZINC001148552720 1049331487 /nfs/dbraw/zinc/33/14/87/1049331487.db2.gz DOMOOGDKDGSAPZ-IAGOWNOFSA-N -1 3 345.464 4.075 20 0 EIADHM CC(=O)c1cc(C(=O)Nc2c(Cl)ccc3ncccc32)ccc1[O-] ZINC001148664888 1049355875 /nfs/dbraw/zinc/35/58/75/1049355875.db2.gz UEJCJIPNIRZOQN-UHFFFAOYSA-N -1 3 340.766 4.049 20 0 EIADHM CC(=O)c1cc(C(=O)N2CCC[C@@H]2c2cc3ccccc3[nH]2)ccc1[O-] ZINC001148662326 1049356723 /nfs/dbraw/zinc/35/67/23/1049356723.db2.gz JFMMPPAJQNPHKM-LJQANCHMSA-N -1 3 348.402 4.053 20 0 EIADHM CSc1ccc([O-])c(C(=O)N2CCC[C@H]2c2cccc(F)c2)c1 ZINC001136329802 1049479018 /nfs/dbraw/zinc/47/90/18/1049479018.db2.gz OUEFZWUJMXQVPR-INIZCTEOSA-N -1 3 331.412 4.231 20 0 EIADHM O=C(Nc1c([O-])cccc1Cl)[C@H](O)c1cc(Cl)cc(Cl)c1 ZINC000820511120 1049516634 /nfs/dbraw/zinc/51/66/34/1049516634.db2.gz WFEODEAGHTUXBN-CYBMUJFWSA-N -1 3 346.597 4.025 20 0 EIADHM CCC[C@@H]1C[C@H]1C(=O)O[C@@H](C)c1nc(=O)c2c(C)c(C)sc2[n-]1 ZINC000812637319 1049535257 /nfs/dbraw/zinc/53/52/57/1049535257.db2.gz BQXZAQLCXLYLIG-MVWJERBFSA-N -1 3 334.441 4.054 20 0 EIADHM CC(C)c1nsc([N-]C(=O)c2ncccc2Oc2ccccc2)n1 ZINC001133409639 1049546617 /nfs/dbraw/zinc/54/66/17/1049546617.db2.gz KACQBRGIMUCDAE-UHFFFAOYSA-N -1 3 340.408 4.101 20 0 EIADHM O=C(OCc1noc(C2CCCCC2)n1)c1cc2ccsc2[n-]1 ZINC000773110325 1049590431 /nfs/dbraw/zinc/59/04/31/1049590431.db2.gz DLYWHAOZTUDNEJ-UHFFFAOYSA-N -1 3 331.397 4.017 20 0 EIADHM Cc1ccsc1CNC(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC001136442041 1049630965 /nfs/dbraw/zinc/63/09/65/1049630965.db2.gz DIZIHADTAXGYIV-UHFFFAOYSA-N -1 3 337.444 4.283 20 0 EIADHM CC(C)c1ncsc1C(=O)[N-]c1nnc(C2CCCCC2)s1 ZINC000822686039 1049786624 /nfs/dbraw/zinc/78/66/24/1049786624.db2.gz HNSUNAJLRMVGFY-UHFFFAOYSA-N -1 3 336.486 4.418 20 0 EIADHM Cc1ccc(C(=O)NCCc2nc(C3CCCCC3)cs2)c([O-])c1 ZINC001136628192 1049793836 /nfs/dbraw/zinc/79/38/36/1049793836.db2.gz RSRRKLCHHLQJJT-UHFFFAOYSA-N -1 3 344.480 4.177 20 0 EIADHM CC(C)c1ccc(C(=O)NCC(C)(C)c2ccc(F)cc2)c([O-])c1 ZINC001136642529 1049805683 /nfs/dbraw/zinc/80/56/83/1049805683.db2.gz CXJASQZUIXSRBY-UHFFFAOYSA-N -1 3 329.415 4.362 20 0 EIADHM CN(CCC(F)(F)F)C(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000138625626 1049868823 /nfs/dbraw/zinc/86/88/23/1049868823.db2.gz BYWHXNWOVLAGFX-UHFFFAOYSA-N -1 3 339.313 4.209 20 0 EIADHM O=c1cc(Nc2ccc(C3CCOCC3)cc2)[n-]n1-c1ccccc1 ZINC001212651218 1049878199 /nfs/dbraw/zinc/87/81/99/1049878199.db2.gz AKUQZEDVKKIIDM-UHFFFAOYSA-N -1 3 335.407 4.216 20 0 EIADHM CSc1ccc([O-])c(C(=O)N2CCc3sc(Cl)cc3C2)c1 ZINC000616453057 1049890698 /nfs/dbraw/zinc/89/06/98/1049890698.db2.gz QWOHHFVKRSBJKK-UHFFFAOYSA-N -1 3 339.869 4.028 20 0 EIADHM CCCCCC[C@@H](CCCC)n1c2[n-]c(=O)sc2c(=O)nc1N ZINC001172511770 1049926906 /nfs/dbraw/zinc/92/69/06/1049926906.db2.gz WQWOGHQOOFDUQP-LLVKDONJSA-N -1 3 338.477 4.085 20 0 EIADHM CC[C@H]1CC[C@H](C2CCC([NH2+]CCCCP(=O)([O-])[O-])CC2)CC1 ZINC001172589249 1049953079 /nfs/dbraw/zinc/95/30/79/1049953079.db2.gz WBXSUCSUWBFZRE-MJYONLJCSA-N -1 3 345.464 4.309 20 0 EIADHM CSc1c(F)cccc1[N-]C(=O)c1nc(C(C)C)ncc1Cl ZINC000617276020 1049973861 /nfs/dbraw/zinc/97/38/61/1049973861.db2.gz SYXROMZAHWIYAP-UHFFFAOYSA-N -1 3 339.823 4.367 20 0 EIADHM Cc1nc([C@H](C)N2CCC[C@H](C(=O)[O-])C2)oc1-c1ccc(Cl)cc1 ZINC000263582061 1050090830 /nfs/dbraw/zinc/09/08/30/1050090830.db2.gz YAYBINXBGRKHAM-JSGCOSHPSA-N -1 3 348.830 4.161 20 0 EIADHM Cc1ccc(-c2nsc([N-]C(=O)c3scnc3C3CC3)n2)s1 ZINC000089793707 1050135873 /nfs/dbraw/zinc/13/58/73/1050135873.db2.gz QCUKGHZQVQKMDO-UHFFFAOYSA-N -1 3 348.478 4.161 20 0 EIADHM [O-]c1cncc(-c2nc(-c3ccc(Cl)cc3C(F)(F)F)no2)c1 ZINC001212708696 1050330172 /nfs/dbraw/zinc/33/01/72/1050330172.db2.gz PIJLKJJTJGFPOZ-UHFFFAOYSA-N -1 3 341.676 4.176 20 0 EIADHM Cc1ccc2c(/C=C/C(=O)Nc3cc([O-])cc(Cl)c3)c[nH]c2c1 ZINC001178493604 1050469708 /nfs/dbraw/zinc/46/97/08/1050469708.db2.gz XEJFATWDQKJNLS-HWKANZROSA-N -1 3 326.783 4.487 20 0 EIADHM CC(=O)c1cccc([O-])c1NC(=O)c1ccc(OC(C)(C)C)cc1 ZINC001187363862 1050526941 /nfs/dbraw/zinc/52/69/41/1050526941.db2.gz LKRHHQMNCRMUOL-UHFFFAOYSA-N -1 3 327.380 4.024 20 0 EIADHM CN(C)Cc1ccccc1Nc1c(Cl)c(F)[n-]c(=O)c1Cl ZINC001173928750 1050651134 /nfs/dbraw/zinc/65/11/34/1050651134.db2.gz CYWXNZNZAZMWEQ-UHFFFAOYSA-N -1 3 330.190 4.038 20 0 EIADHM Cc1cc(S(=O)(=O)[N-]CC2(CC(C)C)CCCC2)c(F)cc1F ZINC001188008486 1050670372 /nfs/dbraw/zinc/67/03/72/1050670372.db2.gz LXHKQUZRPHQAIP-UHFFFAOYSA-N -1 3 345.455 4.158 20 0 EIADHM O=C([N-]c1csc2cnccc12)c1ncsc1C(F)(F)F ZINC001188206617 1050726810 /nfs/dbraw/zinc/72/68/10/1050726810.db2.gz HEVBWZJEGPWWSG-UHFFFAOYSA-N -1 3 329.328 4.024 20 0 EIADHM O=C(c1ccc(Nc2ccc([O-])c(Cl)c2)cc1)N1CCCCC1 ZINC001174072135 1050744744 /nfs/dbraw/zinc/74/47/44/1050744744.db2.gz JGMIVHVVQJVMBF-UHFFFAOYSA-N -1 3 330.815 4.415 20 0 EIADHM O=C(c1ccc(Nc2ccc([O-])c(F)c2F)cc1)N1CCCCC1 ZINC001174074555 1050748501 /nfs/dbraw/zinc/74/85/01/1050748501.db2.gz ZODRBLGCJWIKJV-UHFFFAOYSA-N -1 3 332.350 4.040 20 0 EIADHM COc1cc(F)ccc1Nc1cc(Br)cc(F)c1[O-] ZINC001174130006 1050774037 /nfs/dbraw/zinc/77/40/37/1050774037.db2.gz DWGVIAWSYUPZIZ-UHFFFAOYSA-N -1 3 330.128 4.185 20 0 EIADHM CC1CCN(C(=O)c2ccc(Nc3ccc([O-])c(F)c3F)cc2)CC1 ZINC001174161437 1050802190 /nfs/dbraw/zinc/80/21/90/1050802190.db2.gz JOZIBUVJHUTVJP-UHFFFAOYSA-N -1 3 346.377 4.286 20 0 EIADHM O=C(Nc1ccccc1)c1ccc(Nc2ncc(Cl)cc2[O-])cc1 ZINC001174161195 1050802633 /nfs/dbraw/zinc/80/26/33/1050802633.db2.gz SRDUAKNBFWWAFA-UHFFFAOYSA-N -1 3 339.782 4.437 20 0 EIADHM CC1CCN(C(=O)c2ccc(Nc3cc([O-])c(F)cc3F)cc2)CC1 ZINC001174162547 1050803386 /nfs/dbraw/zinc/80/33/86/1050803386.db2.gz YOPIWWXJDJGLCV-UHFFFAOYSA-N -1 3 346.377 4.286 20 0 EIADHM Cc1c(C(F)(F)F)ccc(Cl)c1[N-]S(=O)(=O)c1ccoc1 ZINC001188614158 1050806225 /nfs/dbraw/zinc/80/62/25/1050806225.db2.gz KPUZMNTXQSQXRI-UHFFFAOYSA-N -1 3 339.722 4.061 20 0 EIADHM O=C(c1cccc(Nc2cccc([O-])c2Cl)c1)N1CCCCC1 ZINC001174174478 1050816102 /nfs/dbraw/zinc/81/61/02/1050816102.db2.gz UWFPELLIKZXNBV-UHFFFAOYSA-N -1 3 330.815 4.415 20 0 EIADHM Cc1cccc([O-])c1C(=O)Nc1cccc(CCc2ccccn2)c1 ZINC001188638373 1050820472 /nfs/dbraw/zinc/82/04/72/1050820472.db2.gz LLPKZTXGLREWJI-UHFFFAOYSA-N -1 3 332.403 4.133 20 0 EIADHM CC(C)(C)[C@@H]1CCCN(Cc2ncc(Br)cc2[O-])CC1 ZINC001179931607 1050821447 /nfs/dbraw/zinc/82/14/47/1050821447.db2.gz OYUBGLZETZJGGG-GFCCVEGCSA-N -1 3 341.293 4.198 20 0 EIADHM COc1ccc(NC(=O)Nc2cc3ccccc3cc2[O-])cc1OC ZINC001188800504 1050847598 /nfs/dbraw/zinc/84/75/98/1050847598.db2.gz QFJHPBSFRXRACH-UHFFFAOYSA-N -1 3 338.363 4.207 20 0 EIADHM COc1cccc([C@@H](C)SCc2nnc(-c3ccccc3[O-])o2)c1 ZINC001188953607 1050870912 /nfs/dbraw/zinc/87/09/12/1050870912.db2.gz YAJNKUKMOCCCKK-GFCCVEGCSA-N -1 3 342.420 4.445 20 0 EIADHM COc1ccc(F)c(F)c1Nc1cccc([O-])c1Br ZINC001174425312 1050958272 /nfs/dbraw/zinc/95/82/72/1050958272.db2.gz PKARABQMDGAJND-UHFFFAOYSA-N -1 3 330.128 4.185 20 0 EIADHM Cc1cccc(F)c1[N-]S(=O)(=O)c1ccc(F)c2ccccc21 ZINC001189390331 1050977713 /nfs/dbraw/zinc/97/77/13/1050977713.db2.gz UOMVFIQAVJZECF-UHFFFAOYSA-N -1 3 333.359 4.227 20 0 EIADHM CCc1ccccc1NC(=O)NCc1ccc([O-])c(Br)c1 ZINC000153209121 1050993395 /nfs/dbraw/zinc/99/33/95/1050993395.db2.gz FJADQLQRPXRYFO-UHFFFAOYSA-N -1 3 349.228 4.039 20 0 EIADHM C[C@H](NCc1c(F)cccc1OC(F)F)c1cc([O-])cc(F)c1 ZINC000925484770 1051000635 /nfs/dbraw/zinc/00/06/35/1051000635.db2.gz HZEYTKMAUQQGOZ-VIFPVBQESA-N -1 3 329.293 4.123 20 0 EIADHM COc1ccc(C)cc1-c1csc([N-]c2ncnc3ncccc23)n1 ZINC000163149941 1051021081 /nfs/dbraw/zinc/02/10/81/1051021081.db2.gz ZVECPHLPWJUJOE-UHFFFAOYSA-N -1 3 349.419 4.209 20 0 EIADHM CC(C)(C(=O)Nc1ccc(F)c([O-])c1)c1ccccc1C(F)(F)F ZINC001180883457 1051100923 /nfs/dbraw/zinc/10/09/23/1051100923.db2.gz LFNJMYSIJDXAJW-UHFFFAOYSA-N -1 3 341.304 4.466 20 0 EIADHM O=S(=O)([N-]c1ccc(-n2cccc2)cc1)c1ccc(C2CC2)cc1 ZINC001190464766 1051192420 /nfs/dbraw/zinc/19/24/20/1051192420.db2.gz UZYIYHQVXWCKJP-UHFFFAOYSA-N -1 3 338.432 4.156 20 0 EIADHM CC(C)(C)c1cc([N-]S(=O)(=O)c2ccc(C3CC3)cc2)ccn1 ZINC001190469706 1051194646 /nfs/dbraw/zinc/19/46/46/1051194646.db2.gz QOSDZKLYUAABKZ-UHFFFAOYSA-N -1 3 330.453 4.057 20 0 EIADHM CC(C)(C)OC(=O)N1CCC(=CNc2cccc([O-])c2Cl)CC1 ZINC001174847355 1051210100 /nfs/dbraw/zinc/21/01/00/1051210100.db2.gz ZMIVKGMCSJGQNU-UHFFFAOYSA-N -1 3 338.835 4.372 20 0 EIADHM COc1c(C)cc(Nc2c(F)cc([O-])cc2F)cc1Br ZINC001175099775 1051345053 /nfs/dbraw/zinc/34/50/53/1051345053.db2.gz SFQNDRSEMJXZON-UHFFFAOYSA-N -1 3 344.155 4.494 20 0 EIADHM [O-]c1cc(F)c(Nc2c(F)cc(Br)cc2F)c(F)c1 ZINC001175099927 1051347768 /nfs/dbraw/zinc/34/77/68/1051347768.db2.gz HPRVRQMJJNEECH-UHFFFAOYSA-N -1 3 336.082 4.455 20 0 EIADHM CCO[C@@H]1C[C@@H](N(C)C(=O)c2cc3sccc3c([O-])c2)C12CCC2 ZINC000774064207 1051439240 /nfs/dbraw/zinc/43/92/40/1051439240.db2.gz CVDRFLMHMSBRPU-IAGOWNOFSA-N -1 3 345.464 4.027 20 0 EIADHM Cc1cc(Br)c(Nc2c(F)ccc([O-])c2F)nc1C ZINC001175262978 1051501438 /nfs/dbraw/zinc/50/14/38/1051501438.db2.gz FVVAXOKQVDZCAC-UHFFFAOYSA-N -1 3 329.144 4.188 20 0 EIADHM Cc1cc(=O)[n-]c([C@H](C)Sc2ncc(-c3ccc(F)cc3)o2)n1 ZINC000155925149 1051477174 /nfs/dbraw/zinc/47/71/74/1051477174.db2.gz UUCAGPZQNKUYAR-JTQLQIEISA-N -1 3 331.372 4.138 20 0 EIADHM O=S(=O)(CC1CCCC1)[N-]c1c(F)cccc1OC1CCCC1 ZINC001191536060 1051477631 /nfs/dbraw/zinc/47/76/31/1051477631.db2.gz VUTMRSDAZAUXCO-UHFFFAOYSA-N -1 3 341.448 4.079 20 0 EIADHM CC(C)(C)OC(=O)Nc1cc(Nc2c(F)ccc([O-])c2F)ccn1 ZINC001175260820 1051498683 /nfs/dbraw/zinc/49/86/83/1051498683.db2.gz BVTVPQDEKPJZNW-UHFFFAOYSA-N -1 3 337.326 4.156 20 0 EIADHM COc1cc(Br)cc(Nc2c(F)ccc([O-])c2F)c1 ZINC001175267651 1051502851 /nfs/dbraw/zinc/50/28/51/1051502851.db2.gz FASMNRUGLVXBDT-UHFFFAOYSA-N -1 3 330.128 4.185 20 0 EIADHM Cc1cnn(Cc2ccccc2F)c1Nc1c(F)ccc([O-])c1F ZINC001175266276 1051503567 /nfs/dbraw/zinc/50/35/67/1051503567.db2.gz SNIOTSWZFLRNKI-UHFFFAOYSA-N -1 3 333.313 4.106 20 0 EIADHM [O-]c1ccc(F)c(Nc2ccc(OCc3ccncc3)cc2)c1F ZINC001175267789 1051503820 /nfs/dbraw/zinc/50/38/20/1051503820.db2.gz GVZZNGJPVBTFRI-UHFFFAOYSA-N -1 3 328.318 4.388 20 0 EIADHM Cc1noc(C2CC2)c1[N-]C(=O)c1cnc(-c2ccccc2)s1 ZINC000156551007 1051540914 /nfs/dbraw/zinc/54/09/14/1051540914.db2.gz SATHUJXMXQXKEB-UHFFFAOYSA-N -1 3 325.393 4.236 20 0 EIADHM CCOc1ccc(C)cc1S(=O)(=O)[N-]c1ccc(C)cc1Cl ZINC001191779528 1051544686 /nfs/dbraw/zinc/54/46/86/1051544686.db2.gz DEKKFOKNQZEXSC-UHFFFAOYSA-N -1 3 339.844 4.156 20 0 EIADHM O=C(Nc1cc([O-])cc(Cl)c1)c1ccnc(Oc2ccccc2)c1 ZINC001191803746 1051555605 /nfs/dbraw/zinc/55/56/05/1051555605.db2.gz ZCZXMFMLMYDPLM-UHFFFAOYSA-N -1 3 340.766 4.485 20 0 EIADHM Cc1noc(C2CC2)c1[N-]C(=O)c1csc(-c2ccccc2F)n1 ZINC000156712043 1051556623 /nfs/dbraw/zinc/55/66/23/1051556623.db2.gz WDBQRDVAKGDNBS-UHFFFAOYSA-N -1 3 343.383 4.375 20 0 EIADHM Cc1ccc([N-]S(=O)(=O)Cc2ccc(Cl)cc2F)c(F)c1F ZINC001191903192 1051584550 /nfs/dbraw/zinc/58/45/50/1051584550.db2.gz FORXBEYGTMVHNZ-UHFFFAOYSA-N -1 3 349.761 4.008 20 0 EIADHM C[C@H](C(=O)Nc1ncccc1[O-])c1cccc(Oc2ccccc2)c1 ZINC001182735698 1051693743 /nfs/dbraw/zinc/69/37/43/1051693743.db2.gz HLAQMWRGZGAZPF-AWEZNQCLSA-N -1 3 334.375 4.322 20 0 EIADHM Cc1noc2ccc(CNC(=O)c3ccc(C(C)(C)C)cc3[O-])cc12 ZINC001192339357 1051694014 /nfs/dbraw/zinc/69/40/14/1051694014.db2.gz DNJOUAGPDLSYIM-UHFFFAOYSA-N -1 3 338.407 4.069 20 0 EIADHM CC(C)(C)c1ccc(C(=O)NCc2cncc3ccccc32)c([O-])c1 ZINC001192339782 1051694712 /nfs/dbraw/zinc/69/47/12/1051694712.db2.gz JMMCTXUJIBVKMG-UHFFFAOYSA-N -1 3 334.419 4.168 20 0 EIADHM Cc1csc(CCC(=O)Nc2cc(Br)ccc2[O-])c1 ZINC001176182053 1051930345 /nfs/dbraw/zinc/93/03/45/1051930345.db2.gz LTMONBGJNZKRMT-UHFFFAOYSA-N -1 3 340.242 4.096 20 0 EIADHM COC(=O)c1cc([O-])c(F)cc1NC(=O)CCCC1CCCCC1 ZINC001184224913 1051973427 /nfs/dbraw/zinc/97/34/27/1051973427.db2.gz RIVBNICBOYTMIS-UHFFFAOYSA-N -1 3 337.391 4.007 20 0 EIADHM C[C@@H]1C[C@H](NC(=O)c2ccc([O-])cc2C(F)(F)F)CC(C)(C)C1 ZINC001193757984 1051991994 /nfs/dbraw/zinc/99/19/94/1051991994.db2.gz IXOYMCTULRMJMU-MNOVXSKESA-N -1 3 329.362 4.356 20 0 EIADHM CCCCOc1ccc(C(=O)N[C@@H]2CCCc3ccccc32)c([O-])c1 ZINC001184402095 1052004172 /nfs/dbraw/zinc/00/41/72/1052004172.db2.gz DHSHWYHJEARPTG-LJQANCHMSA-N -1 3 339.435 4.379 20 0 EIADHM O=C(Nc1cc([O-])cc(Cl)c1)c1cncc(-c2ccsc2)c1 ZINC001193993292 1052056580 /nfs/dbraw/zinc/05/65/80/1052056580.db2.gz WKNOIJHVTJNEKH-UHFFFAOYSA-N -1 3 330.796 4.421 20 0 EIADHM O=C(Nc1cc([O-])cc(Cl)c1)c1cc(F)ccc1N1CCCC1 ZINC001194467737 1052151286 /nfs/dbraw/zinc/15/12/86/1052151286.db2.gz NFKFCQACFUWBOS-UHFFFAOYSA-N -1 3 334.778 4.037 20 0 EIADHM O=C(Nc1ccc(F)c(F)c1)Nc1ccc([O-])c(Br)c1 ZINC001185089559 1052164944 /nfs/dbraw/zinc/16/49/44/1052164944.db2.gz IIPDKWRBNHRYPV-UHFFFAOYSA-N -1 3 343.127 4.077 20 0 EIADHM Cc1cccc(C)c1S(=O)(=O)[N-]c1ccc(C(F)(F)F)cc1 ZINC001194602062 1052176139 /nfs/dbraw/zinc/17/61/39/1052176139.db2.gz DVZULGOAMCABCA-UHFFFAOYSA-N -1 3 329.343 4.123 20 0 EIADHM CC(C)c1ccc(CN(C(=O)Cc2ccc([O-])c(F)c2)C2CC2)cc1 ZINC000622284912 1052180275 /nfs/dbraw/zinc/18/02/75/1052180275.db2.gz UFVWHSCEPFPUHK-UHFFFAOYSA-N -1 3 341.426 4.388 20 0 EIADHM Cc1cccc(C)c1S(=O)(=O)[N-]c1cccc(-c2cccnc2)c1 ZINC001194634613 1052181972 /nfs/dbraw/zinc/18/19/72/1052181972.db2.gz XFRZEVWBMAKLCJ-UHFFFAOYSA-N -1 3 338.432 4.166 20 0 EIADHM CCCN(Cc1ccccc1)C(=O)c1cc([O-])cc(C(F)(F)F)c1 ZINC000622290492 1052184816 /nfs/dbraw/zinc/18/48/16/1052184816.db2.gz DARVMRVUURWHAI-UHFFFAOYSA-N -1 3 337.341 4.463 20 0 EIADHM Cc1cccc(C)c1S(=O)(=O)[N-]c1ccc2nc(Cl)ccc2c1 ZINC001194644992 1052185907 /nfs/dbraw/zinc/18/59/07/1052185907.db2.gz VXYVMBJHTFPNMN-UHFFFAOYSA-N -1 3 346.839 4.306 20 0 EIADHM O=C(c1cc([O-])cc(C(F)(F)F)c1)N1CCc2ccc(Cl)cc21 ZINC000622335665 1052214410 /nfs/dbraw/zinc/21/44/10/1052214410.db2.gz OIXHDPIOJCZCGJ-UHFFFAOYSA-N -1 3 341.716 4.267 20 0 EIADHM O=C(CCc1cc(Cl)ccc1Br)[N-]OC1CCCC1 ZINC000774869119 1052232804 /nfs/dbraw/zinc/23/28/04/1052232804.db2.gz QGCCSLZNMUDZDZ-UHFFFAOYSA-N -1 3 346.652 4.026 20 0 EIADHM Cc1ccc(C(F)(F)F)cc1NC(=O)Cc1ccc([O-])c(F)c1 ZINC000622407283 1052248387 /nfs/dbraw/zinc/24/83/87/1052248387.db2.gz OGRKNGQPUWDKBF-UHFFFAOYSA-N -1 3 327.277 4.040 20 0 EIADHM CCc1ccc([O-])c(C(=O)N(C)[C@H](CC)Cc2ccc(C)cc2)c1 ZINC000622395998 1052252325 /nfs/dbraw/zinc/25/23/25/1052252325.db2.gz AKFALOLHCBELSQ-GOSISDBHSA-N -1 3 325.452 4.356 20 0 EIADHM Cc1cc(S(=O)(=O)[N-]c2ccc(F)c(C)c2C)ccc1Cl ZINC001185530125 1052257483 /nfs/dbraw/zinc/25/74/83/1052257483.db2.gz UFBFFZWHPJTENR-UHFFFAOYSA-N -1 3 327.808 4.205 20 0 EIADHM C[C@H]1c2cc(Cl)cc(Cl)c2CCN1C(=O)c1ccccc1[O-] ZINC000622425558 1052261557 /nfs/dbraw/zinc/26/15/57/1052261557.db2.gz HAFBKNIJLWXNMD-JTQLQIEISA-N -1 3 336.218 4.459 20 0 EIADHM CCc1cccc(C(=O)Nc2cnn(CC(C)C)c2C(C)C)c1[O-] ZINC000622475229 1052285577 /nfs/dbraw/zinc/28/55/77/1052285577.db2.gz TWCZPPOXCVBGMX-UHFFFAOYSA-N -1 3 329.444 4.183 20 0 EIADHM C[C@H](CC(F)(F)F)NC(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000622514961 1052310964 /nfs/dbraw/zinc/31/09/64/1052310964.db2.gz GSXYXEIZFGJBCZ-GFCCVEGCSA-N -1 3 337.341 4.054 20 0 EIADHM O=C(Cc1ccc([O-])c(F)c1)Nc1cc(Cl)cc(C(F)(F)F)c1 ZINC000622520518 1052313384 /nfs/dbraw/zinc/31/33/84/1052313384.db2.gz WNUYYCDJYKCPLR-UHFFFAOYSA-N -1 3 347.695 4.385 20 0 EIADHM CCc1nc(NC(=O)Cc2ccc([O-])c(F)c2)sc1C(C)(C)C ZINC000622697250 1052379690 /nfs/dbraw/zinc/37/96/90/1052379690.db2.gz UPSOHEMAMLXVTE-UHFFFAOYSA-N -1 3 336.432 4.029 20 0 EIADHM CC(C)[C@@H](Oc1cccc(Cl)c1)C(=O)Nc1cccc([O-])c1F ZINC000180019200 1052773978 /nfs/dbraw/zinc/77/39/78/1052773978.db2.gz SMAPPCSDFRSPMX-MRXNPFEDSA-N -1 3 337.778 4.227 20 0 EIADHM CCc1ccc([O-])c(C(=O)N(C)[C@@H](C)c2nc3ccccc3s2)c1 ZINC000180335061 1052794091 /nfs/dbraw/zinc/79/40/91/1052794091.db2.gz QQWVZGRGPDPZHN-LBPRGKRZSA-N -1 3 340.448 4.398 20 0 EIADHM C[C@@H](NCc1ccccc1[N+](=O)[O-])c1ccc(Cl)c(Cl)c1[O-] ZINC000185935708 1052828063 /nfs/dbraw/zinc/82/80/63/1052828063.db2.gz XUGRURGCIYILFW-SECBINFHSA-N -1 3 341.194 4.458 20 0 EIADHM Cc1nc(-c2ccc(Cl)s2)sc1C(=O)[N-]c1cnoc1 ZINC000623938980 1052839658 /nfs/dbraw/zinc/83/96/58/1052839658.db2.gz YDPJKOGNCSODRB-UHFFFAOYSA-N -1 3 325.802 4.074 20 0 EIADHM COc1ccc2c(c1)oc(C(=O)[N-]c1cnoc1)c2-c1ccccc1 ZINC000623940164 1052840209 /nfs/dbraw/zinc/84/02/09/1052840209.db2.gz UEKBYHYYSQGQIA-UHFFFAOYSA-N -1 3 334.331 4.349 20 0 EIADHM CCN(Cc1ccccc1Cl)Cc1cc(=O)oc2cc([O-])ccc12 ZINC000764187276 1053040989 /nfs/dbraw/zinc/04/09/89/1053040989.db2.gz MIVQWWANMJIOFP-UHFFFAOYSA-N -1 3 343.810 4.174 20 0 EIADHM CC(C)(NCc1cc(=O)oc2cc([O-])c(Cl)cc12)c1ccccc1 ZINC000794553931 1053070515 /nfs/dbraw/zinc/07/05/15/1053070515.db2.gz GKSBDTOLNGUKIJ-UHFFFAOYSA-N -1 3 343.810 4.177 20 0 EIADHM CC(C)(C)OC(=O)c1ccc(NC(=O)Oc2ccc(F)cc2)c([O-])c1 ZINC001195044451 1053242143 /nfs/dbraw/zinc/24/21/43/1053242143.db2.gz UICQXGAXCGQFHB-UHFFFAOYSA-N -1 3 347.342 4.098 20 0 EIADHM Cc1ccc(-c2ccc(C)cc2C(=O)Nc2cc(=O)[n-]c(C)n2)cc1 ZINC001195685040 1053451207 /nfs/dbraw/zinc/45/12/07/1053451207.db2.gz LAEDWMNHQYKKHB-UHFFFAOYSA-N -1 3 333.391 4.027 20 0 EIADHM Cc1ccc(-c2ccc(C)cc2C(=O)NCc2ncccc2[O-])cc1 ZINC001195698026 1053465167 /nfs/dbraw/zinc/46/51/67/1053465167.db2.gz NWUWBNOKVGGSLD-UHFFFAOYSA-N -1 3 332.403 4.001 20 0 EIADHM Cc1ccc(NCc2cccc(C(F)(F)F)c2C)cc1-c1nnn[n-]1 ZINC001168541688 1053573982 /nfs/dbraw/zinc/57/39/82/1053573982.db2.gz CAKBUZIDQILZQC-UHFFFAOYSA-N -1 3 347.344 4.114 20 0 EIADHM Cc1ccc(NCc2cccc(C(F)(F)F)c2C)cc1-c1nn[n-]n1 ZINC001168541688 1053573998 /nfs/dbraw/zinc/57/39/98/1053573998.db2.gz CAKBUZIDQILZQC-UHFFFAOYSA-N -1 3 347.344 4.114 20 0 EIADHM Cc1sc2[n-]c([C@H](C)OC(=O)[C@@H](C)CC(C)C)nc(=O)c2c1C ZINC000765527010 1053620506 /nfs/dbraw/zinc/62/05/06/1053620506.db2.gz IJZWDHPWWHWSLC-ONGXEEELSA-N -1 3 336.457 4.300 20 0 EIADHM CC(C)Sc1c(Cl)cccc1[N-]C(=O)c1csc(CO)n1 ZINC000866039130 1053632329 /nfs/dbraw/zinc/63/23/29/1053632329.db2.gz QINJJNSHPDGSKT-UHFFFAOYSA-N -1 3 342.873 4.042 20 0 EIADHM [O-]c1cc(NC(=S)Nc2ccc(Br)cc2)ccc1F ZINC001196621498 1053716247 /nfs/dbraw/zinc/71/62/47/1053716247.db2.gz YLUOFSIRPWDVOD-UHFFFAOYSA-N -1 3 341.205 4.103 20 0 EIADHM Cn1ccnc1-c1cccc(NC(=O)c2cc([O-])c3ccccc3c2)c1 ZINC000471784190 1053722667 /nfs/dbraw/zinc/72/26/67/1053722667.db2.gz ZQCDNIZOBADCMF-UHFFFAOYSA-N -1 3 343.386 4.198 20 0 EIADHM CC(C)Oc1c(Cl)cc(C(=O)Nc2cncc([O-])c2)cc1Cl ZINC001197192183 1053849969 /nfs/dbraw/zinc/84/99/69/1053849969.db2.gz NUALGJWYKAGRMI-UHFFFAOYSA-N -1 3 341.194 4.134 20 0 EIADHM CC(C)CCc1nnc([N-]C(=O)c2nc(Cl)ccc2Cl)s1 ZINC000855190241 1053885485 /nfs/dbraw/zinc/88/54/85/1053885485.db2.gz UXUSSPCSWZQONP-UHFFFAOYSA-N -1 3 345.255 4.081 20 0 EIADHM Cc1cc2cc(NCc3cc(=O)oc4c(C)c([O-])ccc34)ccc2[nH]1 ZINC000113307715 1053917095 /nfs/dbraw/zinc/91/70/95/1053917095.db2.gz ZMLFGLGCEMZWHZ-UHFFFAOYSA-N -1 3 334.375 4.209 20 0 EIADHM Cc1ccc2ccccc2c1[N-]S(=O)(=O)Cc1c(F)cccc1F ZINC001197556025 1053938334 /nfs/dbraw/zinc/93/83/34/1053938334.db2.gz DTQPXRZLYAOAED-UHFFFAOYSA-N -1 3 347.386 4.368 20 0 EIADHM O=C([N-]c1nnc(Cc2ccccc2)s1)c1sccc1Cl ZINC000671664910 1053964720 /nfs/dbraw/zinc/96/47/20/1053964720.db2.gz UCFLXPNUEHPAAJ-UHFFFAOYSA-N -1 3 335.841 4.096 20 0 EIADHM O=C(NC1CCC2(CC2(F)F)CC1)c1cc2sccc2c([O-])c1 ZINC000855960016 1054002157 /nfs/dbraw/zinc/00/21/57/1054002157.db2.gz BPVYHCPPLVABRT-UHFFFAOYSA-N -1 3 337.391 4.305 20 0 EIADHM O=C(NCC1([C@H]2CCCCO2)CCC1)c1cc2sccc2c([O-])c1 ZINC000871045821 1054148340 /nfs/dbraw/zinc/14/83/40/1054148340.db2.gz RMRNANHZZYZBLX-QGZVFWFLSA-N -1 3 345.464 4.076 20 0 EIADHM Cc1cc2cccc(C(=O)Nc3cc(Br)ccc3[O-])c2[nH]1 ZINC001198571773 1054186741 /nfs/dbraw/zinc/18/67/41/1054186741.db2.gz QLAAVEJYLQENRQ-UHFFFAOYSA-N -1 3 345.196 4.197 20 0 EIADHM O=C(NCCOC1CCCCCC1)c1cc([O-])c2ccccc2c1 ZINC000472151502 1054215469 /nfs/dbraw/zinc/21/54/69/1054215469.db2.gz DCPNTNZFWZCSJG-UHFFFAOYSA-N -1 3 327.424 4.015 20 0 EIADHM CC(C)(C)SCSc1nc2c(cnn2-c2ccccc2)c(=O)[n-]1 ZINC000871626828 1054234728 /nfs/dbraw/zinc/23/47/28/1054234728.db2.gz WICUGTCYXQKZFO-UHFFFAOYSA-N -1 3 346.481 4.102 20 0 EIADHM CC[C@@H](C)C(=O)Nc1cccc(CN[C@@H](C)c2cccc([O-])c2F)c1 ZINC000872046645 1054360605 /nfs/dbraw/zinc/36/06/05/1054360605.db2.gz KBNUICLKLJPUEH-KGLIPLIRSA-N -1 3 344.430 4.367 20 0 EIADHM Cc1cc(C)n(-c2ccc(C(=O)Nc3ccc(Cl)cc3[O-])cc2)n1 ZINC000339007489 1054366115 /nfs/dbraw/zinc/36/61/15/1054366115.db2.gz NXKHWHFOOHPCRG-UHFFFAOYSA-N -1 3 341.798 4.100 20 0 EIADHM CCOc1ccc2c(c1)[C@H](N[C@H](C)c1cccc([O-])c1F)CCO2 ZINC000872062896 1054372281 /nfs/dbraw/zinc/37/22/81/1054372281.db2.gz LNTGNQMQZCIEEA-MLGOLLRUSA-N -1 3 331.387 4.104 20 0 EIADHM C[C@@H](N[C@H]1CCc2ccccc2-n2ccnc21)c1cccc([O-])c1F ZINC000872089007 1054385529 /nfs/dbraw/zinc/38/55/29/1054385529.db2.gz XRKKZVRAUFYCKV-CJNGLKHVSA-N -1 3 337.398 4.055 20 0 EIADHM C[C@@H](N[C@@H](CCO)c1ccc(Cl)c(F)c1)c1cccc([O-])c1F ZINC000872093668 1054386767 /nfs/dbraw/zinc/38/67/67/1054386767.db2.gz WCUCVJJZWBXGOR-BMIGLBTASA-N -1 3 341.785 4.098 20 0 EIADHM O=C([O-])c1ccc(CN2CCC(c3ccc(F)cc3)CC2)c(F)c1 ZINC000872163351 1054416777 /nfs/dbraw/zinc/41/67/77/1054416777.db2.gz DVLFVZHVGWRULB-UHFFFAOYSA-N -1 3 331.362 4.043 20 0 EIADHM Cc1nc(C2CCN(C/C=C/c3ccccc3)CC2)sc1C(=O)[O-] ZINC000872165557 1054417880 /nfs/dbraw/zinc/41/78/80/1054417880.db2.gz YDLYDDYTHPIGEW-VMPITWQZSA-N -1 3 342.464 4.043 20 0 EIADHM Cc1nc(C2CCN([C@@H](C)c3cccc(F)c3)CC2)sc1C(=O)[O-] ZINC000872165292 1054418465 /nfs/dbraw/zinc/41/84/65/1054418465.db2.gz RFOJUVPJJPZMNU-LBPRGKRZSA-N -1 3 348.443 4.229 20 0 EIADHM Cc1nc(C2CCN([C@H](C)c3cccc(F)c3)CC2)sc1C(=O)[O-] ZINC000872165291 1054419003 /nfs/dbraw/zinc/41/90/03/1054419003.db2.gz RFOJUVPJJPZMNU-GFCCVEGCSA-N -1 3 348.443 4.229 20 0 EIADHM CC(=O)c1cccc(OCCCC(=O)Nc2cc(Cl)ccc2[O-])c1 ZINC000057550139 1054532440 /nfs/dbraw/zinc/53/24/40/1054532440.db2.gz SDEVFZDAIMWQBT-UHFFFAOYSA-N -1 3 347.798 4.046 20 0 EIADHM Cc1sc2[n-]c([C@H](C)OC(=O)C3CCC=CCC3)nc(=O)c2c1C ZINC000873428681 1054536866 /nfs/dbraw/zinc/53/68/66/1054536866.db2.gz JFYGYAKQASVPID-NSHDSACASA-N -1 3 346.452 4.364 20 0 EIADHM Cc1ccc(NC(=S)Nc2ccc(F)cc2F)c(Cl)c1[O-] ZINC001200932710 1054583483 /nfs/dbraw/zinc/58/34/83/1054583483.db2.gz JQEFKNKLKOFQJX-UHFFFAOYSA-N -1 3 328.771 4.441 20 0 EIADHM O=c1cc(NC(=S)Nc2cccc(Cl)c2)[n-]n1-c1ccccc1 ZINC001201096540 1054656938 /nfs/dbraw/zinc/65/69/38/1054656938.db2.gz MXXGYUFEQGFMDW-UHFFFAOYSA-N -1 3 344.827 4.040 20 0 EIADHM C[C@@H](CC(=O)[N-]OCc1ccc(C(F)(F)F)cc1)c1ccco1 ZINC000860313155 1054800437 /nfs/dbraw/zinc/80/04/37/1054800437.db2.gz UONSOPAXNZVQCJ-NSHDSACASA-N -1 3 327.302 4.040 20 0 EIADHM C[C@H](OC(=O)c1cc(Cl)c(Cl)[n-]1)C(=O)c1ccc(Cl)cc1 ZINC000021730691 1054936164 /nfs/dbraw/zinc/93/61/64/1054936164.db2.gz WTTQUYNPVXTFIR-ZETCQYMHSA-N -1 3 346.597 4.403 20 0 EIADHM Cc1ccccc1-c1nc(C(=O)[N-]c2nnc(C(C)C)s2)cs1 ZINC000066279074 1054993349 /nfs/dbraw/zinc/99/33/49/1054993349.db2.gz LRZLKGLDQLNGEU-UHFFFAOYSA-N -1 3 344.465 4.346 20 0 EIADHM CC[C@@H](C)[C@H](NC(=O)c1cc([O-])c2ccccc2c1)C(F)(F)F ZINC000473229202 1055013866 /nfs/dbraw/zinc/01/38/66/1055013866.db2.gz IERJHJZCMZWPLI-BMIGLBTASA-N -1 3 325.330 4.252 20 0 EIADHM Cc1cccc(C)c1NC(=O)Nc1ccc(Br)cc1[O-] ZINC001202207751 1055084444 /nfs/dbraw/zinc/08/44/44/1055084444.db2.gz NRFFJZLRPUZBOS-UHFFFAOYSA-N -1 3 335.201 4.416 20 0 EIADHM CC1(c2nsc([N-]C(=O)c3cc4cccc(Cl)c4o3)n2)CC1 ZINC000862610731 1055090922 /nfs/dbraw/zinc/09/09/22/1055090922.db2.gz WNOYATISYHHGPY-UHFFFAOYSA-N -1 3 333.800 4.242 20 0 EIADHM COc1cccc(NC(=O)Nc2ccc(C(F)(F)F)cc2[O-])c1 ZINC001202277128 1055121626 /nfs/dbraw/zinc/12/16/26/1055121626.db2.gz NVPBOKDPEYSWLV-UHFFFAOYSA-N -1 3 326.274 4.064 20 0 EIADHM CC(=O)c1cccc([O-])c1NC(=O)Nc1ccc(Br)cc1 ZINC001202336307 1055143789 /nfs/dbraw/zinc/14/37/89/1055143789.db2.gz KREJAWOFSYTFNH-UHFFFAOYSA-N -1 3 349.184 4.001 20 0 EIADHM CC(C)OC(=O)OCSc1nnc([N-]c2ccccc2F)s1 ZINC000863228067 1055166069 /nfs/dbraw/zinc/16/60/69/1055166069.db2.gz CWZXNZDRTJXEGG-UHFFFAOYSA-N -1 3 343.405 4.032 20 0 EIADHM COc1ccc(NC(=O)Nc2c([O-])cccc2C(F)(F)F)cc1 ZINC001202393940 1055169256 /nfs/dbraw/zinc/16/92/56/1055169256.db2.gz MBDGEANRISQXFP-UHFFFAOYSA-N -1 3 326.274 4.064 20 0 EIADHM C[C@@H]1CCN(Cc2nnc(-c3ccccc3[O-])o2)[C@@H](c2ccco2)C1 ZINC000878151860 1055195773 /nfs/dbraw/zinc/19/57/73/1055195773.db2.gz DOFZQVCPRYDKIA-UKRRQHHQSA-N -1 3 339.395 4.008 20 0 EIADHM CC(C)[C@H]1c2ccccc2CCN1Cc1nnc(-c2ccccc2[O-])o1 ZINC000878195127 1055200831 /nfs/dbraw/zinc/20/08/31/1055200831.db2.gz NVAYWVNXVGSFJU-FQEVSTJZSA-N -1 3 349.434 4.198 20 0 EIADHM C[C@@H](c1ccccc1Br)N1CCC(CCC(=O)[O-])CC1 ZINC000086755869 1055270179 /nfs/dbraw/zinc/27/01/79/1055270179.db2.gz JBRRJWXKRKOFHJ-LBPRGKRZSA-N -1 3 340.261 4.087 20 0 EIADHM [O-]c1ccccc1-c1nnc(CN[C@@H](CC2CCC2)c2ccccc2)o1 ZINC000878383181 1055282084 /nfs/dbraw/zinc/28/20/84/1055282084.db2.gz KIRPGEDVYZLDQQ-SFHVURJKSA-N -1 3 349.434 4.463 20 0 EIADHM Cc1sc2[n-]c([C@H](C)OC(=O)[C@H]3CC[C@H](C)C3)nc(=O)c2c1C ZINC000776424621 1055291905 /nfs/dbraw/zinc/29/19/05/1055291905.db2.gz PMRWWNFXDYOYCG-PEXQALLHSA-N -1 3 334.441 4.054 20 0 EIADHM [O-]c1ccccc1-c1nnc(CN2CCCC[C@H]2c2ccccc2)o1 ZINC000878434286 1055310488 /nfs/dbraw/zinc/31/04/88/1055310488.db2.gz UOQLFZBKELCWKT-KRWDZBQOSA-N -1 3 335.407 4.169 20 0 EIADHM Cc1ccc(C)c(OC2CCN(C(=O)c3c(C)cccc3[O-])CC2)c1 ZINC000624571550 1055370015 /nfs/dbraw/zinc/37/00/15/1055370015.db2.gz HQVZUUBALJLRAP-UHFFFAOYSA-N -1 3 339.435 4.001 20 0 EIADHM Cc1cc(C(=O)Nc2c([O-])cccc2Cl)c(C)n1CC(F)(F)F ZINC000655110854 1055480879 /nfs/dbraw/zinc/48/08/79/1055480879.db2.gz RDOUFXBOIKHUFR-UHFFFAOYSA-N -1 3 346.736 4.279 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1cc(F)cc(Br)c1 ZINC000111210456 1056773021 /nfs/dbraw/zinc/77/30/21/1056773021.db2.gz IYMLFQYCNZDWHT-UHFFFAOYSA-N -1 3 344.567 4.200 20 0 EIADHM Cc1ccc(F)c([N-]S(=O)(=O)c2ccc(Cl)c(Cl)c2)c1 ZINC000007428479 1056794082 /nfs/dbraw/zinc/79/40/82/1056794082.db2.gz WBGUWVTVVASDRL-UHFFFAOYSA-N -1 3 334.199 4.242 20 0 EIADHM CCCCc1ccc(NC(=S)NCc2ccc([O-])c(F)c2)cc1 ZINC000737461280 1058553470 /nfs/dbraw/zinc/55/34/70/1058553470.db2.gz LQNKMLBYHCJQEU-UHFFFAOYSA-N -1 3 332.444 4.361 20 0 EIADHM Cc1cc(CO[N-]C(=O)CCC2CCCCC2)c2ccccc2n1 ZINC000742358070 1058569966 /nfs/dbraw/zinc/56/99/66/1058569966.db2.gz YLCSKCVPQVYCQL-UHFFFAOYSA-N -1 3 326.440 4.452 20 0 EIADHM Cc1cc(C(=O)Nc2ccc(Cl)cc2[O-])c(Br)s1 ZINC000036463393 1059255277 /nfs/dbraw/zinc/25/52/77/1059255277.db2.gz KDCUQZOUZUEQJN-UHFFFAOYSA-N -1 3 346.633 4.430 20 0 EIADHM CC[C@H](CC(=O)Oc1cccc(-c2nc(C)cc(=O)[n-]2)c1)C(C)C ZINC000744216448 1059335080 /nfs/dbraw/zinc/33/50/80/1059335080.db2.gz HECUDIBHANGHFF-CQSZACIVSA-N -1 3 328.412 4.135 20 0 EIADHM CC[C@@H](CC(=O)Oc1cccc(-c2nc(C)cc(=O)[n-]2)c1)C(C)C ZINC000744216447 1059335786 /nfs/dbraw/zinc/33/57/86/1059335786.db2.gz HECUDIBHANGHFF-AWEZNQCLSA-N -1 3 328.412 4.135 20 0 EIADHM O=C(OCc1ncc(-c2ccccc2F)o1)c1cc2ccsc2[n-]1 ZINC000744542827 1059573637 /nfs/dbraw/zinc/57/36/37/1059573637.db2.gz QSMGOGUSBODJCD-UHFFFAOYSA-N -1 3 342.351 4.381 20 0 EIADHM COC(Cc1ccccc1Nc1c(Cl)ccc([O-])c1F)OC ZINC001214561334 1060311532 /nfs/dbraw/zinc/31/15/32/1060311532.db2.gz HCQVRRAIZCRHMR-UHFFFAOYSA-N -1 3 325.767 4.090 20 0 EIADHM CCc1cc2c(CN3CC[C@@H]3c3ccccc3)cc(=O)oc2cc1[O-] ZINC000746457147 1060352123 /nfs/dbraw/zinc/35/21/23/1060352123.db2.gz JBWOANAEWFZBKH-GOSISDBHSA-N -1 3 335.403 4.008 20 0 EIADHM COc1cc(C)c([N-]S(=O)(=O)c2cccc(C(F)F)c2)cc1C ZINC000766584936 1060641923 /nfs/dbraw/zinc/64/19/23/1060641923.db2.gz NDCDTWXPJPAQAV-UHFFFAOYSA-N -1 3 341.379 4.050 20 0 EIADHM CCOC(=O)c1cc(Cl)cnc1Nc1ccc(Cl)c([O-])c1 ZINC001212589640 1060786438 /nfs/dbraw/zinc/78/64/38/1060786438.db2.gz WUIKNVZAEHIXQN-UHFFFAOYSA-N -1 3 327.167 4.014 20 0 EIADHM COC(=O)Cc1ccc(Cl)c(Nc2ccc(Cl)c([O-])c2)c1 ZINC001212593731 1060911684 /nfs/dbraw/zinc/91/16/84/1060911684.db2.gz HSGNGCAHCSHZSK-UHFFFAOYSA-N -1 3 326.179 4.158 20 0 EIADHM O=S(=O)([N-]c1cc(F)c(F)cc1F)c1ccc2ccccc2c1 ZINC000105389838 1032122869 /nfs/dbraw/zinc/12/28/69/1032122869.db2.gz DUMDBFMTUUQAQM-UHFFFAOYSA-N -1 3 337.322 4.058 20 0 EIADHM CC[C@H](CC(F)(F)F)C(=O)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000450088383 1032289951 /nfs/dbraw/zinc/28/99/51/1032289951.db2.gz PVBAEGWDHYENCS-SSDOTTSWSA-N -1 3 329.240 4.328 20 0 EIADHM O=C(CCC(=O)c1ccc(-c2ccccc2)cc1)Nc1ncccc1[O-] ZINC000302812426 1032512672 /nfs/dbraw/zinc/51/26/72/1032512672.db2.gz GGLLZZWUTUANKP-UHFFFAOYSA-N -1 3 346.386 4.056 20 0 EIADHM O=C(c1cc(Oc2ccccc2)ccc1[O-])N1CC[C@]2(CC2(F)F)C1 ZINC000653003857 1032573675 /nfs/dbraw/zinc/57/36/75/1032573675.db2.gz GBSGWPABSSBEBC-SFHVURJKSA-N -1 3 345.345 4.056 20 0 EIADHM Cc1nccn1-c1ccc([C@@H](C)NCc2cccc([O-])c2Cl)cc1 ZINC000339295344 1018761281 /nfs/dbraw/zinc/76/12/81/1018761281.db2.gz NSQDPJIGYROPOD-CYBMUJFWSA-N -1 3 341.842 4.391 20 0 EIADHM Cc1cc(F)cc2c(=O)c(C(=O)Nc3ccc4ccccc4c3)c[n-]c12 ZINC000157485309 1018823645 /nfs/dbraw/zinc/82/36/45/1018823645.db2.gz JMILMBILCBRWSX-UHFFFAOYSA-N -1 3 346.361 4.381 20 0 EIADHM Cc1ncn(-c2ccc(NCc3cccc([O-])c3Cl)cc2)c1C ZINC000339409605 1018853963 /nfs/dbraw/zinc/85/39/63/1018853963.db2.gz XPFHYNGEEXILLG-UHFFFAOYSA-N -1 3 327.815 4.460 20 0 EIADHM COC(C)(C)c1nc(C)c(C(=O)[N-]c2c(C)noc2C(C)C)s1 ZINC001626337512 1018869587 /nfs/dbraw/zinc/86/95/87/1018869587.db2.gz WNJJTCFIYIWONZ-UHFFFAOYSA-N -1 3 337.445 4.005 20 0 EIADHM CC(C)CCOc1ccc(CNCc2cccc(C(=O)[O-])c2)cc1 ZINC000683170595 1019083215 /nfs/dbraw/zinc/08/32/15/1019083215.db2.gz HJYAHZRAEVOWGB-UHFFFAOYSA-N -1 3 327.424 4.100 20 0 EIADHM Cc1ccc(F)c([N-]S(=O)(=O)c2cc(C)c(F)cc2Cl)c1 ZINC000471137956 1019094479 /nfs/dbraw/zinc/09/44/79/1019094479.db2.gz XTJZNIXGEIAJBW-UHFFFAOYSA-N -1 3 331.771 4.036 20 0 EIADHM O=C(Nc1ccc(-n2ccnc2)c(Cl)c1)c1cc([O-])ccc1Cl ZINC000339551321 1019202836 /nfs/dbraw/zinc/20/28/36/1019202836.db2.gz UGEZKXHZUWYIGG-UHFFFAOYSA-N -1 3 348.189 4.137 20 0 EIADHM CCc1noc(C)c1[N-]C(=O)c1cc(F)c(C(F)(F)F)c(F)c1 ZINC000683211303 1019397040 /nfs/dbraw/zinc/39/70/40/1019397040.db2.gz DZHSITNLFHYMEP-UHFFFAOYSA-N -1 3 334.244 4.095 20 0 EIADHM O=C(Nc1ccc(Cl)cc1[O-])c1ccccc1Oc1cccnc1 ZINC000153699798 1020379899 /nfs/dbraw/zinc/37/98/99/1020379899.db2.gz INRLKUXOZIEZNO-UHFFFAOYSA-N -1 3 340.766 4.485 20 0 EIADHM Cc1ccc(SC[C@H](C)NC(=O)c2cc([O-])ccc2Cl)cc1 ZINC000500784896 1032915558 /nfs/dbraw/zinc/91/55/58/1032915558.db2.gz DLXSQQZMZGWLOO-LBPRGKRZSA-N -1 3 335.856 4.265 20 0 EIADHM Cc1noc(C)c1[N-]C(=O)c1csc(-c2ccc(Cl)s2)n1 ZINC000340264842 1020696237 /nfs/dbraw/zinc/69/62/37/1020696237.db2.gz QOGHLACTQXDWRF-UHFFFAOYSA-N -1 3 339.829 4.382 20 0 EIADHM [O-]c1ccc(CN=c2[nH]c3cc(Cl)cc(Cl)c3o2)cc1F ZINC000432839533 1032936564 /nfs/dbraw/zinc/93/65/64/1032936564.db2.gz MPTXHEJQCAEMGA-UHFFFAOYSA-N -1 3 327.142 4.013 20 0 EIADHM CC(C)c1ccc(-c2nc([C@@H]3COc4ccccc4O3)no2)c([O-])c1 ZINC000683592446 1020950309 /nfs/dbraw/zinc/95/03/09/1020950309.db2.gz BRUJRXBOMSGHFO-KRWDZBQOSA-N -1 3 338.363 4.078 20 0 EIADHM COC(=O)c1c(F)ccc(Nc2cccc(Cl)c2[O-])c1Cl ZINC001210223598 1020962003 /nfs/dbraw/zinc/96/20/03/1020962003.db2.gz UIZQNXHKRGAQAI-UHFFFAOYSA-N -1 3 330.142 4.368 20 0 EIADHM O=C(NC1CCC2(CCOCC2)CC1)c1cc([O-])c2ccccc2c1 ZINC000376100515 1021451126 /nfs/dbraw/zinc/45/11/26/1021451126.db2.gz VLRKHAAYMAMAQD-UHFFFAOYSA-N -1 3 339.435 4.015 20 0 EIADHM CSc1ccc([O-])c(C(=O)N2CCc3ccc(F)cc3[C@H](C)C2)c1 ZINC000616567221 1021545330 /nfs/dbraw/zinc/54/53/30/1021545330.db2.gz LNJCTQRTYKAKCW-GFCCVEGCSA-N -1 3 345.439 4.055 20 0 EIADHM Cc1cnc([C@H](C)/N=C/c2cc(Br)ccc2[O-])s1 ZINC000175894667 1021657548 /nfs/dbraw/zinc/65/75/48/1021657548.db2.gz HZOVAEUSILORMY-HXBVQPGFSA-N -1 3 325.231 4.100 20 0 EIADHM O=C(NCC1(c2ccc(F)cc2)CCCC1)c1cc([O-])ccc1Cl ZINC000431740180 1021713091 /nfs/dbraw/zinc/71/30/91/1021713091.db2.gz OFIMMJBNFGOKRL-UHFFFAOYSA-N -1 3 347.817 4.427 20 0 EIADHM CCCCOc1ccc(CCNC(=O)c2cc([O-])ccc2Cl)cc1 ZINC000431742725 1021725139 /nfs/dbraw/zinc/72/51/39/1021725139.db2.gz VFRNZMHBSXLGCG-UHFFFAOYSA-N -1 3 347.842 4.197 20 0 EIADHM CC(=O)c1ccc(C(=O)Nc2ccc(F)cc2OC(C)(C)C)cc1[O-] ZINC000613155048 1021766796 /nfs/dbraw/zinc/76/67/96/1021766796.db2.gz RRVYAEXLPLWZPE-UHFFFAOYSA-N -1 3 345.370 4.164 20 0 EIADHM C[C@H](NC(=O)c1cc([O-])ccc1Cl)c1cccc(OC(F)F)c1 ZINC000431753495 1021775491 /nfs/dbraw/zinc/77/54/91/1021775491.db2.gz NYUCVBPRQKAMMT-VIFPVBQESA-N -1 3 341.741 4.138 20 0 EIADHM O=C(Nc1ccccc1OCC(F)(F)F)c1cc([O-])ccc1Cl ZINC000431802291 1021879283 /nfs/dbraw/zinc/87/92/83/1021879283.db2.gz WJYFAYVUJRDZFT-UHFFFAOYSA-N -1 3 345.704 4.239 20 0 EIADHM COc1nnc([N-]C(=O)c2ccc(-c3cccc(C(C)C)c3)o2)s1 ZINC000683904407 1021898434 /nfs/dbraw/zinc/89/84/34/1021898434.db2.gz AWDARVIUSMPBSL-UHFFFAOYSA-N -1 3 343.408 4.182 20 0 EIADHM C[C@H](c1ccccc1Br)N1CCC[C@H](CCC(=O)[O-])C1 ZINC000086809576 1021976732 /nfs/dbraw/zinc/97/67/32/1021976732.db2.gz CTKQASCBTLOYRI-CHWSQXEVSA-N -1 3 340.261 4.087 20 0 EIADHM O=C(N[C@H](c1nccs1)c1ccccc1)c1cc([O-])ccc1Cl ZINC000377891504 1022077839 /nfs/dbraw/zinc/07/78/39/1022077839.db2.gz CBDRQJJYHYSZMZ-HNNXBMFYSA-N -1 3 344.823 4.022 20 0 EIADHM Cc1cc(Oc2ccc(NC(=O)c3cc([O-])ccc3Cl)cc2)n[nH]1 ZINC000431854214 1022090951 /nfs/dbraw/zinc/09/09/51/1022090951.db2.gz MYUVJDLDARXQSR-UHFFFAOYSA-N -1 3 343.770 4.122 20 0 EIADHM CC(C)c1scnc1NC(=O)c1cc([O-])cc(C(F)(F)F)c1 ZINC000623027194 1022108794 /nfs/dbraw/zinc/10/87/94/1022108794.db2.gz BDSWRAZNBJKYKX-UHFFFAOYSA-N -1 3 330.331 4.243 20 0 EIADHM CCN(C(=O)c1cc(SC)ccc1[O-])[C@H](C)Cc1ccsc1 ZINC000613699944 1022752610 /nfs/dbraw/zinc/75/26/10/1022752610.db2.gz FTVKZXDCAMPCJI-GFCCVEGCSA-N -1 3 335.494 4.269 20 0 EIADHM COc1ccc([C@@H](NC(=O)c2cc([O-])ccc2Cl)C(C)C)cc1 ZINC000582033642 1022768374 /nfs/dbraw/zinc/76/83/74/1022768374.db2.gz MTWCLQUOEOTYNS-KRWDZBQOSA-N -1 3 333.815 4.181 20 0 EIADHM CCCN(CCc1cccs1)C(=O)c1cc(SC)ccc1[O-] ZINC000613550843 1022988309 /nfs/dbraw/zinc/98/83/09/1022988309.db2.gz LVPILQZHJMXVBP-UHFFFAOYSA-N -1 3 335.494 4.271 20 0 EIADHM O=C(CCCc1ccc(F)c(F)c1)Nc1c([O-])cccc1Cl ZINC000581339324 1023035138 /nfs/dbraw/zinc/03/51/38/1023035138.db2.gz RYLAJPIITDRQAU-UHFFFAOYSA-N -1 3 325.742 4.285 20 0 EIADHM Cc1cc(F)cc(-c2noc(C=C([O-])c3ccccc3Cl)n2)c1F ZINC001211647092 1023216639 /nfs/dbraw/zinc/21/66/39/1023216639.db2.gz HATPZHRHNHVEFU-UHFFFAOYSA-N -1 3 348.736 4.402 20 0 EIADHM [O-]C(=Cc1nc(-c2ccc3ccncc3c2)no1)c1ccccc1Cl ZINC001211647554 1023229039 /nfs/dbraw/zinc/22/90/39/1023229039.db2.gz VJTNJAVIWCSMBO-UHFFFAOYSA-N -1 3 349.777 4.364 20 0 EIADHM Cc1nc(C(C)C)sc1[C@@H](C)N(C)Cc1ccccc1C(=O)[O-] ZINC000584724428 1023245620 /nfs/dbraw/zinc/24/56/20/1023245620.db2.gz BZCRUCCOGTVGER-CYBMUJFWSA-N -1 3 332.469 4.466 20 0 EIADHM CC(C)=CCSC[C@H](NCc1cc(Cl)ccc1Cl)C(=O)[O-] ZINC000417627944 1023388075 /nfs/dbraw/zinc/38/80/75/1023388075.db2.gz QATRCCNWYBBPBF-AWEZNQCLSA-N -1 3 348.295 4.236 20 0 EIADHM Cc1ccc2ncc(CN3CC[C@H](C(=O)[O-])[C@@H]4CCCC[C@H]43)cc2c1 ZINC000656765114 1023509568 /nfs/dbraw/zinc/50/95/68/1023509568.db2.gz IXYCBNNYUIMPQN-CMKODMSKSA-N -1 3 338.451 4.009 20 0 EIADHM O=C([O-])[C@@H]1CCN(Cc2ccc(Cl)c(Cl)c2)[C@H]2CCCC[C@H]12 ZINC000656764925 1023509630 /nfs/dbraw/zinc/50/96/30/1023509630.db2.gz LRTODGJOYWRETO-IOASZLSFSA-N -1 3 342.266 4.459 20 0 EIADHM C[C@@H]1c2ccsc2CCN1C(=O)CCCc1ccc([O-])c(F)c1 ZINC000468586175 1023537370 /nfs/dbraw/zinc/53/73/70/1023537370.db2.gz MOMIWMOOUWIEKZ-GFCCVEGCSA-N -1 3 333.428 4.061 20 0 EIADHM CN(CC[C@@H](C(=O)[O-])c1ccccc1)Cc1ccc(F)cc1Cl ZINC000565106347 1023608693 /nfs/dbraw/zinc/60/86/93/1023608693.db2.gz XTLMMIQXOKEGNE-MRXNPFEDSA-N -1 3 335.806 4.169 20 0 EIADHM CC(C)(CC(=O)Nc1ccc(Br)cc1[O-])C(F)(F)F ZINC000581859315 1023775099 /nfs/dbraw/zinc/77/50/99/1023775099.db2.gz ZEWTUMAZQQAHNR-UHFFFAOYSA-N -1 3 340.139 4.072 20 0 EIADHM C[C@@H](CC(=O)[N-]OCc1ccc(F)cc1)c1c[nH]c2ccccc21 ZINC000785272640 1024275134 /nfs/dbraw/zinc/27/51/34/1024275134.db2.gz NHQXNMDMVHFUPP-ZDUSSCGKSA-N -1 3 326.371 4.049 20 0 EIADHM COCc1nc(C(=O)[N-]c2ccccc2SC(F)(F)F)cs1 ZINC000065065420 1024356559 /nfs/dbraw/zinc/35/65/59/1024356559.db2.gz MEPYXIAKMCFYLQ-UHFFFAOYSA-N -1 3 348.371 4.154 20 0 EIADHM CCCC1(C(=O)Nc2cccc(-c3nc(CC)cc(=O)[n-]3)c2)CCC1 ZINC000468901863 1024494164 /nfs/dbraw/zinc/49/41/64/1024494164.db2.gz JQFOFGYJYUFCHE-UHFFFAOYSA-N -1 3 339.439 4.321 20 0 EIADHM CCCCCc1nnc([N-]C(=O)c2csc(-c3ccoc3)n2)s1 ZINC000341774363 1024645169 /nfs/dbraw/zinc/64/51/69/1024645169.db2.gz SCTJEMPXWAZBCB-UHFFFAOYSA-N -1 3 348.453 4.240 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2cccc(Cl)c2F)cc1Cl ZINC000048653628 1024676288 /nfs/dbraw/zinc/67/62/88/1024676288.db2.gz UJPQXZPXKCQXKZ-UHFFFAOYSA-N -1 3 334.199 4.242 20 0 EIADHM O=S(=O)([N-]c1cc(F)cc(F)c1F)c1ccc2ccccc2c1 ZINC000431160952 1024741278 /nfs/dbraw/zinc/74/12/78/1024741278.db2.gz CTHYSRQFYNPMRU-UHFFFAOYSA-N -1 3 337.322 4.058 20 0 EIADHM O=C([O-])c1cccc(Br)c1CN(C1CC1)C1CCCC1 ZINC000652388257 1024801560 /nfs/dbraw/zinc/80/15/60/1024801560.db2.gz GEXYATUOXKLNBE-UHFFFAOYSA-N -1 3 338.245 4.054 20 0 EIADHM O=C([O-])[C@H]1CN(C[C@@H]2CC[C@@H](c3ccccc3)C2)Cc2ccccc21 ZINC000662222185 1024974919 /nfs/dbraw/zinc/97/49/19/1024974919.db2.gz DVYKJKCLIXXTOZ-BLIXFSHQSA-N -1 3 335.447 4.254 20 0 EIADHM [O-]c1ccc(OCc2ccccc2)cc1-c1nc(-c2ccncc2)no1 ZINC000184863987 1024980214 /nfs/dbraw/zinc/98/02/14/1024980214.db2.gz RKIKYVFOBPLJAP-UHFFFAOYSA-N -1 3 345.358 4.083 20 0 EIADHM CC(C)Cc1nnc([N-]C(=O)c2c(Cl)cc(F)cc2Cl)s1 ZINC000277265958 1025426856 /nfs/dbraw/zinc/42/68/56/1025426856.db2.gz RIGLPGFOKVYAJL-UHFFFAOYSA-N -1 3 348.230 4.435 20 0 EIADHM CC(C)CC[C@@H](NC(=O)c1cc(=O)c2ccccc2[n-]1)C(C)(C)C ZINC000604364432 1025524573 /nfs/dbraw/zinc/52/45/73/1025524573.db2.gz WASNIMYMGRYMMS-GOSISDBHSA-N -1 3 328.456 4.109 20 0 EIADHM CC[C@H](c1ccc(Cl)cc1)N1CC[C@](C(=O)[O-])(C(F)(F)F)C1 ZINC000315815574 1025784351 /nfs/dbraw/zinc/78/43/51/1025784351.db2.gz DZWILUMNJSBZOX-OCCSQVGLSA-N -1 3 335.753 4.130 20 0 EIADHM O=S(=O)([N-]c1ccc(Cl)cc1F)c1cccc2ccccc21 ZINC000319815501 1026180953 /nfs/dbraw/zinc/18/09/53/1026180953.db2.gz DGMMMVZGTYEUDJ-UHFFFAOYSA-N -1 3 335.787 4.433 20 0 EIADHM Cc1cc(Br)ccc1CNCc1c(F)ccc([O-])c1F ZINC000511083435 1026258378 /nfs/dbraw/zinc/25/83/78/1026258378.db2.gz ZUCMBTMBDDCXRK-UHFFFAOYSA-N -1 3 342.183 4.031 20 0 EIADHM CC[C@@H](C)c1ccc(S(=O)(=O)[N-]c2cc(C)cnc2Cl)cc1 ZINC000318785548 1026284191 /nfs/dbraw/zinc/28/41/91/1026284191.db2.gz YKHKYHQBWDUDHP-GFCCVEGCSA-N -1 3 338.860 4.358 20 0 EIADHM CC(C)c1ccc(C(=O)N[C@H](c2ccccc2)[C@@H](O)C(C)C)c([O-])c1 ZINC001167866311 1026344385 /nfs/dbraw/zinc/34/43/85/1026344385.db2.gz NWPXYNQNQGDXHS-UXHICEINSA-N -1 3 341.451 4.004 20 0 EIADHM CC(C)c1ccc(C(=O)N[C@@H](c2ccccc2)[C@H](O)C(C)C)c([O-])c1 ZINC001167866312 1026344898 /nfs/dbraw/zinc/34/48/98/1026344898.db2.gz NWPXYNQNQGDXHS-VQTJNVASSA-N -1 3 341.451 4.004 20 0 EIADHM CC1(C)C[C@H](C(=O)Nc2c([O-])cccc2Cl)c2ccccc2O1 ZINC000582369106 1026505650 /nfs/dbraw/zinc/50/56/50/1026505650.db2.gz BCVIAEWXARRJOO-LBPRGKRZSA-N -1 3 331.799 4.329 20 0 EIADHM Cc1ccc2cc(CN[C@H](C(=O)[O-])c3cccc(Cl)c3)ccc2n1 ZINC000426727454 1026508517 /nfs/dbraw/zinc/50/85/17/1026508517.db2.gz OVXCGKWJEDITOD-SFHVURJKSA-N -1 3 340.810 4.112 20 0 EIADHM O=C([O-])[C@@H](NCc1ccc(Cl)c(C(F)(F)F)c1)c1ccccc1 ZINC000426765227 1026531222 /nfs/dbraw/zinc/53/12/22/1026531222.db2.gz LEHKNJFPUQOMBY-AWEZNQCLSA-N -1 3 343.732 4.274 20 0 EIADHM CCCSC[C@H](NCc1ccc(-c2ccccc2)cc1F)C(=O)[O-] ZINC000426782159 1026555097 /nfs/dbraw/zinc/55/50/97/1026555097.db2.gz FXPCHCXVZUQYGD-SFHVURJKSA-N -1 3 347.455 4.179 20 0 EIADHM COC(=O)c1cnc(SCc2ccc(-c3cccs3)cc2)[n-]1 ZINC000432665165 1026696840 /nfs/dbraw/zinc/69/68/40/1026696840.db2.gz GYLICRGOASMGCU-UHFFFAOYSA-N -1 3 330.434 4.217 20 0 EIADHM COc1c(Br)cc(F)cc1Nc1cc([O-])c(F)cc1F ZINC001211712422 1026727725 /nfs/dbraw/zinc/72/77/25/1026727725.db2.gz GXCYXLGBXSXIJD-UHFFFAOYSA-N -1 3 348.118 4.324 20 0 EIADHM O=c1ccnc(C(=Cc2ccc(F)c(Cl)c2)Cc2ccccc2)[n-]1 ZINC000432693178 1026782901 /nfs/dbraw/zinc/78/29/01/1026782901.db2.gz HOFJOKSCNINHAK-RVDMUPIBSA-N -1 3 340.785 4.346 20 0 EIADHM O=c1ccnc(C(=Cc2ccc(F)cc2Cl)Cc2ccccc2)[n-]1 ZINC000432699392 1026790321 /nfs/dbraw/zinc/79/03/21/1026790321.db2.gz YBHZOKFMXJSERI-RVDMUPIBSA-N -1 3 340.785 4.346 20 0 EIADHM [O-]c1cccc(CN2CCC(Nc3ccc(F)cc3)CC2)c1Cl ZINC000507654146 1026862303 /nfs/dbraw/zinc/86/23/03/1026862303.db2.gz RMKMPRZWBSPYCT-UHFFFAOYSA-N -1 3 334.822 4.261 20 0 EIADHM O=C(N=c1cc(-c2ccccc2)[n-][nH]1)c1sccc1-c1ccccc1 ZINC000519998516 1027111760 /nfs/dbraw/zinc/11/17/60/1027111760.db2.gz LJLGGRQLHDUMBE-UHFFFAOYSA-N -1 3 345.427 4.479 20 0 EIADHM Cc1ccc(OCC(=O)Nc2ccc([O-])c(C(F)(F)F)c2)cc1C ZINC000440994767 1027179880 /nfs/dbraw/zinc/17/98/80/1027179880.db2.gz XRXJTIUXZJCWDV-UHFFFAOYSA-N -1 3 339.313 4.045 20 0 EIADHM Cc1nc2c(s1)[C@H]([N-]c1nc(-c3ccc(C)cc3)no1)CCC2 ZINC000302014666 1027185645 /nfs/dbraw/zinc/18/56/45/1027185645.db2.gz FCRXSAPCDPAKMT-CQSZACIVSA-N -1 3 326.425 4.299 20 0 EIADHM CC(C)CCCSc1nc2c(cnn2-c2ccccc2)c(=O)[n-]1 ZINC000302059148 1027201671 /nfs/dbraw/zinc/20/16/71/1027201671.db2.gz RMCYRQWQLFWYQK-UHFFFAOYSA-N -1 3 328.441 4.049 20 0 EIADHM O=C(c1ccc(O)cc1[O-])N1CCC[C@@H]1c1cccc2ccccc21 ZINC000034777354 1027303341 /nfs/dbraw/zinc/30/33/41/1027303341.db2.gz DBGMFYKYOBLITL-LJQANCHMSA-N -1 3 333.387 4.228 20 0 EIADHM CCN(CCc1ccccc1)[C@H](C(=O)[O-])c1c(F)cccc1Cl ZINC000566359062 1027363887 /nfs/dbraw/zinc/36/38/87/1027363887.db2.gz PNSYXYDTMDAOHW-KRWDZBQOSA-N -1 3 335.806 4.169 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(NCC(C(C)C)C(C)C)nc2)n1 ZINC000302804795 1027401035 /nfs/dbraw/zinc/40/10/35/1027401035.db2.gz FHGCDXPVRITYAA-UHFFFAOYSA-N -1 3 328.460 4.147 20 0 EIADHM CC(C)NC(=S)Nc1ccc([O-])c(-c2nc3ccccc3s2)c1 ZINC000007582978 1027440053 /nfs/dbraw/zinc/44/00/53/1027440053.db2.gz WXXKCVFVIYRCAT-UHFFFAOYSA-N -1 3 343.477 4.364 20 0 EIADHM NC(=O)c1cc(-c2ccccc2)sc1Nc1cc(F)c([O-])c(F)c1 ZINC001213375075 1027504579 /nfs/dbraw/zinc/50/45/79/1027504579.db2.gz OIXYENHJKTYMOX-UHFFFAOYSA-N -1 3 346.358 4.241 20 0 EIADHM O=C([O-])[C@@H]1CCCN([C@@H](c2ccc(F)cc2)c2ccc(Cl)cc2)C1 ZINC000003750393 1027800754 /nfs/dbraw/zinc/80/07/54/1027800754.db2.gz XLMZGOFPMDJNNY-CRAIPNDOSA-N -1 3 347.817 4.365 20 0 EIADHM O=C(OCc1ncc(-c2ccc(Cl)cc2)o1)c1ccc([O-])cc1 ZINC000007164917 1027822500 /nfs/dbraw/zinc/82/25/00/1027822500.db2.gz FLGHRADUDQGESJ-UHFFFAOYSA-N -1 3 329.739 4.058 20 0 EIADHM CCC(CC)c1nnc([N-]C(=O)c2csc(C(C)(C)C)n2)s1 ZINC000522484533 1027871491 /nfs/dbraw/zinc/87/14/91/1027871491.db2.gz RCUUUILWIKLFDC-UHFFFAOYSA-N -1 3 338.502 4.448 20 0 EIADHM O=C(c1ccccc1[O-])N1CCCC[C@H]1c1nc(-c2ccccc2)c[nH]1 ZINC000188713294 1028022079 /nfs/dbraw/zinc/02/20/79/1028022079.db2.gz GZZRHXIBWQTFNG-SFHVURJKSA-N -1 3 347.418 4.150 20 0 EIADHM CCSc1ccc(Cl)cc1[N-]C(=O)c1ccc2nccnc2n1 ZINC000343272239 1028132199 /nfs/dbraw/zinc/13/21/99/1028132199.db2.gz SWVVIMZZHHYNQC-UHFFFAOYSA-N -1 3 344.827 4.043 20 0 EIADHM O=S(=O)([N-]c1ccsc1Cl)c1cccc(C(F)(F)F)c1 ZINC000189733943 1028212198 /nfs/dbraw/zinc/21/21/98/1028212198.db2.gz VBVCYSHUWLCPPV-UHFFFAOYSA-N -1 3 341.763 4.221 20 0 EIADHM O=C1c2cc(Cl)ccc2N[C@@H](c2ccc([O-])cc2F)N1CC1CC1 ZINC000639415444 1028362618 /nfs/dbraw/zinc/36/26/18/1028362618.db2.gz XMRLXDAUQDXVKT-QGZVFWFLSA-N -1 3 346.789 4.161 20 0 EIADHM CCc1nc2c(s1)[C@H](N(C)Cc1ccc(F)cc1C(=O)[O-])CCC2 ZINC000583327340 1028512111 /nfs/dbraw/zinc/51/21/11/1028512111.db2.gz JXAKKJKNMAVRCW-OAHLLOKOSA-N -1 3 348.443 4.052 20 0 EIADHM [O-]c1cc2ccccc2cc1-c1nc(Cc2ccc(F)c(F)c2)no1 ZINC000445449000 1028537518 /nfs/dbraw/zinc/53/75/18/1028537518.db2.gz XLRLLYYFIANFCY-UHFFFAOYSA-N -1 3 338.313 4.464 20 0 EIADHM [O-]c1ccc(Cc2ccccc2)cc1-c1nc(-c2cncs2)no1 ZINC000445593550 1028779842 /nfs/dbraw/zinc/77/98/42/1028779842.db2.gz WIAYVCFZZLRYSZ-UHFFFAOYSA-N -1 3 335.388 4.157 20 0 EIADHM O=C(NC12CCC(C(F)(F)F)(CC1)CC2)c1cc([O-])ccc1Cl ZINC000508544914 1028969643 /nfs/dbraw/zinc/96/96/43/1028969643.db2.gz NNSAHAXFDSUCPZ-UHFFFAOYSA-N -1 3 347.764 4.431 20 0 EIADHM Cc1c(Cl)cc(F)c([N-]C(=O)c2noc3c2CCCCC3)c1F ZINC000446020129 1029082229 /nfs/dbraw/zinc/08/22/29/1029082229.db2.gz KOULKCRXDXVDDI-UHFFFAOYSA-N -1 3 340.757 4.436 20 0 EIADHM Cc1cc(N2CCSCC2)ccc1NCc1ccc([O-])c(F)c1 ZINC000892357167 1029156686 /nfs/dbraw/zinc/15/66/86/1029156686.db2.gz ZBUVUVZGQMSJMI-UHFFFAOYSA-N -1 3 332.444 4.005 20 0 EIADHM Cc1ccc2ccccc2c1CN(C)Cc1nc(=O)c2sccc2[n-]1 ZINC000467476172 1029296198 /nfs/dbraw/zinc/29/61/98/1029296198.db2.gz GNXQHPJCLJYHJB-UHFFFAOYSA-N -1 3 349.459 4.491 20 0 EIADHM Cc1cc(=O)[n-]c([C@H](C)N[C@H](c2ccc(Cl)cc2F)C(C)C)n1 ZINC000192775000 1029387431 /nfs/dbraw/zinc/38/74/31/1029387431.db2.gz LMMBKRCIOSDFBG-ZBEGNZNMSA-N -1 3 337.826 4.331 20 0 EIADHM Cc1noc(C(C)C)c1NC(=O)c1cc([O-])cc(C(F)(F)F)c1 ZINC000928784173 1029395402 /nfs/dbraw/zinc/39/54/02/1029395402.db2.gz AAUKYLNRGBMEIT-UHFFFAOYSA-N -1 3 328.290 4.083 20 0 EIADHM CCSc1ccc(Cl)cc1[N-]C(=O)c1nc(C)ncc1Cl ZINC000525129687 1029468047 /nfs/dbraw/zinc/46/80/47/1029468047.db2.gz NDBOEZVQMSBGKC-UHFFFAOYSA-N -1 3 342.251 4.456 20 0 EIADHM C[C@@H](C(=O)Nc1ccc(Br)cc1[O-])c1cccc(F)c1 ZINC000525161285 1029493655 /nfs/dbraw/zinc/49/36/55/1029493655.db2.gz YFGHWOCHDHZBAC-SECBINFHSA-N -1 3 338.176 4.036 20 0 EIADHM COc1cc(C(=O)Nc2cc(Cl)ccc2[O-])ccc1OCC(C)C ZINC000216606814 1029580570 /nfs/dbraw/zinc/58/05/70/1029580570.db2.gz BRQUEZIGLDUURG-UHFFFAOYSA-N -1 3 349.814 4.341 20 0 EIADHM O=C([O-])c1cnc2ccccc2c1N1CCC(CC(F)(F)F)CC1 ZINC000584116060 1029626397 /nfs/dbraw/zinc/62/63/97/1029626397.db2.gz GFTKKPYMKWJPPP-UHFFFAOYSA-N -1 3 338.329 4.102 20 0 EIADHM O=C(Nc1ccc(OC(F)(F)F)cc1)Nc1ccc([O-])c(F)c1 ZINC000168934116 1029668943 /nfs/dbraw/zinc/66/89/43/1029668943.db2.gz ZREKRXFUBJIWTO-UHFFFAOYSA-N -1 3 330.237 4.074 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N3CCCC[C@@H]3CC(C)C)nc2)n1 ZINC000301745040 1029802638 /nfs/dbraw/zinc/80/26/38/1029802638.db2.gz NRVIEGNUNPBHGN-QGZVFWFLSA-N -1 3 340.471 4.212 20 0 EIADHM O=C([O-])c1ccccc1OCCN1CCC[C@@H]1c1ccc(Cl)cc1 ZINC000183914353 1030043613 /nfs/dbraw/zinc/04/36/13/1030043613.db2.gz XLRWPQTXMUURTE-QGZVFWFLSA-N -1 3 345.826 4.254 20 0 EIADHM CCOc1ccc([C@H](C)NCc2cccc(C(=O)[O-])c2)cc1OCC ZINC000262949062 1030053134 /nfs/dbraw/zinc/05/31/34/1030053134.db2.gz APWWHTAZVILXIA-AWEZNQCLSA-N -1 3 343.423 4.033 20 0 EIADHM CC(C)c1ccc(C(=O)N2C[C@@H](C)O[C@H](c3ccccc3)C2)c([O-])c1 ZINC000143502867 1030072467 /nfs/dbraw/zinc/07/24/67/1030072467.db2.gz UIBFNTRWEIAMTO-QRWLVFNGSA-N -1 3 339.435 4.118 20 0 EIADHM C[C@H]1CC[C@H](C(=O)[O-])CN1CCSc1cc(Cl)ccc1Cl ZINC000396993444 1030190897 /nfs/dbraw/zinc/19/08/97/1030190897.db2.gz BIBNPWZKDGBBSH-QWRGUYRKSA-N -1 3 348.295 4.271 20 0 EIADHM C[C@@H]1CC(C(=O)[O-])C[C@@H](C)N1Cc1coc(-c2ccc(Cl)cc2)n1 ZINC000530178995 1030199793 /nfs/dbraw/zinc/19/97/93/1030199793.db2.gz KHVKOBBMTSVCTB-VXGBXAGGSA-N -1 3 348.830 4.069 20 0 EIADHM COc1ccccc1[C@@H](NCc1cc([O-])cc(F)c1)c1ccco1 ZINC000185583681 1030205598 /nfs/dbraw/zinc/20/55/98/1030205598.db2.gz FASMTVWKTLOZAH-LJQANCHMSA-N -1 3 327.355 4.012 20 0 EIADHM Cc1c(F)c(C(F)(F)F)ccc1C(=O)Nc1cccc([O-])c1F ZINC000526947069 1030342803 /nfs/dbraw/zinc/34/28/03/1030342803.db2.gz QOCSXTXCKNPTED-UHFFFAOYSA-N -1 3 331.240 4.250 20 0 EIADHM O=C(Nc1cc(Br)ccc1[O-])C1(Cc2ccccc2)CC1 ZINC000531253845 1031026692 /nfs/dbraw/zinc/02/66/92/1031026692.db2.gz LBNUAPVDJMERLW-UHFFFAOYSA-N -1 3 346.224 4.116 20 0 EIADHM C[C@H]1C[C@@H]1c1ccc(CN2CCC(c3ccccc3C(=O)[O-])CC2)o1 ZINC000666586636 1031048733 /nfs/dbraw/zinc/04/87/33/1031048733.db2.gz SKNMHKDVUNAYPB-LIRRHRJNSA-N -1 3 339.435 4.481 20 0 EIADHM CCCCc1nnc([N-]C(=O)c2ccsc2C(F)(F)F)s1 ZINC000528135248 1031150360 /nfs/dbraw/zinc/15/03/60/1031150360.db2.gz IRCDRDHCDFKBRP-UHFFFAOYSA-N -1 3 335.376 4.213 20 0 EIADHM CC1(C)CN(C(=O)c2cc([O-])c3ccccc3c2)[C@H]1c1cccnc1 ZINC000359263552 1031182889 /nfs/dbraw/zinc/18/28/89/1031182889.db2.gz NTMLRDROJUXODF-IBGZPJMESA-N -1 3 332.403 4.164 20 0 EIADHM C[C@H](Oc1cc(O)cc([O-])c1Br)c1ccccc1F ZINC001229098258 1031253175 /nfs/dbraw/zinc/25/31/75/1031253175.db2.gz DFXHUXNGSOSHIS-QMMMGPOBSA-N -1 3 327.149 4.139 20 0 EIADHM COc1ccc([C@H](C)Oc2cc(O)cc([O-])c2Br)cc1 ZINC001229098254 1031254754 /nfs/dbraw/zinc/25/47/54/1031254754.db2.gz DERSXSPQQPAOGR-VIFPVBQESA-N -1 3 339.185 4.009 20 0 EIADHM CSc1ccsc1C(=O)[N-]c1nc(-c2ccsc2)ns1 ZINC000109109112 1031297716 /nfs/dbraw/zinc/29/77/16/1031297716.db2.gz RKFVDRBXUVACGE-UHFFFAOYSA-N -1 3 339.492 4.302 20 0 EIADHM Cc1c(Br)ccc([O-])c1NC(=O)[C@H]1CCCC(F)(F)C1 ZINC000452760848 1031314332 /nfs/dbraw/zinc/31/43/32/1031314332.db2.gz WPGXNQNOLFGLNY-VIFPVBQESA-N -1 3 348.187 4.227 20 0 EIADHM CCCC[C@@H](CC)CN1C[C@H]2C[C@@H](C1)N2C(=O)c1ccc([S-])cc1 ZINC001272016708 1031324666 /nfs/dbraw/zinc/32/46/66/1031324666.db2.gz GDUCHSUHFHFGNJ-NXHRZFHOSA-N -1 3 346.540 4.090 20 0 EIADHM COc1cc(F)c([N-]C(=O)c2cc(-c3cccc(F)c3)no2)cc1F ZINC000531574934 1031369466 /nfs/dbraw/zinc/36/94/66/1031369466.db2.gz QMDIYPMMKRALOW-UHFFFAOYSA-N -1 3 348.280 4.020 20 0 EIADHM CCCC[C@H](CC)CN1CCC12CN(C(=O)c1ccc([S-])cc1)C2 ZINC001272017410 1031384148 /nfs/dbraw/zinc/38/41/48/1031384148.db2.gz VCDCOSFJZFSALB-INIZCTEOSA-N -1 3 346.540 4.092 20 0 EIADHM CCOc1cc([C@@H]2Nc3ccccc3C(=O)N2CC)cc(Cl)c1[O-] ZINC000042186090 1031533899 /nfs/dbraw/zinc/53/38/99/1031533899.db2.gz WKUVGKRQFTYUQU-QGZVFWFLSA-N -1 3 346.814 4.031 20 0 EIADHM CCOc1cc(CN2CCO[C@H](c3ccccc3)C2)cc(Cl)c1[O-] ZINC000459309939 1031759491 /nfs/dbraw/zinc/75/94/91/1031759491.db2.gz LSENQWZJZOCWQE-SFHVURJKSA-N -1 3 347.842 4.018 20 0 EIADHM CCCN(Cc1c(F)ccc([O-])c1F)[C@@H]1CCCc2cccnc21 ZINC000512667731 1033670530 /nfs/dbraw/zinc/67/05/30/1033670530.db2.gz FQGJRHVZXBCYOO-MRXNPFEDSA-N -1 3 332.394 4.355 20 0 EIADHM [O-]c1ccc(F)c(CNC[C@@H](c2ccccc2)C(F)(F)F)c1F ZINC000512691661 1033714332 /nfs/dbraw/zinc/71/43/32/1033714332.db2.gz XCDOZUDGBAEJMN-LBPRGKRZSA-N -1 3 331.284 4.106 20 0 EIADHM C[C@@H]1C[C@H](C(F)(F)F)CCN1C(=O)c1cc([O-])c2ccccc2c1 ZINC000295705528 1033807670 /nfs/dbraw/zinc/80/76/70/1033807670.db2.gz CBTAGRQDEHSDJP-BXUZGUMPSA-N -1 3 337.341 4.348 20 0 EIADHM C[C@@H]1C[C@@H](C(F)(F)F)CCN1C(=O)c1cc([O-])c2ccccc2c1 ZINC000295706914 1033808772 /nfs/dbraw/zinc/80/87/72/1033808772.db2.gz CBTAGRQDEHSDJP-RISCZKNCSA-N -1 3 337.341 4.348 20 0 EIADHM Cn1cccc1[C@H]1CCCCCN1C(=O)c1cc([O-])ccc1Cl ZINC000433218837 1034066120 /nfs/dbraw/zinc/06/61/20/1034066120.db2.gz KNCKYMYRGVEIFB-QGZVFWFLSA-N -1 3 332.831 4.142 20 0 EIADHM Cc1ccccc1C[C@@H](C)N(C)Cc1cc(C(=O)[O-])ccc1Cl ZINC000576710738 1034882804 /nfs/dbraw/zinc/88/28/04/1034882804.db2.gz RSJJOGGMEBRAIR-CQSZACIVSA-N -1 3 331.843 4.410 20 0 EIADHM [O-]c1cccc(CN2CCC(N3CCc4ccccc43)CC2)c1Cl ZINC000513513206 1035007257 /nfs/dbraw/zinc/00/72/57/1035007257.db2.gz DBPAVZRLCHKKRR-UHFFFAOYSA-N -1 3 342.870 4.073 20 0 EIADHM O=C(NC[C@H](c1ccccc1)C(F)(F)F)c1cc([O-])ccc1Cl ZINC000501396833 1035435019 /nfs/dbraw/zinc/43/50/19/1035435019.db2.gz RNPXQVDSOJMNHD-CYBMUJFWSA-N -1 3 343.732 4.122 20 0 EIADHM O=C(Nc1ccc(Cl)cc1[O-])c1ccc(OC(F)F)c(F)c1 ZINC000490646475 1035567650 /nfs/dbraw/zinc/56/76/50/1035567650.db2.gz FPCLSNJZSFHXAW-UHFFFAOYSA-N -1 3 331.677 4.038 20 0 EIADHM Cc1cc(C(=O)NC2CCCC2)ccc1NCc1cc([O-])cc(F)c1 ZINC000414454309 1035574401 /nfs/dbraw/zinc/57/44/01/1035574401.db2.gz ARFOXNUACZLXLG-UHFFFAOYSA-N -1 3 342.414 4.124 20 0 EIADHM O=C(CSc1ccccc1Cl)Nc1cc(Cl)ccc1[O-] ZINC000490692046 1035606931 /nfs/dbraw/zinc/60/69/31/1035606931.db2.gz CEBPEZBLBLMVQE-UHFFFAOYSA-N -1 3 328.220 4.430 20 0 EIADHM CC(C)(C)c1nsc([N-]C(=O)c2cc(F)c(F)cc2Cl)n1 ZINC000068073893 1035829819 /nfs/dbraw/zinc/82/98/19/1035829819.db2.gz ITGJSPMRBWKDIN-UHFFFAOYSA-N -1 3 331.775 4.020 20 0 EIADHM C[C@H](NC(=O)c1cc(CCc2ccccc2)ccc1[O-])c1ccccn1 ZINC000586756264 1035835782 /nfs/dbraw/zinc/83/57/82/1035835782.db2.gz IHUOSLFKJFZHGZ-INIZCTEOSA-N -1 3 346.430 4.063 20 0 EIADHM CCc1cccc(Cl)c1CN1CCC(C(=O)[O-])(C(F)(F)F)CC1 ZINC000905739468 1035881287 /nfs/dbraw/zinc/88/12/87/1035881287.db2.gz RXYBSJHLWCNIED-UHFFFAOYSA-N -1 3 349.780 4.132 20 0 EIADHM Cc1cc(C(=O)Nc2cc(Cl)ccc2[O-])c2c(n1)onc2C(C)C ZINC000195695544 1035882696 /nfs/dbraw/zinc/88/26/96/1035882696.db2.gz URCRYNYXIUWBTA-UHFFFAOYSA-N -1 3 345.786 4.266 20 0 EIADHM O=C(Cc1cscc1Br)Nc1cc(Cl)ccc1[O-] ZINC000485502236 1035955489 /nfs/dbraw/zinc/95/54/89/1035955489.db2.gz HPIPHXSWTGDYIP-UHFFFAOYSA-N -1 3 346.633 4.051 20 0 EIADHM C[C@@H](SCc1cc(=O)[n-]c(C2CC2)n1)c1nc2ccccc2o1 ZINC000572017274 1036395264 /nfs/dbraw/zinc/39/52/64/1036395264.db2.gz QEBZIPZEIHZNNN-SNVBAGLBSA-N -1 3 327.409 4.195 20 0 EIADHM CC(C)Cc1ccc(C=Cc2cc(=O)[n-]c(-c3ccncc3)n2)cc1 ZINC000486052858 1036444343 /nfs/dbraw/zinc/44/43/43/1036444343.db2.gz PNNJGAKWKHPMMA-FPLPWBNLSA-N -1 3 331.419 4.201 20 0 EIADHM [O-]c1ccc(Cl)cc1/C=N/CC1(c2ccccc2)CCOCC1 ZINC000032070069 1036446070 /nfs/dbraw/zinc/44/60/70/1036446070.db2.gz HLDVQTIFRWTIQG-FYJGNVAPSA-N -1 3 329.827 4.213 20 0 EIADHM CC(C)Cc1ccc(C=Cc2cc(=O)[n-]c(-c3ccncc3)n2)cc1 ZINC000486052857 1036446274 /nfs/dbraw/zinc/44/62/74/1036446274.db2.gz PNNJGAKWKHPMMA-BQYQJAHWSA-N -1 3 331.419 4.201 20 0 EIADHM O=c1cc(C=Cc2ccc3ccccc3c2)nc(-c2ccncc2)[n-]1 ZINC000486055165 1036460491 /nfs/dbraw/zinc/46/04/91/1036460491.db2.gz YCBJBCCVJWPEKF-VURMDHGXSA-N -1 3 325.371 4.156 20 0 EIADHM O=c1cc(C=Cc2csc3ccccc23)nc(-c2ccncc2)[n-]1 ZINC000486074209 1036473002 /nfs/dbraw/zinc/47/30/02/1036473002.db2.gz IQPREVIUGALEBH-WAYWQWQTSA-N -1 3 331.400 4.217 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1sccc1Br ZINC000502753401 1036619944 /nfs/dbraw/zinc/61/99/44/1036619944.db2.gz ZTIXCTQONNLBNJ-UHFFFAOYSA-N -1 3 332.606 4.122 20 0 EIADHM CCC[C@@H]1CCCC[C@H]1C[N-]S(=O)(=O)c1cccc(Cl)c1F ZINC001212162412 1036976876 /nfs/dbraw/zinc/97/68/76/1036976876.db2.gz MZLIZPRWUOGVEC-OLZOCXBDSA-N -1 3 347.883 4.364 20 0 EIADHM CC(C)c1ccc(/C=C\CC(=O)Nc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000487047586 1036977007 /nfs/dbraw/zinc/97/70/07/1036977007.db2.gz YXMAKOUPEFACEL-ARJAWSKDSA-N -1 3 347.422 4.032 20 0 EIADHM CC(C)c1ccc(/C=C\CC(=O)Nc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000487047586 1036977032 /nfs/dbraw/zinc/97/70/32/1036977032.db2.gz YXMAKOUPEFACEL-ARJAWSKDSA-N -1 3 347.422 4.032 20 0 EIADHM CCS[C@@H]1CCCCN(C(=O)c2cc([O-])cc(C(F)(F)F)c2)C1 ZINC000590436460 1037065623 /nfs/dbraw/zinc/06/56/23/1037065623.db2.gz VHPCUUGSYGVTOO-CQSZACIVSA-N -1 3 347.402 4.159 20 0 EIADHM CCOc1ccccc1C1=CCN(Cc2cccc(C(=O)[O-])c2)CC1 ZINC000414643705 1037610288 /nfs/dbraw/zinc/61/02/88/1037610288.db2.gz XTGWHWWJXFPGQU-UHFFFAOYSA-N -1 3 337.419 4.073 20 0 EIADHM Cc1cccc([C@H](NC(=O)c2cc(=O)c3ccccc3[n-]2)C(C)(C)C)c1 ZINC000488794269 1037755888 /nfs/dbraw/zinc/75/58/88/1037755888.db2.gz JGELVGBMLIPEMS-FQEVSTJZSA-N -1 3 348.446 4.354 20 0 EIADHM CC[C@H](C)N(CC(=O)[O-])Cc1cc(Cl)c(C)cc1Br ZINC000414682385 1037806299 /nfs/dbraw/zinc/80/62/99/1037806299.db2.gz NOPKBSCIMQBANL-JTQLQIEISA-N -1 3 348.668 4.096 20 0 EIADHM Cc1cccc2c1[C@H](C)C[C@H]2CC(=O)NCc1ccc([O-])c(F)c1 ZINC000488990221 1037827197 /nfs/dbraw/zinc/82/71/97/1037827197.db2.gz YCJBPWSKJXNXJH-HIFRSBDPSA-N -1 3 327.399 4.137 20 0 EIADHM CCc1ccc([O-])c(C(=O)N2C[C@H](c3ccc(F)cc3)C[C@@H]2C)c1 ZINC000605896435 1037870328 /nfs/dbraw/zinc/87/03/28/1037870328.db2.gz DCHCONOZPLIJSU-XJKSGUPXSA-N -1 3 327.399 4.112 20 0 EIADHM CC(C)COc1ccccc1CN[C@H](CC(=O)[O-])c1cccs1 ZINC000669472644 1037941305 /nfs/dbraw/zinc/94/13/05/1037941305.db2.gz HYHGYKGJJLKOAW-OAHLLOKOSA-N -1 3 333.453 4.089 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)c1cccc(OC2CCCCC2)c1 ZINC000606536865 1038152691 /nfs/dbraw/zinc/15/26/91/1038152691.db2.gz SJGAHAZGONFNSA-UHFFFAOYSA-N -1 3 343.398 4.173 20 0 EIADHM O=C(N[C@@H]1CC[C@@H](Cc2ccccc2)C1)c1cc([O-])ccc1Cl ZINC000504601831 1038427265 /nfs/dbraw/zinc/42/72/65/1038427265.db2.gz PZKWAUZOMUOCIB-LSDHHAIUSA-N -1 3 329.827 4.187 20 0 EIADHM CC(C)Oc1ccc([N-]S(=O)(=O)c2ccc(F)cc2)cc1Cl ZINC000031721557 1038860716 /nfs/dbraw/zinc/86/07/16/1038860716.db2.gz QLLLBSMWLQUCAT-UHFFFAOYSA-N -1 3 343.807 4.067 20 0 EIADHM CC(C)(C)Oc1cc(-c2nc3cc(Cl)ccc3c(=O)[n-]2)ccn1 ZINC000505110949 1039024924 /nfs/dbraw/zinc/02/49/24/1039024924.db2.gz YHWUPFQPBVFCEB-UHFFFAOYSA-N -1 3 329.787 4.228 20 0 EIADHM CC(=O)c1cccc(NC(=O)[C@@H](Sc2ccccc2)C(C)C)c1[O-] ZINC000552069380 1039096257 /nfs/dbraw/zinc/09/62/57/1039096257.db2.gz PQGNILVLPVYOST-SFHVURJKSA-N -1 3 343.448 4.350 20 0 EIADHM CC(=O)c1cccc(NC(=O)c2cc(F)cc(C(F)(F)F)c2)c1[O-] ZINC000552069142 1039097335 /nfs/dbraw/zinc/09/73/35/1039097335.db2.gz DPKDPIYTYAGKBR-UHFFFAOYSA-N -1 3 341.260 4.005 20 0 EIADHM CC(C)c1ccc(C(=O)N2CC[C@H](C(F)(F)F)C[C@H]2C)c([O-])c1 ZINC000456109538 1039098128 /nfs/dbraw/zinc/09/81/28/1039098128.db2.gz DKLBUSZQYBEMHG-YPMHNXCESA-N -1 3 329.362 4.319 20 0 EIADHM CC(=O)c1cccc(NC(=O)[C@H](C)Sc2ccccc2Cl)c1[O-] ZINC000552286008 1039337457 /nfs/dbraw/zinc/33/74/57/1039337457.db2.gz IROFFAYROWMMAB-NSHDSACASA-N -1 3 349.839 4.368 20 0 EIADHM CCc1ncsc1C(=O)[N-]c1cc(F)ccc1SCC(F)F ZINC000121963611 1039538287 /nfs/dbraw/zinc/53/82/87/1039538287.db2.gz TVBAVNNIKSWGSI-UHFFFAOYSA-N -1 3 346.399 4.454 20 0 EIADHM COc1ccc([O-])c(C(=O)Nc2ccccc2COc2ccccc2)c1 ZINC000537640918 1039674223 /nfs/dbraw/zinc/67/42/23/1039674223.db2.gz AFBWSHXTYMBGIY-UHFFFAOYSA-N -1 3 349.386 4.232 20 0 EIADHM CCC[C@@H](CC)S(=O)(=O)[N-]c1cnn(-c2cc(C)ccc2C)c1C ZINC000555879637 1039779067 /nfs/dbraw/zinc/77/90/67/1039779067.db2.gz PQXGOYYPJNYCQV-MRXNPFEDSA-N -1 3 349.500 4.118 20 0 EIADHM O=C(c1cc([O-])ccc1Cl)N1CCC[C@@H](Cc2ccccc2)C1 ZINC000555921423 1039809396 /nfs/dbraw/zinc/80/93/96/1039809396.db2.gz FPABELIMKGAYHL-HNNXBMFYSA-N -1 3 329.827 4.141 20 0 EIADHM O=C(Cc1ccc(C(F)(F)F)cc1)Nc1c([O-])cccc1Cl ZINC000552780670 1039817969 /nfs/dbraw/zinc/81/79/69/1039817969.db2.gz KPBFQUCVDAPOER-UHFFFAOYSA-N -1 3 329.705 4.246 20 0 EIADHM CCc1ccc([O-])c(C(=O)Nc2cc(NC(=O)C(C)C)ccc2C)c1 ZINC000537655463 1039853754 /nfs/dbraw/zinc/85/37/54/1039853754.db2.gz XXRGDQHEZKIPDZ-UHFFFAOYSA-N -1 3 340.423 4.110 20 0 EIADHM CCc1nc2c(s1)[C@@H](N(C)C(=O)c1cc(CC)ccc1[O-])CCC2 ZINC000537683169 1039901433 /nfs/dbraw/zinc/90/14/33/1039901433.db2.gz HQVNEEWXISGZKK-HNNXBMFYSA-N -1 3 344.480 4.123 20 0 EIADHM C[C@@H](CC(=O)c1ccccc1F)C(=O)Nc1ccc(Cl)cc1[O-] ZINC000535421242 1040253431 /nfs/dbraw/zinc/25/34/31/1040253431.db2.gz VQLMBJAAKGCQMW-JTQLQIEISA-N -1 3 335.762 4.032 20 0 EIADHM CCCc1cc(=O)[n-]c(C(=Cc2ccc(OC(F)F)cc2)CC)n1 ZINC000435341004 1040297451 /nfs/dbraw/zinc/29/74/51/1040297451.db2.gz QRGIEXREXGPIEF-JLHYYAGUSA-N -1 3 334.366 4.274 20 0 EIADHM CC[C@H](NCc1cccc([O-])c1Br)c1cccs1 ZINC000315447496 1040334842 /nfs/dbraw/zinc/33/48/42/1040334842.db2.gz VYGHWCHEOKEZBL-NSHDSACASA-N -1 3 326.259 4.457 20 0 EIADHM CC[C@@H](NCc1cccc([O-])c1Br)c1cccs1 ZINC000315446366 1040336056 /nfs/dbraw/zinc/33/60/56/1040336056.db2.gz VYGHWCHEOKEZBL-LLVKDONJSA-N -1 3 326.259 4.457 20 0 EIADHM C[C@@H]([N-]S(=O)(=O)c1cc(Cl)sc1Cl)c1ccsc1 ZINC000669844546 1040789705 /nfs/dbraw/zinc/78/97/05/1040789705.db2.gz WWWYISQHEHUQPO-ZCFIWIBFSA-N -1 3 342.294 4.156 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N1CC2(CCC2)[C@@H]1c1cccnc1 ZINC000898415650 1040837878 /nfs/dbraw/zinc/83/78/78/1040837878.db2.gz JLUFTCUKOMBQCK-FQEVSTJZSA-N -1 3 344.414 4.308 20 0 EIADHM Cc1cnc([C@@H](NC(=O)c2cc([O-])c3ccccc3c2)C2CC2)s1 ZINC000350006475 1040841981 /nfs/dbraw/zinc/84/19/81/1040841981.db2.gz UXRMRDLGEBYVKR-KRWDZBQOSA-N -1 3 338.432 4.191 20 0 EIADHM CC(C)c1ccc(S(=O)(=O)[N-]c2cncc(Cl)c2Cl)cc1 ZINC000480154668 1041011192 /nfs/dbraw/zinc/01/11/92/1041011192.db2.gz SKAVSESOQCXEHG-UHFFFAOYSA-N -1 3 345.251 4.313 20 0 EIADHM Cc1nc(C(=O)[N-]c2cc(F)cc(F)c2F)c(-c2ccccc2)o1 ZINC000554362020 1041037623 /nfs/dbraw/zinc/03/76/23/1041037623.db2.gz FWKXYBFFCBBNBQ-UHFFFAOYSA-N -1 3 332.281 4.320 20 0 EIADHM CC(C)c1ccc([C@@H]2CCCN2C(=O)N=c2cc3ccccn3[n-]2)cc1 ZINC000554412599 1041092606 /nfs/dbraw/zinc/09/26/06/1041092606.db2.gz DUQNZRARWAPMBE-IBGZPJMESA-N -1 3 348.450 4.249 20 0 EIADHM Cc1ccc(C(F)(F)F)cc1S(=O)(=O)[N-]c1c(C)cccc1F ZINC000461112999 1041245672 /nfs/dbraw/zinc/24/56/72/1041245672.db2.gz LPBBVHYSZKOIOI-UHFFFAOYSA-N -1 3 347.333 4.262 20 0 EIADHM O=C(c1ccc(O)cc1[O-])N1CCCC[C@@H]1CCCc1ccccc1 ZINC000436521513 1041306144 /nfs/dbraw/zinc/30/61/44/1041306144.db2.gz NDXVLHGTILAYIK-QGZVFWFLSA-N -1 3 339.435 4.115 20 0 EIADHM CCCCCN(C(=O)c1cc(OC)c([O-])c(OC)c1)[C@@H](C)CCC ZINC000436536955 1041320388 /nfs/dbraw/zinc/32/03/88/1041320388.db2.gz QSKZYTXDRUMVJT-AWEZNQCLSA-N -1 3 337.460 4.230 20 0 EIADHM CC(=O)c1cccc(NC(=O)c2cc(Oc3ccccc3)ccn2)c1[O-] ZINC000554696628 1041333657 /nfs/dbraw/zinc/33/36/57/1041333657.db2.gz ZBUSUGQNJDLXIA-UHFFFAOYSA-N -1 3 348.358 4.034 20 0 EIADHM CCCN(CCc1ccccn1)C(=O)c1ccc(C(C)C)cc1[O-] ZINC000436541825 1041334985 /nfs/dbraw/zinc/33/49/85/1041334985.db2.gz YXEGEVPYWCEBSD-UHFFFAOYSA-N -1 3 326.440 4.006 20 0 EIADHM CCCCOc1ccc([N-]S(=O)(=O)c2ccc(C)cc2)c(C)c1 ZINC000516019895 1041346096 /nfs/dbraw/zinc/34/60/96/1041346096.db2.gz XFXZMTVOMSLWEO-UHFFFAOYSA-N -1 3 333.453 4.283 20 0 EIADHM CC(C)c1nn(C)cc1NC(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436594210 1041355637 /nfs/dbraw/zinc/35/56/37/1041355637.db2.gz FYRVUVYADHLKJJ-UHFFFAOYSA-N -1 3 349.434 4.092 20 0 EIADHM Cc1csc([C@H](NC(=O)c2ccc(C(C)C)cc2[O-])C2CC2)n1 ZINC000436580640 1041358589 /nfs/dbraw/zinc/35/85/89/1041358589.db2.gz CIHGYIHPLQSCEB-MRXNPFEDSA-N -1 3 330.453 4.162 20 0 EIADHM O=C(c1ccccc1[O-])N(CCc1cccc(F)c1)C1CCCC1 ZINC000436585975 1041360027 /nfs/dbraw/zinc/36/00/27/1041360027.db2.gz KWAQTKGCLIOXGS-UHFFFAOYSA-N -1 3 327.399 4.159 20 0 EIADHM CC(C)c1ccc(C(=O)N2CC(Cc3ccc(F)c(F)c3)C2)c([O-])c1 ZINC000436581303 1041361714 /nfs/dbraw/zinc/36/17/14/1041361714.db2.gz FFIUVKDEDUHSBO-UHFFFAOYSA-N -1 3 345.389 4.109 20 0 EIADHM CC(C)c1ccc(C(=O)N(CCC(F)(F)F)CC2CC2)c([O-])c1 ZINC000436585222 1041363356 /nfs/dbraw/zinc/36/33/56/1041363356.db2.gz PHRQJUGBIQWQOE-UHFFFAOYSA-N -1 3 329.362 4.320 20 0 EIADHM Cc1ccc([C@H]2[C@H](C)CCCN2C(=O)c2ccc(O)cc2[O-])cc1 ZINC000436617631 1041375382 /nfs/dbraw/zinc/37/53/82/1041375382.db2.gz ISRRKBOTDNMBER-AUUYWEPGSA-N -1 3 325.408 4.020 20 0 EIADHM Cc1ccc(C(=O)Nc2cnn(CC(C)C)c2C(C)C)c([O-])c1C ZINC000436620894 1041387440 /nfs/dbraw/zinc/38/74/40/1041387440.db2.gz XCWXWOYPCBBHAC-UHFFFAOYSA-N -1 3 329.444 4.237 20 0 EIADHM CC(C)c1ccc(C(=O)N[C@H]2CCO[C@H](c3ccccc3)C2)c([O-])c1 ZINC000436660010 1041413108 /nfs/dbraw/zinc/41/31/08/1041413108.db2.gz RCLQVDAMTYALEO-PXNSSMCTSA-N -1 3 339.435 4.166 20 0 EIADHM Cc1ccc([O-])c(C(=O)Nc2cccc(Cn3ccnc3C(C)C)c2)c1 ZINC000436711004 1041436794 /nfs/dbraw/zinc/43/67/94/1041436794.db2.gz CEBJDYUQLXDKMQ-UHFFFAOYSA-N -1 3 349.434 4.321 20 0 EIADHM Cc1ccc(C(=O)Nc2cccc(OCc3cccnc3)c2)c([O-])c1C ZINC000436710197 1041438661 /nfs/dbraw/zinc/43/86/61/1041438661.db2.gz RBEZJYLOBMBWMZ-UHFFFAOYSA-N -1 3 348.402 4.235 20 0 EIADHM COc1ccc2cc(-c3nc4cc(F)c(F)cc4c(=O)[n-]3)ccc2c1 ZINC000463217635 1041439777 /nfs/dbraw/zinc/43/97/77/1041439777.db2.gz FUIYOGWXDLBRNV-UHFFFAOYSA-N -1 3 338.313 4.442 20 0 EIADHM CC(C)(C)OC(=O)N=c1[n-]cc(-c2nc(C3CCCC3)no2)s1 ZINC000904351912 1041446451 /nfs/dbraw/zinc/44/64/51/1041446451.db2.gz OFIHBGUPEPGQDW-UHFFFAOYSA-N -1 3 336.417 4.198 20 0 EIADHM CCc1ccc([O-])c(C(=O)N(C)[C@@H](CC)c2cccc(OC)c2)c1 ZINC000436747426 1041461855 /nfs/dbraw/zinc/46/18/55/1041461855.db2.gz ALRQFWSSCZCMDY-SFHVURJKSA-N -1 3 327.424 4.187 20 0 EIADHM C[C@@H]1c2cccn2CCN1C(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436757084 1041467406 /nfs/dbraw/zinc/46/74/06/1041467406.db2.gz TVDUOPWFKQJTTA-MRXNPFEDSA-N -1 3 346.430 4.002 20 0 EIADHM Cc1cccc(C(=O)Nc2cc(F)ccc2OCC(F)(F)F)c1[O-] ZINC000436754659 1041467421 /nfs/dbraw/zinc/46/74/21/1041467421.db2.gz JFFUAFVDJLVISF-UHFFFAOYSA-N -1 3 343.276 4.033 20 0 EIADHM CC(C)c1ccc(C(=O)NCc2cc(-c3ccccc3)no2)c([O-])c1 ZINC000436791339 1041483593 /nfs/dbraw/zinc/48/35/93/1041483593.db2.gz JXFWPTRICFDWGS-UHFFFAOYSA-N -1 3 336.391 4.101 20 0 EIADHM CCN(Cc1cccc(-c2ccncc2)c1)C(=O)c1ccccc1[O-] ZINC000436794010 1041485764 /nfs/dbraw/zinc/48/57/64/1041485764.db2.gz UNCMZFIQNHLSEH-UHFFFAOYSA-N -1 3 332.403 4.117 20 0 EIADHM O=C(c1ccccc1[O-])N1CCC[C@H]1c1ccc(Br)cc1 ZINC000436809056 1041491039 /nfs/dbraw/zinc/49/10/39/1041491039.db2.gz RKGSSOMXTGFMOD-HNNXBMFYSA-N -1 3 346.224 4.132 20 0 EIADHM COC[C@@H](C)Oc1ccc(Cl)cc1NC(=O)c1cccc(C)c1[O-] ZINC000436821068 1041501528 /nfs/dbraw/zinc/50/15/28/1041501528.db2.gz NZEWUDKRQLBINC-GFCCVEGCSA-N -1 3 349.814 4.020 20 0 EIADHM CCc1ccc(C(=O)N2CC=C(c3c(F)cccc3F)CC2)c([O-])c1 ZINC000436839384 1041508870 /nfs/dbraw/zinc/50/88/70/1041508870.db2.gz LVVSSCDXGWZRHW-UHFFFAOYSA-N -1 3 343.373 4.162 20 0 EIADHM CCc1ccc(-c2nc(CSc3ccc(F)cc3)no2)c([O-])c1 ZINC000436840669 1041508986 /nfs/dbraw/zinc/50/89/86/1041508986.db2.gz SPVLUZZEAKCKCB-UHFFFAOYSA-N -1 3 330.384 4.436 20 0 EIADHM CC(C)c1ccc(-c2nc(COc3ccc(F)cc3)no2)c([O-])c1 ZINC000436894814 1041536515 /nfs/dbraw/zinc/53/65/15/1041536515.db2.gz UITCSTRNKXNGME-UHFFFAOYSA-N -1 3 328.343 4.284 20 0 EIADHM COc1cccc(C2(c3noc(-c4ccc(C)cc4[O-])n3)CCC2)c1 ZINC000436889721 1041544021 /nfs/dbraw/zinc/54/40/21/1041544021.db2.gz ZGTGMOBRUHZNPT-UHFFFAOYSA-N -1 3 336.391 4.229 20 0 EIADHM COc1cccc(-c2nc(-c3ccc(OC(C)(C)C)cc3)no2)c1[O-] ZINC000436900432 1041552819 /nfs/dbraw/zinc/55/28/19/1041552819.db2.gz IGCPAJLHMUFFIW-UHFFFAOYSA-N -1 3 340.379 4.295 20 0 EIADHM CC(C)[C@H](c1ccccc1Cl)N(C)C(=O)c1ccc(O)cc1[O-] ZINC000436920821 1041558870 /nfs/dbraw/zinc/55/88/70/1041558870.db2.gz QUZSMQMKLPIIDZ-QGZVFWFLSA-N -1 3 333.815 4.221 20 0 EIADHM CC(C)c1ccc(-c2nc(-c3ccc4c(c3)ncn4C)no2)c([O-])c1 ZINC000436928327 1041561584 /nfs/dbraw/zinc/56/15/84/1041561584.db2.gz ANCLFAWUOJCUSB-UHFFFAOYSA-N -1 3 334.379 4.119 20 0 EIADHM COc1ccc([O-])c(-c2nc(-c3ccc4nc(C)sc4c3)no2)c1 ZINC000436941506 1041568191 /nfs/dbraw/zinc/56/81/91/1041568191.db2.gz DKVGYJVLCZHHOC-UHFFFAOYSA-N -1 3 339.376 4.036 20 0 EIADHM C[C@@H]1CN(C(=O)c2cc(Oc3ccccc3)ccc2[O-])CCC1(F)F ZINC000436941001 1041569105 /nfs/dbraw/zinc/56/91/05/1041569105.db2.gz ZFMYAQXRHLZBEL-CYBMUJFWSA-N -1 3 347.361 4.302 20 0 EIADHM C[C@H](CSCc1noc(-c2ccccc2[O-])n1)c1ccccc1 ZINC000436972314 1041576967 /nfs/dbraw/zinc/57/69/67/1041576967.db2.gz NORPINVERYIIQR-CYBMUJFWSA-N -1 3 326.421 4.479 20 0 EIADHM CN(Cc1coc(-c2ccc(C(=O)[O-])cc2)n1)C1CCCCCC1 ZINC000516576342 1041651030 /nfs/dbraw/zinc/65/10/30/1041651030.db2.gz PWPWBUKGYHXIJA-UHFFFAOYSA-N -1 3 328.412 4.194 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)N[C@@H]1C[C@H]1c1cccc(Cl)c1 ZINC000437206718 1041698289 /nfs/dbraw/zinc/69/82/89/1041698289.db2.gz MGWAXPPYTIODIX-DOTOQJQBSA-N -1 3 347.817 4.180 20 0 EIADHM Cc1ccccc1[N-]S(=O)(=O)c1ccc(OC2CCCC2)cc1 ZINC000096659134 1041919930 /nfs/dbraw/zinc/91/99/30/1041919930.db2.gz WYIFUPGBXUETOH-UHFFFAOYSA-N -1 3 331.437 4.117 20 0 EIADHM Cc1cccc(C(=O)Nc2ccc(-c3cn4c(n3)CCCC4)cc2)c1[O-] ZINC000302946765 1042198803 /nfs/dbraw/zinc/19/88/03/1042198803.db2.gz CUAOPGPDHRDHCB-UHFFFAOYSA-N -1 3 347.418 4.153 20 0 EIADHM Cc1cccc([O-])c1C(=O)N1CCC[C@H]1c1nc2ccccc2s1 ZINC000623592593 1042275131 /nfs/dbraw/zinc/27/51/31/1042275131.db2.gz TYZCZPUZKWXKGH-AWEZNQCLSA-N -1 3 338.432 4.288 20 0 EIADHM COc1ccccc1C[C@H](C)CC(=O)Nc1cc(Cl)ccc1[O-] ZINC000303361333 1042413236 /nfs/dbraw/zinc/41/32/36/1042413236.db2.gz ZTBJBKJUHREBJX-LBPRGKRZSA-N -1 3 333.815 4.262 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])[C@@H]1C[C@]12CCCc1ccccc12 ZINC000439093544 1042496466 /nfs/dbraw/zinc/49/64/66/1042496466.db2.gz HNIBXRLQRXYHFE-KXBFYZLASA-N -1 3 327.811 4.278 20 0 EIADHM CC[C@H](O[C@H]1CCC[C@@H](C)C1)C(=O)Nc1cc(Cl)ccc1[O-] ZINC000439097174 1042497687 /nfs/dbraw/zinc/49/76/87/1042497687.db2.gz LWYFQXWOBNQDAY-FFSVYQOJSA-N -1 3 325.836 4.358 20 0 EIADHM CC=C(C=CC(=O)Nc1cccc(-c2nc(CC)cc(=O)[n-]2)c1)CC ZINC000492111303 1042558523 /nfs/dbraw/zinc/55/85/23/1042558523.db2.gz LSZWLDMASIPJEP-CRISVIQDSA-N -1 3 337.423 4.263 20 0 EIADHM COc1cc(C)c(S(=O)(=O)[N-]c2cccc(C(F)F)c2)cc1C ZINC000509604847 1042687477 /nfs/dbraw/zinc/68/74/77/1042687477.db2.gz UTCJSJSYPLKQPA-UHFFFAOYSA-N -1 3 341.379 4.050 20 0 EIADHM CCOc1ccc(S(=O)(=O)[N-]c2cccc(C(F)F)c2)c(C)c1 ZINC000509604275 1042687529 /nfs/dbraw/zinc/68/75/29/1042687529.db2.gz SNEFWKRKAUHFBX-UHFFFAOYSA-N -1 3 341.379 4.132 20 0 EIADHM O=C(CCc1ccc(OC(F)F)cc1)Nc1cc(Cl)ccc1[O-] ZINC000518795635 1042698641 /nfs/dbraw/zinc/69/86/41/1042698641.db2.gz XLCARFPQQFQGND-UHFFFAOYSA-N -1 3 341.741 4.218 20 0 EIADHM CC(C)(C)[C@@H](NCc1nc(=O)c2sccc2[n-]1)c1ccc(F)cc1 ZINC000298375338 1042809811 /nfs/dbraw/zinc/80/98/11/1042809811.db2.gz GHWWXQZDQYKDDP-INIZCTEOSA-N -1 3 345.443 4.413 20 0 EIADHM CCCCCc1nnc([N-]C(=O)c2scnc2C(C)(C)C)s1 ZINC000176626977 1042814008 /nfs/dbraw/zinc/81/40/08/1042814008.db2.gz ANTNDWIXNQMRDN-UHFFFAOYSA-N -1 3 338.502 4.277 20 0 EIADHM CCCCSc1nc2c(cnn2-c2cccc(Cl)c2)c(=O)[n-]1 ZINC000009521184 1042897656 /nfs/dbraw/zinc/89/76/56/1042897656.db2.gz HFGXYKLNAUXPHQ-UHFFFAOYSA-N -1 3 334.832 4.067 20 0 EIADHM CC[C@@H]1CC[C@@H](C)N1Cc1csc(-c2ccc(C(=O)[O-])cc2)n1 ZINC000520594939 1042918007 /nfs/dbraw/zinc/91/80/07/1042918007.db2.gz YHACEVPGKUKKBP-MLGOLLRUSA-N -1 3 330.453 4.271 20 0 EIADHM O=C([N-]c1nnc(CC2CCCCC2)s1)c1ccoc1Cl ZINC000192305909 1042939252 /nfs/dbraw/zinc/93/92/52/1042939252.db2.gz ODHBARRLLJTDNU-UHFFFAOYSA-N -1 3 325.821 4.160 20 0 EIADHM CSc1ccc(S(=O)(=O)[N-]c2ccccc2F)cc1Cl ZINC000184766232 1043126904 /nfs/dbraw/zinc/12/69/04/1043126904.db2.gz ZROPOPFGYMMOHB-UHFFFAOYSA-N -1 3 331.821 4.002 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N1CC[C@H](COc2ccccc2)C1 ZINC000526923298 1043245412 /nfs/dbraw/zinc/24/54/12/1043245412.db2.gz RULYOSDGVPGWFH-INIZCTEOSA-N -1 3 347.414 4.087 20 0 EIADHM CCC(CC)[C@H]1C[C@H](NC(=O)c2cc([O-])c3ccccc3c2)CCO1 ZINC000527170426 1043252576 /nfs/dbraw/zinc/25/25/76/1043252576.db2.gz IWXDPLAFDMQCQV-YLJYHZDGSA-N -1 3 341.451 4.259 20 0 EIADHM CCOc1ccc(NC(=O)c2cc([O-])c3ccccc3c2)cc1OC ZINC000527453507 1043260468 /nfs/dbraw/zinc/26/04/68/1043260468.db2.gz JMYMIMBVSCRBKD-UHFFFAOYSA-N -1 3 337.375 4.205 20 0 EIADHM O=C(Nc1ccc(OC(F)F)cc1)c1cc([O-])c2ccccc2c1 ZINC000527445217 1043261282 /nfs/dbraw/zinc/26/12/82/1043261282.db2.gz PCTAFQVMHOVYNC-UHFFFAOYSA-N -1 3 329.302 4.399 20 0 EIADHM CCOc1ccc(CN(C)C(=O)c2cc([O-])c3ccccc3c2)cc1 ZINC000527444969 1043261321 /nfs/dbraw/zinc/26/13/21/1043261321.db2.gz LRFNZUGPZKBGBI-UHFFFAOYSA-N -1 3 335.403 4.216 20 0 EIADHM O=C(Nc1ccc(-c2c[nH]cn2)cc1)c1cc([O-])c2ccccc2c1 ZINC000527456815 1043263523 /nfs/dbraw/zinc/26/35/23/1043263523.db2.gz LYSCSPUEPCXCNA-UHFFFAOYSA-N -1 3 329.359 4.188 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)C1(c2cccc(F)c2)CCCCC1 ZINC000427941776 1043269694 /nfs/dbraw/zinc/26/96/94/1043269694.db2.gz HFRMDMOILFQTBH-UHFFFAOYSA-N -1 3 345.389 4.189 20 0 EIADHM CC(C)(C)c1nsc([N-]C(=O)c2cc3c(cccc3F)s2)n1 ZINC000727721236 1043275903 /nfs/dbraw/zinc/27/59/03/1043275903.db2.gz PQMLULQIAUSDRX-UHFFFAOYSA-N -1 3 335.429 4.442 20 0 EIADHM O=c1[n-]c(Oc2ccccc2OCC(F)(F)F)nc2ccccc12 ZINC000727829395 1043311363 /nfs/dbraw/zinc/31/13/63/1043311363.db2.gz POEMYIBSLJRZIQ-UHFFFAOYSA-N -1 3 336.269 4.069 20 0 EIADHM NC(=O)c1cc(-c2ccccc2)sc1Nc1cc(F)cc(F)c1[O-] ZINC001212479478 1043425336 /nfs/dbraw/zinc/42/53/36/1043425336.db2.gz AIYROHIJDPHQLI-UHFFFAOYSA-N -1 3 346.358 4.241 20 0 EIADHM CSc1ccncc1[N-]C(=O)c1cc2c(C(C)C)nn(C)c2s1 ZINC000674255798 1043504195 /nfs/dbraw/zinc/50/41/95/1043504195.db2.gz DYOVLHOWMCIMSU-UHFFFAOYSA-N -1 3 346.481 4.127 20 0 EIADHM Cc1cc(NCc2nc(C(F)(F)F)cc(=O)[n-]2)cc(C)c1Cl ZINC000442131139 1043504796 /nfs/dbraw/zinc/50/47/96/1043504796.db2.gz OFEUVDQEDMESKA-UHFFFAOYSA-N -1 3 331.725 4.083 20 0 EIADHM CSc1ccncc1[N-]C(=O)c1cnc(-c2ccccc2F)s1 ZINC000674256365 1043504986 /nfs/dbraw/zinc/50/49/86/1043504986.db2.gz LKYVTRRXXSRTFC-UHFFFAOYSA-N -1 3 345.424 4.318 20 0 EIADHM CSc1ccncc1[N-]C(=O)c1csc(-c2ccccc2)n1 ZINC000674258686 1043522139 /nfs/dbraw/zinc/52/21/39/1043522139.db2.gz WOINRANJOWDKPC-UHFFFAOYSA-N -1 3 327.434 4.179 20 0 EIADHM C[C@H](CS(=O)(=O)[N-]c1cc(Cl)cc(F)c1F)c1ccccc1 ZINC000442231942 1043561945 /nfs/dbraw/zinc/56/19/45/1043561945.db2.gz AYGPNXXUTPGTDV-SNVBAGLBSA-N -1 3 345.798 4.164 20 0 EIADHM [O-]c1c(F)cc(F)cc1Nc1c(F)cccc1OC[C@H]1CCCO1 ZINC001212491070 1043583234 /nfs/dbraw/zinc/58/32/34/1043583234.db2.gz GTNGOBBVQSXOCY-LLVKDONJSA-N -1 3 339.313 4.111 20 0 EIADHM CC(C)c1cc(=O)oc2cc(Oc3nc4ccccc4c(=O)[n-]3)ccc21 ZINC000731916634 1043845632 /nfs/dbraw/zinc/84/56/32/1043845632.db2.gz QMSBUJWDHBRSKK-UHFFFAOYSA-N -1 3 348.358 4.358 20 0 EIADHM O=c1[n-]c(Oc2cccc(Oc3ccccn3)c2)nc2ccccc21 ZINC000731921625 1043845874 /nfs/dbraw/zinc/84/58/74/1043845874.db2.gz KIYYMQBPBCNCRY-UHFFFAOYSA-N -1 3 331.331 4.315 20 0 EIADHM C[C@H](NC(=O)c1nnc2ccccc2c1[O-])c1csc2ccccc21 ZINC000732289446 1043896082 /nfs/dbraw/zinc/89/60/82/1043896082.db2.gz QYMJJKYLHHQGKK-NSHDSACASA-N -1 3 349.415 4.041 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1cc(Br)cs1 ZINC000195315591 1044057247 /nfs/dbraw/zinc/05/72/47/1044057247.db2.gz ZVLJZDCTZNPUPO-UHFFFAOYSA-N -1 3 332.606 4.122 20 0 EIADHM Cc1sc2[n-]c(COc3ccc4ccccc4c3)nc(=O)c2c1C ZINC000041864308 1044272345 /nfs/dbraw/zinc/27/23/45/1044272345.db2.gz KTFJTTVKIMAHJO-UHFFFAOYSA-N -1 3 336.416 4.334 20 0 EIADHM O=C(c1cc(Cc2ccccc2)ccc1[O-])N1CC(CC(F)(F)F)C1 ZINC000675416041 1044278496 /nfs/dbraw/zinc/27/84/96/1044278496.db2.gz XEFDPVOCJZCFAB-UHFFFAOYSA-N -1 3 349.352 4.007 20 0 EIADHM CC(C)(C)n1cc([N-]c2nc3cc(Br)ccc3o2)cn1 ZINC001212567810 1044360073 /nfs/dbraw/zinc/36/00/73/1044360073.db2.gz SVQOJDLKYRXKIM-UHFFFAOYSA-N -1 3 335.205 4.285 20 0 EIADHM C[C@H](CC(=O)NCc1ccc([O-])c(Br)c1)CC(C)(C)C ZINC000676055691 1044622277 /nfs/dbraw/zinc/62/22/77/1044622277.db2.gz KHXKHSBKHMWQAF-LLVKDONJSA-N -1 3 342.277 4.233 20 0 EIADHM O=C(Nc1ccc(Br)cc1[O-])c1ccccc1Cl ZINC000642324090 1044669759 /nfs/dbraw/zinc/66/97/59/1044669759.db2.gz XIQPEKGENBOBLB-UHFFFAOYSA-N -1 3 326.577 4.060 20 0 EIADHM CC(C)Oc1ccc([N-]S(=O)(=O)c2ccccc2Cl)c(F)c1 ZINC000052025615 1044734979 /nfs/dbraw/zinc/73/49/79/1044734979.db2.gz LMHRCXYNFKIMCU-UHFFFAOYSA-N -1 3 343.807 4.067 20 0 EIADHM C[C@H](c1ccc(F)cc1)N1CCC(C(=O)c2ccc([O-])cc2)CC1 ZINC000078657806 1044809549 /nfs/dbraw/zinc/80/95/49/1044809549.db2.gz JZWJPAKPZHVEJT-CQSZACIVSA-N -1 3 327.399 4.187 20 0 EIADHM Cc1ccc(Cl)c([N-]S(=O)(=O)c2cnc3ccsc3c2)c1 ZINC000474308705 1044849039 /nfs/dbraw/zinc/84/90/39/1044849039.db2.gz VEGDJGOTSLLOAR-UHFFFAOYSA-N -1 3 338.841 4.059 20 0 EIADHM Cc1ccc(C(=O)[C@H](C)OC(=O)c2cc3ccsc3[n-]2)cc1C ZINC000914891873 1044852161 /nfs/dbraw/zinc/85/21/61/1044852161.db2.gz QMVMBNAEGUWBOS-LBPRGKRZSA-N -1 3 327.405 4.274 20 0 EIADHM COc1ccc(Cl)c(S(=O)(=O)[N-]c2cc(C)ccc2Cl)c1 ZINC000474306297 1044852439 /nfs/dbraw/zinc/85/24/39/1044852439.db2.gz FQTPGGSNEJLVDI-UHFFFAOYSA-N -1 3 346.235 4.111 20 0 EIADHM C[C@@H](OC(=O)c1cc2ccsc2[n-]1)C(=O)c1ccc(Cl)cc1 ZINC000914889587 1044852480 /nfs/dbraw/zinc/85/24/80/1044852480.db2.gz JHHYKTIQAUPIQT-SECBINFHSA-N -1 3 333.796 4.311 20 0 EIADHM O=C(Nc1ccccc1-c1cccs1)c1nnc2ccccc2c1[O-] ZINC000735650710 1044853754 /nfs/dbraw/zinc/85/37/54/1044853754.db2.gz QZDCHHYFZVNUAD-UHFFFAOYSA-N -1 3 347.399 4.316 20 0 EIADHM Cc1c([O-])ccc2c(CSC3=Nc4ccccc4C3)cc(=O)oc12 ZINC000735794360 1044867731 /nfs/dbraw/zinc/86/77/31/1044867731.db2.gz UNYVXNXYTILOQM-UHFFFAOYSA-N -1 3 337.400 4.327 20 0 EIADHM O=C([O-])C[C@@H](NCc1ccc(C(F)(F)F)cc1)c1cccs1 ZINC000315393893 1044876826 /nfs/dbraw/zinc/87/68/26/1044876826.db2.gz FTAOKIYKQAVMJM-GFCCVEGCSA-N -1 3 329.343 4.073 20 0 EIADHM [O-]c1ccc(F)c(CNc2cccc(OCC(F)(F)F)c2)c1F ZINC000509331456 1044973886 /nfs/dbraw/zinc/97/38/86/1044973886.db2.gz MYHGXIFIWQVTID-UHFFFAOYSA-N -1 3 333.256 4.224 20 0 EIADHM CSc1cccc(S(=O)(=O)[N-]c2cc(Cl)cc(F)c2F)c1 ZINC000509390024 1045087344 /nfs/dbraw/zinc/08/73/44/1045087344.db2.gz GXCISLLQAMABCE-UHFFFAOYSA-N -1 3 349.811 4.141 20 0 EIADHM O=C(C[C@@H]1CCCN1Cc1cccc([O-])c1Cl)c1ccc(F)cc1 ZINC000509084698 1045089539 /nfs/dbraw/zinc/08/95/39/1045089539.db2.gz PWUKZLRLKYQTIA-INIZCTEOSA-N -1 3 347.817 4.422 20 0 EIADHM Cc1cc(C(=O)Nc2ccc(Br)cc2[O-])c(C)s1 ZINC000075654738 1045201475 /nfs/dbraw/zinc/20/14/75/1045201475.db2.gz CHVTZCIMXVEKDK-UHFFFAOYSA-N -1 3 326.215 4.085 20 0 EIADHM O=C(CSCc1ccc(F)cc1)Nc1ccc(Cl)cc1[O-] ZINC000611101770 1045250995 /nfs/dbraw/zinc/25/09/95/1045250995.db2.gz IUTIWPDNHPFKSD-UHFFFAOYSA-N -1 3 325.792 4.057 20 0 EIADHM O=C(Nc1cccc(-n2ccnc2)c1)c1cc2sccc2c([O-])c1 ZINC000791327222 1045722884 /nfs/dbraw/zinc/72/28/84/1045722884.db2.gz QSELZVDGFMXEHR-UHFFFAOYSA-N -1 3 335.388 4.045 20 0 EIADHM COc1ccc([C@H](C)N(C)C(=O)c2cc3sccc3c([O-])c2)cc1 ZINC000791309767 1045724505 /nfs/dbraw/zinc/72/45/05/1045724505.db2.gz AOMZLTVNJRGQGA-LBPRGKRZSA-N -1 3 341.432 4.449 20 0 EIADHM C[C@@H](CC(=O)c1cccs1)NC(=O)c1cc2sccc2c([O-])c1 ZINC000791385832 1045728293 /nfs/dbraw/zinc/72/82/93/1045728293.db2.gz ADPZPSFZALZGLA-JTQLQIEISA-N -1 3 345.445 4.060 20 0 EIADHM CC[C@@](C)(NC(=O)c1cc2sccc2c([O-])c1)c1nccs1 ZINC000791366634 1045731207 /nfs/dbraw/zinc/73/12/07/1045731207.db2.gz LCMBEJMNWSDUBU-MRXNPFEDSA-N -1 3 332.450 4.119 20 0 EIADHM COc1ccc(Br)cc1Nc1ccc([O-])c(F)c1F ZINC001212007691 1045829615 /nfs/dbraw/zinc/82/96/15/1045829615.db2.gz XVDIPOXGVQDWKH-UHFFFAOYSA-N -1 3 330.128 4.185 20 0 EIADHM [O-]c1ccc(Nc2ccc(OC[C@H]3CCCO3)c(F)c2)c(F)c1F ZINC001212009467 1045831577 /nfs/dbraw/zinc/83/15/77/1045831577.db2.gz PSXCWEBMORJOOU-LLVKDONJSA-N -1 3 339.313 4.111 20 0 EIADHM [O-]c1ccc(Nc2cccc(F)c2OC[C@@H]2CCCO2)c(F)c1F ZINC001212016323 1045839616 /nfs/dbraw/zinc/83/96/16/1045839616.db2.gz KEOJYDCSEJTEKX-JTQLQIEISA-N -1 3 339.313 4.111 20 0 EIADHM C[C@H](NC(=O)c1cc([O-])c2ccccc2c1)c1ccc(F)c(F)c1 ZINC000792025117 1045851472 /nfs/dbraw/zinc/85/14/72/1045851472.db2.gz SHWRZFWRJKXVGD-NSHDSACASA-N -1 3 327.330 4.315 20 0 EIADHM CCc1ccc(O)c([N-]S(=O)(=O)/C=C\c2cccc(Cl)c2)c1 ZINC000768886154 1045852546 /nfs/dbraw/zinc/85/25/46/1045852546.db2.gz BINFNHRLWPXUSY-HJWRWDBZSA-N -1 3 337.828 4.021 20 0 EIADHM CCOc1cc(CNc2ccc(NC(C)=O)cc2)cc(Cl)c1[O-] ZINC000076275251 1045881722 /nfs/dbraw/zinc/88/17/22/1045881722.db2.gz WCXGVZDBHNWPLW-UHFFFAOYSA-N -1 3 334.803 4.015 20 0 EIADHM CCN(C[C@@H](O)c1ccc(C)cc1)C(=O)c1cc([O-])c2ccccc2c1 ZINC000792213816 1045881776 /nfs/dbraw/zinc/88/17/76/1045881776.db2.gz KZCLVHUCCGPOQN-OAQYLSRUSA-N -1 3 349.430 4.050 20 0 EIADHM O=C([N-]Cc1ccc(C(F)(F)F)cc1)C(F)(F)c1ccccc1 ZINC000916042677 1045884987 /nfs/dbraw/zinc/88/49/87/1045884987.db2.gz BSQSIPYINSKIHE-UHFFFAOYSA-N -1 3 329.268 4.114 20 0 EIADHM O=C([O-])[C@@H]1CCN(Cc2cc(Cl)ccc2Cl)[C@@H]2CCC[C@@H]21 ZINC000629374934 1045900644 /nfs/dbraw/zinc/90/06/44/1045900644.db2.gz XEHUBNISLKSXSJ-UMVBOHGHSA-N -1 3 328.239 4.069 20 0 EIADHM CCc1ccc(C(=O)Nc2n[n-]c(-c3cc4ccccc4o3)n2)s1 ZINC000792482520 1045900851 /nfs/dbraw/zinc/90/08/51/1045900851.db2.gz NWYWKJHCGFWLRW-UHFFFAOYSA-N -1 3 338.392 4.094 20 0 EIADHM O=C(Nc1cc(F)ccc1[O-])c1ccc(CCC(F)(F)F)cc1 ZINC000162380286 1046194352 /nfs/dbraw/zinc/19/43/52/1046194352.db2.gz MCORPZVBXUEJOH-UHFFFAOYSA-N -1 3 327.277 4.279 20 0 EIADHM O=C([O-])c1cccc(CN2CCC(Oc3ccccc3Cl)CC2)c1 ZINC000263509590 1046299865 /nfs/dbraw/zinc/29/98/65/1046299865.db2.gz YHUWPRLAQMNIOT-UHFFFAOYSA-N -1 3 345.826 4.082 20 0 EIADHM Cc1[nH]c2ccccc2c1CC(=O)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000125334660 1046299958 /nfs/dbraw/zinc/29/99/58/1046299958.db2.gz IKYBIHHBOFKFFM-UHFFFAOYSA-N -1 3 348.324 4.382 20 0 EIADHM Cc1ccc(C(=O)Nc2cc(Cl)c(N)c(Cl)c2)c([O-])c1C ZINC000916744656 1046348787 /nfs/dbraw/zinc/34/87/87/1046348787.db2.gz KKZUVTBVWZFMDR-UHFFFAOYSA-N -1 3 325.195 4.150 20 0 EIADHM CC(C)(Cc1ccc(C(F)(F)F)cc1)C(=O)[N-]OC/C=C/Cl ZINC000794304747 1046397292 /nfs/dbraw/zinc/39/72/92/1046397292.db2.gz IYSGZJWKNGXPAF-FPYGCLRLSA-N -1 3 335.753 4.074 20 0 EIADHM O=C(Nc1cccc([O-])c1F)c1cc(F)c(C(F)(F)F)cc1F ZINC000804522299 1046564912 /nfs/dbraw/zinc/56/49/12/1046564912.db2.gz QTZFOVKSBHFSFK-UHFFFAOYSA-N -1 3 335.203 4.081 20 0 EIADHM CC1(CC(F)F)CN(C(=O)c2cc(Oc3ccccc3)ccc2[O-])C1 ZINC000649016365 1046568504 /nfs/dbraw/zinc/56/85/04/1046568504.db2.gz ADNMGBYSLJDCHM-UHFFFAOYSA-N -1 3 347.361 4.302 20 0 EIADHM CC(C)(NCc1cccc([O-])c1Br)c1cccc(F)c1 ZINC000459406888 1046624604 /nfs/dbraw/zinc/62/46/04/1046624604.db2.gz HEQFIAKTGZBVJA-UHFFFAOYSA-N -1 3 338.220 4.319 20 0 EIADHM CC(C)Oc1cc(F)c(F)cc1Nc1cc(=O)n(-c2ccccc2)[n-]1 ZINC001212222540 1046706961 /nfs/dbraw/zinc/70/69/61/1046706961.db2.gz SLTFVHPBLOKIFF-UHFFFAOYSA-N -1 3 345.349 4.387 20 0 EIADHM CCOc1cc(CNc2cnn([C@@H](C)C3CC3)c2)cc(Cl)c1[O-] ZINC000459495131 1046723689 /nfs/dbraw/zinc/72/36/89/1046723689.db2.gz CXGPTCCEDAICJA-NSHDSACASA-N -1 3 335.835 4.224 20 0 EIADHM O=C([N-]c1nnc(C(F)F)s1)c1ccc(-c2ccc(F)cc2)o1 ZINC000067524481 1046744856 /nfs/dbraw/zinc/74/48/56/1046744856.db2.gz BHCJBTFYRPDCRG-UHFFFAOYSA-N -1 3 339.298 4.127 20 0 EIADHM Cc1ccc(-c2nnc([C@H](C)OC(=O)c3cc4occc4[n-]3)o2)cc1 ZINC000786030958 1046804197 /nfs/dbraw/zinc/80/41/97/1046804197.db2.gz KKILMOMYLNMMBG-NSHDSACASA-N -1 3 337.335 4.037 20 0 EIADHM O=C(OCc1cnc(Cl)s1)c1cc2sccc2c([O-])c1 ZINC000786138083 1046815195 /nfs/dbraw/zinc/81/51/95/1046815195.db2.gz QYOHHBGZGGDASR-UHFFFAOYSA-N -1 3 325.798 4.074 20 0 EIADHM C[C@@H](C(=O)Nc1cccc([O-])c1F)c1ccc(Br)s1 ZINC000128434751 1046866481 /nfs/dbraw/zinc/86/64/81/1046866481.db2.gz FAZPIFROANPOFQ-SSDOTTSWSA-N -1 3 344.205 4.098 20 0 EIADHM O=C(Nc1cccc([O-])c1F)[C@@H]1C[C@H]1c1cccc(C(F)(F)F)c1 ZINC000128842493 1047111022 /nfs/dbraw/zinc/11/10/22/1047111022.db2.gz VEVYRBDXRLFLHN-NWDGAFQWSA-N -1 3 339.288 4.292 20 0 EIADHM CN(Cc1ccc(F)c(F)c1)C(=O)c1cc2sccc2c([O-])c1 ZINC000788277463 1047156837 /nfs/dbraw/zinc/15/68/37/1047156837.db2.gz YSOATTZJCAJSJM-UHFFFAOYSA-N -1 3 333.359 4.157 20 0 EIADHM O=C(Nc1cnc(-c2ccccc2)nc1)c1cc2sccc2c([O-])c1 ZINC000788279061 1047157687 /nfs/dbraw/zinc/15/76/87/1047157687.db2.gz WBJNAHCVKSYIEU-UHFFFAOYSA-N -1 3 347.399 4.316 20 0 EIADHM O=C(Nc1cc(-c2cccs2)[nH]n1)c1cc2sccc2c([O-])c1 ZINC000788289277 1047159755 /nfs/dbraw/zinc/15/97/55/1047159755.db2.gz GSSULILZCGGNGX-UHFFFAOYSA-N -1 3 341.417 4.311 20 0 EIADHM Cc1cc(C)cc(Oc2cccc(F)c2[N-]C(=O)c2cocn2)c1 ZINC001130578810 1047230360 /nfs/dbraw/zinc/23/03/60/1047230360.db2.gz DGNQRNUUQUXMKL-UHFFFAOYSA-N -1 3 326.327 4.475 20 0 EIADHM CCOc1cc(/C=C2/COc3ccccc3C2=O)cc(Cl)c1[O-] ZINC000033476430 1047343052 /nfs/dbraw/zinc/34/30/52/1047343052.db2.gz RZYKEAVFZMAGFA-GHXNOFRVSA-N -1 3 330.767 4.103 20 0 EIADHM CCC(C)(C)[C@@H]1CCc2nc(NC([O-])=NOCC(F)F)sc2C1 ZINC000806749504 1047361320 /nfs/dbraw/zinc/36/13/20/1047361320.db2.gz CUAXIXQWLSDKCL-SECBINFHSA-N -1 3 347.431 4.002 20 0 EIADHM CCC(C)(C)[C@@H]1CCc2nc(NC(=O)[N-]OCC(F)F)sc2C1 ZINC000806749504 1047361336 /nfs/dbraw/zinc/36/13/36/1047361336.db2.gz CUAXIXQWLSDKCL-SECBINFHSA-N -1 3 347.431 4.002 20 0 EIADHM COc1ccc(C(=O)CCCCCC(=O)[N-]OC2CCCCC2)cc1 ZINC000789211203 1047390123 /nfs/dbraw/zinc/39/01/23/1047390123.db2.gz ANBYFMALUCOBLZ-UHFFFAOYSA-N -1 3 347.455 4.209 20 0 EIADHM Cc1nc(-c2cccc(C(=O)Nc3cccc([O-])c3F)c2)cs1 ZINC000129589753 1047440085 /nfs/dbraw/zinc/44/00/85/1047440085.db2.gz HAPXZZLKOJOJAO-UHFFFAOYSA-N -1 3 328.368 4.216 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1ccc(OC(F)(F)F)cc1 ZINC000069693535 1047449549 /nfs/dbraw/zinc/44/95/49/1047449549.db2.gz CGYKAOJPULWTFL-UHFFFAOYSA-N -1 3 331.677 4.197 20 0 EIADHM C[C@H](Sc1ccc(Cl)cc1)C(=O)Nc1cccc([O-])c1F ZINC000129656085 1047459167 /nfs/dbraw/zinc/45/91/67/1047459167.db2.gz NSMBJVGTOJSHNS-VIFPVBQESA-N -1 3 325.792 4.304 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)N1Cc2cccc(Cl)c2C1 ZINC000807815396 1047505796 /nfs/dbraw/zinc/50/57/96/1047505796.db2.gz JGYARNFKPGRWNG-UHFFFAOYSA-N -1 3 333.790 4.050 20 0 EIADHM CSc1cc(Cl)ccc1[N-]C(=O)c1c2c(ccc1F)OCO2 ZINC001131054757 1047511150 /nfs/dbraw/zinc/51/11/50/1047511150.db2.gz SIQRBKZHABGRTB-UHFFFAOYSA-N -1 3 339.775 4.182 20 0 EIADHM COCc1ccsc1C(=O)[N-]c1c(C)noc1-c1ccccc1 ZINC000131012939 1047820091 /nfs/dbraw/zinc/82/00/91/1047820091.db2.gz KMFWAOBJOWZWMO-UHFFFAOYSA-N -1 3 328.393 4.110 20 0 EIADHM COC(=O)c1ccc(C(=O)Nc2ccc(-c3ccccc3)cc2C)[n-]1 ZINC000814295697 1047928126 /nfs/dbraw/zinc/92/81/26/1047928126.db2.gz CPTIZAPPXNGVAY-UHFFFAOYSA-N -1 3 334.375 4.029 20 0 EIADHM CC(C)(C)Oc1ccc(C[N-]C(=O)C(C)(F)F)c(C(F)(F)F)c1 ZINC000808464401 1047934358 /nfs/dbraw/zinc/93/43/58/1047934358.db2.gz PPJBRQZQLFXBDO-UHFFFAOYSA-N -1 3 339.304 4.154 20 0 EIADHM CC(=O)c1ccc(C(=O)N2CCCCC[C@@H]2c2ccc(C)o2)cc1[O-] ZINC001136941226 1047969763 /nfs/dbraw/zinc/96/97/63/1047969763.db2.gz LALHDFYXKZRBMA-QGZVFWFLSA-N -1 3 341.407 4.254 20 0 EIADHM CC(=O)c1cccc(NC(=O)c2cccc(-c3ccccn3)c2C)c1[O-] ZINC000556893020 1048119328 /nfs/dbraw/zinc/11/93/28/1048119328.db2.gz OPMCDJLKZFJWRJ-UHFFFAOYSA-N -1 3 346.386 4.218 20 0 EIADHM CCc1cc2c(CSc3ccncc3C)cc(=O)oc2cc1[O-] ZINC000814806740 1048189100 /nfs/dbraw/zinc/18/91/00/1048189100.db2.gz OMIUQQJNAXBXNC-UHFFFAOYSA-N -1 3 327.405 4.057 20 0 EIADHM O=C(CCC1CCCCC1)[N-]OCc1noc(C2CCCCC2)n1 ZINC000772897780 1048225409 /nfs/dbraw/zinc/22/54/09/1048225409.db2.gz SVJQZOIYUFSVMB-UHFFFAOYSA-N -1 3 335.448 4.026 20 0 EIADHM CC(C)c1nnc(C(=O)[N-]c2cc(C(F)(F)F)ccc2F)s1 ZINC001143891534 1048269110 /nfs/dbraw/zinc/26/91/10/1048269110.db2.gz PGWOMGRNLLVHLC-UHFFFAOYSA-N -1 3 333.310 4.072 20 0 EIADHM COC(=O)c1ccc(C(=O)Nc2ccc(SC(C)(C)C)cc2C)[n-]1 ZINC000815239149 1048399556 /nfs/dbraw/zinc/39/95/56/1048399556.db2.gz JUXDIAOXEFRJHE-UHFFFAOYSA-N -1 3 346.452 4.253 20 0 EIADHM CC(C)(C)[C@@H]1CCCC[C@@H]1CNC(=O)c1c[n-]c2ccccc2c1=O ZINC000920040020 1048402674 /nfs/dbraw/zinc/40/26/74/1048402674.db2.gz NDBGUERBVDEYBO-RHSMWYFYSA-N -1 3 340.467 4.110 20 0 EIADHM CC(C)(C)c1cnc([N-]C(=O)c2snc(Cl)c2Cl)s1 ZINC000845657061 1048707816 /nfs/dbraw/zinc/70/78/16/1048707816.db2.gz OYZLMBNUQPJXJE-UHFFFAOYSA-N -1 3 336.269 4.456 20 0 EIADHM Cc1ccc(C(=O)Nc2ccc(Br)cc2F)c([O-])c1C ZINC001135428263 1048710710 /nfs/dbraw/zinc/71/07/10/1048710710.db2.gz OHGXJYRJHNIIBT-UHFFFAOYSA-N -1 3 338.176 4.163 20 0 EIADHM C[C@H]1CC(C)(C)c2cccc(NC(=O)Cc3ccc([O-])c(F)c3)c21 ZINC001144630987 1048765131 /nfs/dbraw/zinc/76/51/31/1048765131.db2.gz AETPKLCNTNENJN-LBPRGKRZSA-N -1 3 327.399 4.497 20 0 EIADHM CN(Cc1c(F)ccc([O-])c1F)C[C@@H]1CCCO[C@H]1c1ccccc1 ZINC000816499316 1048820106 /nfs/dbraw/zinc/82/01/06/1048820106.db2.gz LHIREFRZRGKKQA-YWZLYKJASA-N -1 3 347.405 4.270 20 0 EIADHM C[C@H]([N-]C(=O)C(F)(F)c1cc(Cl)ccc1Cl)c1cccnc1 ZINC001135772578 1048884053 /nfs/dbraw/zinc/88/40/53/1048884053.db2.gz DAJJGZWXHFSDCY-VIFPVBQESA-N -1 3 345.176 4.358 20 0 EIADHM O=C([N-]c1cccc(Cl)c1SCC(F)F)c1cscn1 ZINC000076473887 1048888746 /nfs/dbraw/zinc/88/87/46/1048888746.db2.gz JJUGVXKXRRJLEY-UHFFFAOYSA-N -1 3 334.800 4.406 20 0 EIADHM Cc1ccc2[nH]c(-c3ccccc3NC(=O)c3ccccc3[O-])nc2c1 ZINC001144935026 1048891280 /nfs/dbraw/zinc/89/12/80/1048891280.db2.gz YWNNYEWQHQCUGX-UHFFFAOYSA-N -1 3 343.386 4.496 20 0 EIADHM Cc1ccc2nc(-c3ccccc3NC(=O)c3ccccc3[O-])[nH]c2c1 ZINC001144935026 1048891283 /nfs/dbraw/zinc/89/12/83/1048891283.db2.gz YWNNYEWQHQCUGX-UHFFFAOYSA-N -1 3 343.386 4.496 20 0 EIADHM C[C@@H](C(=O)Nc1ccc([O-])c(C(F)(F)F)c1)c1ccccc1F ZINC000134202727 1048895338 /nfs/dbraw/zinc/89/53/38/1048895338.db2.gz XARLOPBIUIFZQE-SECBINFHSA-N -1 3 327.277 4.292 20 0 EIADHM CC[C@H](OCCNC(=O)c1cc(SC)ccc1[O-])c1ccccc1 ZINC001144955959 1048931638 /nfs/dbraw/zinc/93/16/38/1048931638.db2.gz LGUXYXULTPFEKH-SFHVURJKSA-N -1 3 345.464 4.012 20 0 EIADHM O=c1ccnc(C=Cc2cnn(C3CCCC3)c2-c2ccccc2)[n-]1 ZINC000817345162 1048950600 /nfs/dbraw/zinc/95/06/00/1048950600.db2.gz BFLPLBTWAHZUIY-ZHACJKMWSA-N -1 3 332.407 4.331 20 0 EIADHM O=C([N-]c1ccccc1Oc1ccccc1)c1nnc(-c2ccco2)o1 ZINC001135921799 1048971119 /nfs/dbraw/zinc/97/11/19/1048971119.db2.gz SEUQYJAGTUZORE-UHFFFAOYSA-N -1 3 347.330 4.374 20 0 EIADHM CC(C)(F)CCNC(=O)c1cc(CCc2ccccc2)ccc1[O-] ZINC001146465884 1049023940 /nfs/dbraw/zinc/02/39/40/1049023940.db2.gz NVHQJHOXIOFHSE-UHFFFAOYSA-N -1 3 329.415 4.045 20 0 EIADHM Cc1ccccc1C(F)(F)C(=O)[N-][C@@H](CF)c1ccc(F)cc1 ZINC001132769352 1049038253 /nfs/dbraw/zinc/03/82/53/1049038253.db2.gz HFNCWBIKKLMLMX-HNNXBMFYSA-N -1 3 325.305 4.053 20 0 EIADHM Cc1c(CSC(C)C)cccc1NC(=O)c1ccc(N)cc1[O-] ZINC000817951430 1049067489 /nfs/dbraw/zinc/06/74/89/1049067489.db2.gz FKGTXWXPNNYNNL-UHFFFAOYSA-N -1 3 330.453 4.177 20 0 EIADHM CCCCN(Cc1ccccc1Cl)C(=O)c1ccc(N)cc1[O-] ZINC000817930743 1049069948 /nfs/dbraw/zinc/06/99/48/1049069948.db2.gz FQLZMZBTTHESBB-UHFFFAOYSA-N -1 3 332.831 4.070 20 0 EIADHM CCc1ccc(C(=O)N[C@H](C)c2ncc(-c3ccccc3)o2)c([O-])c1 ZINC001147441036 1049159304 /nfs/dbraw/zinc/15/93/04/1049159304.db2.gz KUDWMSIDFVXYNU-CYBMUJFWSA-N -1 3 336.391 4.101 20 0 EIADHM C[C@@H]1CC[C@@H](C)N(C(=O)c2cc(Oc3ccccc3)ccc2[O-])C1 ZINC001147861903 1049229139 /nfs/dbraw/zinc/22/91/39/1049229139.db2.gz RWMXMGLHMCDZMZ-HUUCEWRRSA-N -1 3 325.408 4.445 20 0 EIADHM C[C@H]1CC[C@H](C)N(C(=O)c2cc(Oc3ccccc3)ccc2[O-])C1 ZINC001147861902 1049229966 /nfs/dbraw/zinc/22/99/66/1049229966.db2.gz RWMXMGLHMCDZMZ-GJZGRUSLSA-N -1 3 325.408 4.445 20 0 EIADHM Cc1ccc([C@H]2CCC[C@@H]2N(C)C(=O)Cc2ccc([O-])c(F)c2)cc1 ZINC001147971448 1049244616 /nfs/dbraw/zinc/24/46/16/1049244616.db2.gz XXNHCWFTIKNDJN-MJGOQNOKSA-N -1 3 341.426 4.177 20 0 EIADHM Cc1nc(-c2ccccn2)sc1C(=O)Nc1cc([O-])cc(Cl)c1 ZINC001147954066 1049249191 /nfs/dbraw/zinc/24/91/91/1049249191.db2.gz DAALVDWCANFFLZ-UHFFFAOYSA-N -1 3 345.811 4.125 20 0 EIADHM COc1cccc(C(=O)Nc2ccc(-c3ccccc3)cc2F)c1[O-] ZINC001136195044 1049272738 /nfs/dbraw/zinc/27/27/38/1049272738.db2.gz BPNLQALLEGLECS-UHFFFAOYSA-N -1 3 337.350 4.459 20 0 EIADHM CC(C)(C)OC(=O)c1ccccc1C(=O)Nc1cc([O-])cc(Cl)c1 ZINC001148384913 1049306797 /nfs/dbraw/zinc/30/67/97/1049306797.db2.gz NAENLLQAGLOIKW-UHFFFAOYSA-N -1 3 347.798 4.253 20 0 EIADHM COc1cccc2c(NC(=O)c3ccc([O-])c(C(C)=O)c3)cccc12 ZINC001148663608 1049356754 /nfs/dbraw/zinc/35/67/54/1049356754.db2.gz AFEKBOWSKCPHFR-UHFFFAOYSA-N -1 3 335.359 4.009 20 0 EIADHM CC(=O)c1cc(C(=O)N(c2ccccc2)c2ccccc2N)ccc1[O-] ZINC001148662904 1049357516 /nfs/dbraw/zinc/35/75/16/1049357516.db2.gz UJJMMGZGCSSHAC-UHFFFAOYSA-N -1 3 346.386 4.156 20 0 EIADHM CC(=O)c1cc(C(=O)Nc2cnc3cc(Cl)ccc3c2)ccc1[O-] ZINC001148657694 1049357575 /nfs/dbraw/zinc/35/75/75/1049357575.db2.gz RABPJQODTWZSPM-UHFFFAOYSA-N -1 3 340.766 4.049 20 0 EIADHM O=C(c1cc(Cc2ccccc2)ccc1[O-])N(CC(F)(F)F)C1CC1 ZINC000819995240 1049406655 /nfs/dbraw/zinc/40/66/55/1049406655.db2.gz UUTWVMJFOHJUBR-UHFFFAOYSA-N -1 3 349.352 4.150 20 0 EIADHM CCN(C(=O)c1ccc(C(C)C)cc1[O-])[C@H](C)[C@@H](O)c1ccccc1 ZINC000820108196 1049432951 /nfs/dbraw/zinc/43/29/51/1049432951.db2.gz LWVGKEMPVLUZKE-FOIQADDNSA-N -1 3 341.451 4.100 20 0 EIADHM Cc1cccc([O-])c1C(=O)N[C@@H](C)CCc1ccc(OC(C)C)cc1 ZINC001136324956 1049468769 /nfs/dbraw/zinc/46/87/69/1049468769.db2.gz DCMGSETXAZWRPR-INIZCTEOSA-N -1 3 341.451 4.239 20 0 EIADHM C[C@@H](CC(=O)[N-]OC1CCCC1)c1ccc(F)c(Br)c1 ZINC000812543953 1049511493 /nfs/dbraw/zinc/51/14/93/1049511493.db2.gz WKWXCLDLPXHLMK-JTQLQIEISA-N -1 3 344.224 4.072 20 0 EIADHM Cc1cc(-n2c(C)cc(C(=O)Nc3c([O-])cccc3Cl)c2C)no1 ZINC000820509174 1049517272 /nfs/dbraw/zinc/51/72/72/1049517272.db2.gz BWAHIBOYGBJQAO-UHFFFAOYSA-N -1 3 345.786 4.002 20 0 EIADHM Cc1sc2[n-]c([C@H](C)OC(=O)[C@H]3CCCC[C@@H]3C)nc(=O)c2c1C ZINC000820938530 1049577687 /nfs/dbraw/zinc/57/76/87/1049577687.db2.gz CJGRQVYQXDSZBZ-GAFUQQFSSA-N -1 3 348.468 4.444 20 0 EIADHM CC[C@@H](NCc1cc(=O)oc2cc([O-])ccc12)c1ccc(F)cc1F ZINC000179627228 1049690886 /nfs/dbraw/zinc/69/08/86/1049690886.db2.gz ZIWXQGIXRFHVSO-QGZVFWFLSA-N -1 3 345.345 4.018 20 0 EIADHM CCc1ccc(C(=O)NC2(c3ccc(OC)cc3)CCCC2)c([O-])c1 ZINC001136503661 1049700474 /nfs/dbraw/zinc/70/04/74/1049700474.db2.gz VOLZCOQQGJKGGU-UHFFFAOYSA-N -1 3 339.435 4.163 20 0 EIADHM Cc1cc(-c2cccc(Cl)c2)ccc1NC(=O)c1cc(=O)[n-]cn1 ZINC001136552825 1049739580 /nfs/dbraw/zinc/73/95/80/1049739580.db2.gz HCANFNUSGGOWKM-UHFFFAOYSA-N -1 3 339.782 4.063 20 0 EIADHM CCCN(C)Cc1c([O-])ccc2c(=O)c(-c3ccccc3)c(C)oc21 ZINC000069062248 1049965851 /nfs/dbraw/zinc/96/58/51/1049965851.db2.gz GHAYTZPGLFJHOG-UHFFFAOYSA-N -1 3 337.419 4.316 20 0 EIADHM Cc1sc([N-]C(=O)c2noc(-c3cccc(F)c3)n2)nc1C(C)C ZINC000617245993 1049968807 /nfs/dbraw/zinc/96/88/07/1049968807.db2.gz WQPKREGIAVBRNQ-UHFFFAOYSA-N -1 3 346.387 4.016 20 0 EIADHM CC(C)Oc1ccc(F)c(Nc2cc(=O)n(-c3ccccc3)[n-]2)c1 ZINC001212310422 1050019175 /nfs/dbraw/zinc/01/91/75/1050019175.db2.gz FKQXRSKUHPUHMD-UHFFFAOYSA-N -1 3 327.359 4.248 20 0 EIADHM C[C@H](NC(=O)Nc1ccc([O-])c(Br)c1)C1CCCCC1 ZINC001186389677 1050306717 /nfs/dbraw/zinc/30/67/17/1050306717.db2.gz RYHHWLHCLCGUBR-JTQLQIEISA-N -1 3 341.249 4.245 20 0 EIADHM O=C(Nc1ccc(F)c([O-])c1)c1ccc(Cl)c(C(F)(F)F)c1 ZINC001186637425 1050380721 /nfs/dbraw/zinc/38/07/21/1050380721.db2.gz ZJTSAIHMZZNYPZ-UHFFFAOYSA-N -1 3 333.668 4.456 20 0 EIADHM O=C(Nc1nc2c(cccc2[O-])s1)NC12CC3CC(CC(C3)C1)C2 ZINC001186647437 1050382447 /nfs/dbraw/zinc/38/24/47/1050382447.db2.gz VIHQOKIHRAJOQK-UHFFFAOYSA-N -1 3 343.452 4.092 20 0 EIADHM Cc1cc2cc(NC(=O)c3c[n-]c4c(C)cc(F)cc4c3=O)ccc2[nH]1 ZINC000163029788 1050443397 /nfs/dbraw/zinc/44/33/97/1050443397.db2.gz SLWKVXDYFVNFIC-UHFFFAOYSA-N -1 3 349.365 4.018 20 0 EIADHM CCCCCCc1ccc(NC(=O)c2ccccc2-c2nnn[n-]2)cc1 ZINC001187008535 1050457473 /nfs/dbraw/zinc/45/74/73/1050457473.db2.gz FCTROVHBQSKBJV-UHFFFAOYSA-N -1 3 349.438 4.242 20 0 EIADHM CCCCCCc1ccc(NC(=O)c2ccccc2-c2nn[n-]n2)cc1 ZINC001187008535 1050457478 /nfs/dbraw/zinc/45/74/78/1050457478.db2.gz FCTROVHBQSKBJV-UHFFFAOYSA-N -1 3 349.438 4.242 20 0 EIADHM O=C([N-]c1cc(-c2ccco2)no1)Nc1cccc(Br)c1 ZINC001187441853 1050541362 /nfs/dbraw/zinc/54/13/62/1050541362.db2.gz YIZIRASCIXTSJI-UHFFFAOYSA-N -1 3 348.156 4.341 20 0 EIADHM COc1ccc(Cl)cc1NC(=O)[N-]c1cc(-c2ccco2)no1 ZINC001187905442 1050640993 /nfs/dbraw/zinc/64/09/93/1050640993.db2.gz NQNWMTKRJGGNQP-UHFFFAOYSA-N -1 3 333.731 4.241 20 0 EIADHM CCCCCC(C)(C)C[N-]S(=O)(=O)c1cccc(Cl)c1F ZINC001187944824 1050655388 /nfs/dbraw/zinc/65/53/88/1050655388.db2.gz KSAWUPHNRKQSLD-UHFFFAOYSA-N -1 3 335.872 4.364 20 0 EIADHM CSc1cccc(NC(=O)[N-]c2cc(-c3ccccn3)no2)c1 ZINC001188023941 1050683266 /nfs/dbraw/zinc/68/32/66/1050683266.db2.gz OAMPLPRRBZOPCG-UHFFFAOYSA-N -1 3 326.381 4.103 20 0 EIADHM CCN(CC)C(=O)c1ccc(Nc2nc3c(cccc3[O-])s2)cc1 ZINC001174063195 1050697635 /nfs/dbraw/zinc/69/76/35/1050697635.db2.gz NVQGKBOQDHTYRW-UHFFFAOYSA-N -1 3 341.436 4.228 20 0 EIADHM CO[C@H](CSc1nnc([N-]c2ccccc2F)s1)C1CCC1 ZINC001188114590 1050702897 /nfs/dbraw/zinc/70/28/97/1050702897.db2.gz KODZJBRVNIOARR-CYBMUJFWSA-N -1 3 339.461 4.328 20 0 EIADHM O=c1cc(COc2cccc(C(F)(F)F)c2)nc(-c2ccccc2)[n-]1 ZINC001188192657 1050718437 /nfs/dbraw/zinc/71/84/37/1050718437.db2.gz LWYYUSYOEKUKGH-UHFFFAOYSA-N -1 3 346.308 4.447 20 0 EIADHM O=C(c1cccc(Nc2cc(F)c([O-])c(F)c2)c1)N1CCCCC1 ZINC001174174477 1050815295 /nfs/dbraw/zinc/81/52/95/1050815295.db2.gz UTANXTUSWXKAAR-UHFFFAOYSA-N -1 3 332.350 4.040 20 0 EIADHM CC(C)NC(=O)c1cccc(Nc2cccc([O-])c2Br)c1 ZINC001174188318 1050825097 /nfs/dbraw/zinc/82/50/97/1050825097.db2.gz NPRMSLXXTRSERQ-UHFFFAOYSA-N -1 3 349.228 4.037 20 0 EIADHM COc1cccc([C@H](C)SCc2nnc(-c3ccccc3[O-])o2)c1 ZINC001188953608 1050870603 /nfs/dbraw/zinc/87/06/03/1050870603.db2.gz YAJNKUKMOCCCKK-LBPRGKRZSA-N -1 3 342.420 4.445 20 0 EIADHM O=C(c1ccc([O-])cc1)C1CCN(C/C=C/c2cccc(F)c2)CC1 ZINC001180249757 1050934313 /nfs/dbraw/zinc/93/43/13/1050934313.db2.gz ZHCJQIYARGHAIU-DUXPYHPUSA-N -1 3 339.410 4.139 20 0 EIADHM CN(CCOc1ccc(Cl)cc1)Cc1cccc([O-])c1Cl ZINC001180566593 1051039139 /nfs/dbraw/zinc/03/91/39/1051039139.db2.gz RHYFXELFOPKWOI-UHFFFAOYSA-N -1 3 326.223 4.210 20 0 EIADHM COc1cccc([C@@H]2C[C@@H](C)CN2Cc2c(F)ccc([O-])c2F)c1 ZINC001180834933 1051084437 /nfs/dbraw/zinc/08/44/37/1051084437.db2.gz INCCVGNRINLFHU-PXAZEXFGSA-N -1 3 333.378 4.262 20 0 EIADHM CC(C)Oc1ccc(Nc2cc(Br)cc(F)c2[O-])cn1 ZINC001174765012 1051163916 /nfs/dbraw/zinc/16/39/16/1051163916.db2.gz MTOWMOMQDZYPQH-UHFFFAOYSA-N -1 3 341.180 4.220 20 0 EIADHM O=S(=O)([N-]c1cc(Cl)ccc1F)c1ccc(C2CC2)cc1 ZINC001190500966 1051196675 /nfs/dbraw/zinc/19/66/75/1051196675.db2.gz RQPPJEKDYIIFSY-UHFFFAOYSA-N -1 3 325.792 4.157 20 0 EIADHM CCCCOc1ccccc1Nc1cccc(C(=O)N(C)C)c1[O-] ZINC001175001996 1051287720 /nfs/dbraw/zinc/28/77/20/1051287720.db2.gz QLVGTRMFGHDBBJ-UHFFFAOYSA-N -1 3 328.412 4.017 20 0 EIADHM Cc1cc(C[N-]C(=O)C(F)(F)F)cc(NCC2(C)CCCC2)c1 ZINC001181765203 1051298531 /nfs/dbraw/zinc/29/85/31/1051298531.db2.gz VUODZDOAQVMIKY-UHFFFAOYSA-N -1 3 328.378 4.166 20 0 EIADHM O=C(NC1(c2cccc3ccccc32)CC1)c1ccc(=O)[n-]c1Cl ZINC001190918118 1051311724 /nfs/dbraw/zinc/31/17/24/1051311724.db2.gz MOVQDVZHHAQUOB-UHFFFAOYSA-N -1 3 338.794 4.013 20 0 EIADHM CCOC(=O)c1cnc2c(cccc2Nc2c(F)cc([O-])cc2F)c1 ZINC001175099505 1051344544 /nfs/dbraw/zinc/34/45/44/1051344544.db2.gz KHVNOCHZZNCKDP-UHFFFAOYSA-N -1 3 344.317 4.139 20 0 EIADHM CCOC(=O)c1ccc2ccc(Nc3c(F)cc([O-])cc3F)cc2n1 ZINC001175099329 1051345817 /nfs/dbraw/zinc/34/58/17/1051345817.db2.gz ASAGJWIISBJHGP-UHFFFAOYSA-N -1 3 344.317 4.139 20 0 EIADHM [O-]c1cc(F)c(Nc2ccc3cnn([C@@H]4CCCCO4)c3c2)c(F)c1 ZINC001175100585 1051348231 /nfs/dbraw/zinc/34/82/31/1051348231.db2.gz XAAQZWGVKNAYMN-KRWDZBQOSA-N -1 3 345.349 4.463 20 0 EIADHM CCCCc1ccc(S(=O)(=O)[N-]c2c(O)cccc2Cl)cc1 ZINC001191249394 1051411523 /nfs/dbraw/zinc/41/15/23/1051411523.db2.gz SOIONQBODWURGP-UHFFFAOYSA-N -1 3 339.844 4.189 20 0 EIADHM Cc1ccc(Oc2ccccc2NC([O-])=NO[C@@H]2CCCCO2)cc1 ZINC000775450161 1051431064 /nfs/dbraw/zinc/43/10/64/1051431064.db2.gz LSGQAGQFUKVUCN-GOSISDBHSA-N -1 3 342.395 4.367 20 0 EIADHM Cc1ccc(Oc2ccccc2NC(=O)[N-]O[C@@H]2CCCCO2)cc1 ZINC000775450161 1051431066 /nfs/dbraw/zinc/43/10/66/1051431066.db2.gz LSGQAGQFUKVUCN-GOSISDBHSA-N -1 3 342.395 4.367 20 0 EIADHM CCO[C@H]1C[C@H](N(C)C(=O)c2cc3sccc3c([O-])c2)C12CCC2 ZINC000774064210 1051439037 /nfs/dbraw/zinc/43/90/37/1051439037.db2.gz CVDRFLMHMSBRPU-IRXDYDNUSA-N -1 3 345.464 4.027 20 0 EIADHM CCOc1ccc(OC)cc1Nc1cccc([O-])c1Br ZINC001175214248 1051448845 /nfs/dbraw/zinc/44/88/45/1051448845.db2.gz HRXNGZKMVGYNAF-UHFFFAOYSA-N -1 3 338.201 4.306 20 0 EIADHM Cc1cc(=O)[n-]c(-c2cccc(OC(=O)[C@H](C)CC(C)(C)C)c2)n1 ZINC000774102678 1051453777 /nfs/dbraw/zinc/45/37/77/1051453777.db2.gz ACPVXPIVRJPQLS-GFCCVEGCSA-N -1 3 328.412 4.135 20 0 EIADHM Cc1cc(N)c(Nc2c(F)ccc([O-])c2F)c(Br)c1 ZINC001175268729 1051503849 /nfs/dbraw/zinc/50/38/49/1051503849.db2.gz RHNCMYZELNECLR-UHFFFAOYSA-N -1 3 329.144 4.067 20 0 EIADHM [O-]c1ccc(F)c(Nc2ccc3c(cnn3[C@H]3CCCCO3)c2)c1F ZINC001175267863 1051504708 /nfs/dbraw/zinc/50/47/08/1051504708.db2.gz AVXNAWYOSUDJSG-MRXNPFEDSA-N -1 3 345.349 4.463 20 0 EIADHM CCOC(=O)c1c(Cl)cccc1Nc1c(F)ccc([O-])c1F ZINC001175268806 1051505032 /nfs/dbraw/zinc/50/50/32/1051505032.db2.gz XAFYJMSLODCNFT-UHFFFAOYSA-N -1 3 327.714 4.244 20 0 EIADHM Nc1cc(Cl)c(Br)cc1Nc1c(F)ccc([O-])c1F ZINC001175270886 1051509528 /nfs/dbraw/zinc/50/95/28/1051509528.db2.gz NCBPPIADEHZGEK-UHFFFAOYSA-N -1 3 349.562 4.412 20 0 EIADHM Cc1noc(C2CC2)c1[N-]C(=O)c1cnc(-c2ccsc2)s1 ZINC000156625791 1051548776 /nfs/dbraw/zinc/54/87/76/1051548776.db2.gz ACIUIRDUEUXWOQ-UHFFFAOYSA-N -1 3 331.422 4.298 20 0 EIADHM O=C(Cc1occ2ccccc21)Nc1cc(Br)ccc1[O-] ZINC001182502014 1051619722 /nfs/dbraw/zinc/61/97/22/1051619722.db2.gz BFAKZNRAPJRNAC-UHFFFAOYSA-N -1 3 346.180 4.082 20 0 EIADHM C[C@H]1CC[C@@](C)(C[N-]S(=O)(=O)c2ccc(Cl)s2)C1(C)C ZINC001192309375 1051686902 /nfs/dbraw/zinc/68/69/02/1051686902.db2.gz DUFXMHZXFSCRNM-HZMBPMFUSA-N -1 3 335.922 4.142 20 0 EIADHM CC(C)(C)c1ccc(C(=O)N2CCC[C@@H]2c2nccs2)c([O-])c1 ZINC001192322862 1051691317 /nfs/dbraw/zinc/69/13/17/1051691317.db2.gz QIBMKQGOTSFQTE-CQSZACIVSA-N -1 3 330.453 4.124 20 0 EIADHM CC(C)(C)c1ccc(C(=O)N2CCC(c3ccccn3)CC2)c([O-])c1 ZINC001192324007 1051692447 /nfs/dbraw/zinc/69/24/47/1051692447.db2.gz AYUSGCXANDXIAN-UHFFFAOYSA-N -1 3 338.451 4.105 20 0 EIADHM Cc1nc(NC(=O)[C@@H](C)c2cccc(Oc3ccccc3)c2)cc(=O)[n-]1 ZINC001182737605 1051693212 /nfs/dbraw/zinc/69/32/12/1051693212.db2.gz SRWHQGKHXYKSDN-ZDUSSCGKSA-N -1 3 349.390 4.025 20 0 EIADHM CC(C)(C)c1ccc(C(=O)N[C@H](c2ncccc2F)C2CC2)c([O-])c1 ZINC001192341248 1051694345 /nfs/dbraw/zinc/69/43/45/1051694345.db2.gz WAVJRMLNSXZMEP-KRWDZBQOSA-N -1 3 342.414 4.105 20 0 EIADHM [O-]c1cc(F)c(Nc2cccnc2OCc2ccccc2)cc1F ZINC001175877151 1051809214 /nfs/dbraw/zinc/80/92/14/1051809214.db2.gz MBDRSLCTNURXPA-UHFFFAOYSA-N -1 3 328.318 4.388 20 0 EIADHM C[C@H]1CCCN(Cc2nnc(-c3ccccc3[O-])o2)c2ccccc21 ZINC001193198679 1051884724 /nfs/dbraw/zinc/88/47/24/1051884724.db2.gz SRTQIALQHAAWAS-AWEZNQCLSA-N -1 3 335.407 4.346 20 0 EIADHM CCc1nnc([N-]C(=O)c2csc(-c3ccc(C)cc3C)n2)s1 ZINC000621553435 1051893350 /nfs/dbraw/zinc/89/33/50/1051893350.db2.gz FUQKMOFLNFOUGT-UHFFFAOYSA-N -1 3 344.465 4.093 20 0 EIADHM Cc1ccc2ccc(F)c(Nc3cc(=O)n(-c4ccccc4)[n-]3)c2n1 ZINC001176115193 1051917637 /nfs/dbraw/zinc/91/76/37/1051917637.db2.gz UXDAHDDZTNGNLP-UHFFFAOYSA-N -1 3 334.354 4.317 20 0 EIADHM Cc1ccc(Nc2ccc(Cl)c(C(=O)N(C)C)c2)c(Cl)c1[O-] ZINC001176153871 1051944313 /nfs/dbraw/zinc/94/43/13/1051944313.db2.gz RTBJRGOFVSBMKI-UHFFFAOYSA-N -1 3 339.222 4.453 20 0 EIADHM Cc1ccc(-c2cc(C(=O)O[C@H](C)CCCC(F)(F)F)n[n-]2)o1 ZINC000774723640 1051957798 /nfs/dbraw/zinc/95/77/98/1051957798.db2.gz TWNSULOPDRKKJJ-SECBINFHSA-N -1 3 330.306 4.256 20 0 EIADHM Cc1ccc(-c2cc(C(=O)O[C@H](C)CCCC(F)(F)F)[n-]n2)o1 ZINC000774723640 1051957811 /nfs/dbraw/zinc/95/78/11/1051957811.db2.gz TWNSULOPDRKKJJ-SECBINFHSA-N -1 3 330.306 4.256 20 0 EIADHM O=C1CCc2cc(Nc3cc(Br)cc(F)c3[O-])ccc21 ZINC001176238925 1051971377 /nfs/dbraw/zinc/97/13/77/1051971377.db2.gz LPGPMUIVRWAAPA-UHFFFAOYSA-N -1 3 336.160 4.166 20 0 EIADHM O=C(CCCC1CCCCC1)Nc1ncc([O-])cc1Br ZINC001184221961 1051971516 /nfs/dbraw/zinc/97/15/16/1051971516.db2.gz CKAJULLIFIUKCE-UHFFFAOYSA-N -1 3 341.249 4.239 20 0 EIADHM Cn1c(NC(=O)c2ccc([O-])cc2C(F)(F)F)cc2ccccc21 ZINC001193733935 1051977179 /nfs/dbraw/zinc/97/71/79/1051977179.db2.gz BWHGENXDXYFWSR-UHFFFAOYSA-N -1 3 334.297 4.155 20 0 EIADHM CN(C(=O)c1ccc([O-])cc1C(F)(F)F)[C@@H]1CCc2ccccc21 ZINC001193745372 1051977928 /nfs/dbraw/zinc/97/79/28/1051977928.db2.gz HVGUGGNKFODVIL-MRXNPFEDSA-N -1 3 335.325 4.171 20 0 EIADHM CCCCOc1ccc(C(=O)N[C@@H]2CCc3c2cccc3F)c([O-])c1 ZINC001184324066 1051994584 /nfs/dbraw/zinc/99/45/84/1051994584.db2.gz CNFUKAIJUIXWGV-GOSISDBHSA-N -1 3 343.398 4.128 20 0 EIADHM CC(=O)c1cccc([O-])c1NC(=O)Cc1c(C)c(C)c(C)c(C)c1C ZINC001184421608 1052009526 /nfs/dbraw/zinc/00/95/26/1052009526.db2.gz GGHVFWHNAOAQKN-UHFFFAOYSA-N -1 3 339.435 4.318 20 0 EIADHM Cc1cc2cc(CN[C@H](CC(=O)[O-])c3cccs3)oc2cc1C ZINC000671162298 1052072664 /nfs/dbraw/zinc/07/26/64/1052072664.db2.gz SMLKWUGJWMFEME-OAHLLOKOSA-N -1 3 329.421 4.417 20 0 EIADHM [O-]c1cc(Cl)c(Nc2cnn(Cc3cccnc3)c2)cc1Cl ZINC001176456675 1052079263 /nfs/dbraw/zinc/07/92/63/1052079263.db2.gz UXDOPAMUYMSOJE-UHFFFAOYSA-N -1 3 335.194 4.082 20 0 EIADHM O=S(=O)([N-]c1ccccc1F)c1ccc(-c2cccs2)cc1 ZINC001194131233 1052080320 /nfs/dbraw/zinc/08/03/20/1052080320.db2.gz PLAGYWPLWBFTEH-UHFFFAOYSA-N -1 3 333.409 4.355 20 0 EIADHM CC(=O)c1cccc([O-])c1NC(=O)CC1(c2ccc(F)cc2)CCC1 ZINC001184879847 1052125381 /nfs/dbraw/zinc/12/53/81/1052125381.db2.gz OITCAKFGHXRKRE-UHFFFAOYSA-N -1 3 341.382 4.184 20 0 EIADHM O=S(=O)([N-]c1ccccc1F)c1cccc2c(Cl)cccc21 ZINC001194403087 1052141706 /nfs/dbraw/zinc/14/17/06/1052141706.db2.gz HDPDREZKOZJRRU-UHFFFAOYSA-N -1 3 335.787 4.433 20 0 EIADHM Cc1nccc(C(F)(F)F)c1C(=O)Nc1cc([O-])cc(Cl)c1 ZINC001185054606 1052152016 /nfs/dbraw/zinc/15/20/16/1052152016.db2.gz SCBYMQBGKPMASD-UHFFFAOYSA-N -1 3 330.693 4.020 20 0 EIADHM Cc1cccc(C)c1S(=O)(=O)[N-]c1ccc(-c2cccnc2)cc1 ZINC001194639493 1052184321 /nfs/dbraw/zinc/18/43/21/1052184321.db2.gz UFEROQUOOGRCFA-UHFFFAOYSA-N -1 3 338.432 4.166 20 0 EIADHM [O-]c1cccc(Nc2ccnn2Cc2ccccc2)c1Br ZINC001176704933 1052184451 /nfs/dbraw/zinc/18/44/51/1052184451.db2.gz RZEKRHTXBMQRHL-UHFFFAOYSA-N -1 3 344.212 4.143 20 0 EIADHM Cc1cccc(C)c1S(=O)(=O)[N-]c1cccc(COC(C)C)c1 ZINC001194643826 1052184914 /nfs/dbraw/zinc/18/49/14/1052184914.db2.gz PALDCIYXTGUPJV-UHFFFAOYSA-N -1 3 333.453 4.029 20 0 EIADHM CCc1ccc([O-])c(C(=O)Nc2ccccc2NCC(F)(F)F)c1 ZINC000622333252 1052212428 /nfs/dbraw/zinc/21/24/28/1052212428.db2.gz QHDUTGNAMGTDQA-UHFFFAOYSA-N -1 3 338.329 4.181 20 0 EIADHM CC(C)CN(C(=O)c1cc([O-])cc(C(F)(F)F)c1)C1CCCC1 ZINC000622334287 1052213273 /nfs/dbraw/zinc/21/32/73/1052213273.db2.gz FZOYAFCDVLZIOF-UHFFFAOYSA-N -1 3 329.362 4.452 20 0 EIADHM COc1cccc(N(CC(C)C)C(=O)c2ccc(C)c(C)c2[O-])c1 ZINC000622335005 1052213943 /nfs/dbraw/zinc/21/39/43/1052213943.db2.gz LFKAUPQUVHRSGJ-UHFFFAOYSA-N -1 3 327.424 4.320 20 0 EIADHM O=S(=O)([N-]CCC1CCCCC1)c1cc(Cl)ccc1Cl ZINC001185299451 1052214167 /nfs/dbraw/zinc/21/41/67/1052214167.db2.gz ABZJOYHBBBXWEL-UHFFFAOYSA-N -1 3 336.284 4.242 20 0 EIADHM O=C(Nc1cc(Br)ccc1[O-])c1cc(C2CCC2)ccn1 ZINC001185316279 1052216941 /nfs/dbraw/zinc/21/69/41/1052216941.db2.gz WRCQMGBEYRMKPD-UHFFFAOYSA-N -1 3 347.212 4.070 20 0 EIADHM C[C@@H]1Cc2cc(Cl)ccc2N1Cc1nnc(-c2ccccc2[O-])o1 ZINC001177015932 1052218214 /nfs/dbraw/zinc/21/82/14/1052218214.db2.gz SYGLBKFEHGUARY-LLVKDONJSA-N -1 3 341.798 4.047 20 0 EIADHM Cc1ccc(NC(=O)Nc2ccc(F)c(F)c2F)c(Cl)c1[O-] ZINC001185331583 1052222789 /nfs/dbraw/zinc/22/27/89/1052222789.db2.gz VDMIKZIVRJMNBY-UHFFFAOYSA-N -1 3 330.693 4.415 20 0 EIADHM CC(C)(NC(=O)c1cc([O-])cc(C(F)(F)F)c1)c1cccc(F)c1 ZINC000622382542 1052239732 /nfs/dbraw/zinc/23/97/32/1052239732.db2.gz XAUCWEMIYJPSCM-UHFFFAOYSA-N -1 3 341.304 4.215 20 0 EIADHM Cc1cc(S(=O)(=O)[N-]c2ccnc(C3CCC3)c2)ccc1Cl ZINC001185500041 1052252117 /nfs/dbraw/zinc/25/21/17/1052252117.db2.gz WFQXGHSECUGQBN-UHFFFAOYSA-N -1 3 336.844 4.112 20 0 EIADHM O=C(Nc1ccc2c(c1)CCC2)Nc1ccc([O-])c(Br)c1 ZINC001185758081 1052293407 /nfs/dbraw/zinc/29/34/07/1052293407.db2.gz LJAYFSBWFWEZCX-UHFFFAOYSA-N -1 3 347.212 4.287 20 0 EIADHM O=C(Nc1ncccc1[O-])c1cc(Cl)ccc1OC1CCCC1 ZINC000622505142 1052304675 /nfs/dbraw/zinc/30/46/75/1052304675.db2.gz QITAVBLXOFAICB-UHFFFAOYSA-N -1 3 332.787 4.014 20 0 EIADHM CCc1cccc(C(=O)N(CC2CC2)c2ccc(OC)cc2)c1[O-] ZINC000622646926 1052369544 /nfs/dbraw/zinc/36/95/44/1052369544.db2.gz ZSBVPIJSYKHXMQ-UHFFFAOYSA-N -1 3 325.408 4.020 20 0 EIADHM CCCC[C@@H](C(=O)Nc1ccc(-c2nc(C)cc(=O)[n-]2)cc1)C(C)C ZINC000622790687 1052448048 /nfs/dbraw/zinc/44/80/48/1052448048.db2.gz YGRXVQMDRMVONO-QGZVFWFLSA-N -1 3 341.455 4.146 20 0 EIADHM CSc1nc2ccccc2c(C)c1[N-]C(=O)c1coc(C2CC2)n1 ZINC000622968643 1052559052 /nfs/dbraw/zinc/55/90/52/1052559052.db2.gz RHFIUWDFKGPQQK-UHFFFAOYSA-N -1 3 339.420 4.383 20 0 EIADHM Cc1nc(-c2cccs2)sc1C(=O)Nc1cc(F)ccc1[O-] ZINC000174885264 1052576864 /nfs/dbraw/zinc/57/68/64/1052576864.db2.gz RALOAMOPIYQEPX-UHFFFAOYSA-N -1 3 334.397 4.277 20 0 EIADHM Cc1cc(=O)[n-]c([C@@H](C)N[C@H](Cc2ccccc2)c2cccs2)n1 ZINC000192777959 1052638378 /nfs/dbraw/zinc/63/83/78/1052638378.db2.gz XMZHGPWPKWZASD-GDBMZVCRSA-N -1 3 339.464 4.187 20 0 EIADHM CCOc1cccc2cc([C@@H](C)N[C@H](C)c3nc(C)cc(=O)[n-]3)oc21 ZINC000192779915 1052638525 /nfs/dbraw/zinc/63/85/25/1052638525.db2.gz WIXUJKZEMIEQES-CHWSQXEVSA-N -1 3 341.411 4.047 20 0 EIADHM Cc1nc(C(F)(F)F)ccc1C(=O)Nc1ccc(Cl)cc1[O-] ZINC000179194782 1052725914 /nfs/dbraw/zinc/72/59/14/1052725914.db2.gz MJNVXUOIZQSQFN-UHFFFAOYSA-N -1 3 330.693 4.020 20 0 EIADHM CCOCc1nnc([N-]Cc2ccc(-c3ccc(Cl)cc3)o2)o1 ZINC000181847581 1052900341 /nfs/dbraw/zinc/90/03/41/1052900341.db2.gz IIIVOPBWVXKYGE-UHFFFAOYSA-N -1 3 333.775 4.132 20 0 EIADHM Nc1c(Cl)cc(NC(=O)c2cc([O-])ccc2Cl)cc1Cl ZINC000764416900 1053093455 /nfs/dbraw/zinc/09/34/55/1053093455.db2.gz JEHHVFSYYLGQQN-UHFFFAOYSA-N -1 3 331.586 4.187 20 0 EIADHM O=C([O-])c1coc(CN2CCC(Cc3ccc(Cl)cc3)CC2)c1 ZINC000864361834 1053251679 /nfs/dbraw/zinc/25/16/79/1053251679.db2.gz SAEOZPHHIBRCSV-UHFFFAOYSA-N -1 3 333.815 4.086 20 0 EIADHM COc1cccc(Cl)c1[N-]S(=O)(=O)c1cccc(C(C)C)c1 ZINC001195159375 1053308091 /nfs/dbraw/zinc/30/80/91/1053308091.db2.gz OYKHBOYHGAZABA-UHFFFAOYSA-N -1 3 339.844 4.273 20 0 EIADHM C[C@@H]1CCC[C@H]([C@@H](CNCc2csc(C3CC3)n2)CC(=O)[O-])C1 ZINC000864534228 1053310181 /nfs/dbraw/zinc/31/01/81/1053310181.db2.gz SJGWGJNBKWZQMY-VHDGCEQUSA-N -1 3 336.501 4.027 20 0 EIADHM O=C(Nc1cncc([O-])c1)c1ccc(-c2ccc3[nH]ccc3c2)cc1 ZINC001195868757 1053512243 /nfs/dbraw/zinc/51/22/43/1053512243.db2.gz ZPXWPPFVDJQWKZ-UHFFFAOYSA-N -1 3 329.359 4.188 20 0 EIADHM CC(C)[C@@H](NCc1cc(=O)oc2cc([O-])ccc12)c1ccccc1F ZINC000852447015 1053579777 /nfs/dbraw/zinc/57/97/77/1053579777.db2.gz PUAAGXSVMOBMAI-HXUWFJFHSA-N -1 3 341.382 4.125 20 0 EIADHM CC(=O)c1ccc([N-]C(=O)c2snc(Cl)c2Cl)c(F)c1 ZINC001196341967 1053644720 /nfs/dbraw/zinc/64/47/20/1053644720.db2.gz LKKFDVNZXXLPRN-UHFFFAOYSA-N -1 3 333.171 4.044 20 0 EIADHM O=C(Nc1ccccc1OC(F)F)c1cc([O-])c2ccccc2c1 ZINC000471637065 1053673043 /nfs/dbraw/zinc/67/30/43/1053673043.db2.gz XZCZVTADVIGNEJ-UHFFFAOYSA-N -1 3 329.302 4.399 20 0 EIADHM [O-]c1cc(Cl)ccc1NC(=S)NCc1ccccc1Cl ZINC001196823467 1053780254 /nfs/dbraw/zinc/78/02/54/1053780254.db2.gz AZEZLRLMURVBIP-UHFFFAOYSA-N -1 3 327.236 4.186 20 0 EIADHM Cc1c([N-]C(=O)c2noc(C(C)(C)C)n2)snc1-c1ccccc1 ZINC001196979709 1053817492 /nfs/dbraw/zinc/81/74/92/1053817492.db2.gz FPLPVXISZQAZIZ-UHFFFAOYSA-N -1 3 342.424 4.051 20 0 EIADHM Cc1ccc(CN(C)Cc2nc3c4ccccc4oc3c(=O)[n-]2)cc1 ZINC000024813894 1053818450 /nfs/dbraw/zinc/81/84/50/1053818450.db2.gz LUJAMUFCXUVPSI-UHFFFAOYSA-N -1 3 333.391 4.022 20 0 EIADHM O=C(Nc1c([O-])cccc1Cl)[C@@H](Cc1cccnc1)C1CCCC1 ZINC000868566945 1053916486 /nfs/dbraw/zinc/91/64/86/1053916486.db2.gz LIYSRVXTQAYDKV-HNNXBMFYSA-N -1 3 344.842 4.428 20 0 EIADHM O=S(=O)(Cc1c(F)cccc1F)[N-]c1ccc(-c2ccco2)cc1 ZINC001197600827 1053953383 /nfs/dbraw/zinc/95/33/83/1053953383.db2.gz RPPWCUPBPOZRNV-UHFFFAOYSA-N -1 3 349.358 4.167 20 0 EIADHM Cc1ccc2c(cccc2[N-]S(=O)(=O)Cc2c(F)cccc2F)c1 ZINC001197606939 1053956516 /nfs/dbraw/zinc/95/65/16/1053956516.db2.gz AZWIFAWYMMIADD-UHFFFAOYSA-N -1 3 347.386 4.368 20 0 EIADHM O=C([N-]c1nc(C2CCCCC2)cs1)c1conc1C(F)(F)F ZINC000869701779 1054025325 /nfs/dbraw/zinc/02/53/25/1054025325.db2.gz RDZNWFASSGFOTM-UHFFFAOYSA-N -1 3 345.346 4.450 20 0 EIADHM O=C(NCC1([C@@H]2CCCCO2)CCC1)c1cc2sccc2c([O-])c1 ZINC000871045817 1054149295 /nfs/dbraw/zinc/14/92/95/1054149295.db2.gz RMRNANHZZYZBLX-KRWDZBQOSA-N -1 3 345.464 4.076 20 0 EIADHM COc1ccc(CC[C@@H](C)NC(=O)c2cc([O-])c3ccccc3c2)cc1 ZINC000471879905 1054193546 /nfs/dbraw/zinc/19/35/46/1054193546.db2.gz IFIAHOTWCAGQSK-OAHLLOKOSA-N -1 3 349.430 4.305 20 0 EIADHM O=C(NCc1cccc(OC(F)F)c1)c1cc([O-])c2ccccc2c1 ZINC000471944302 1054204010 /nfs/dbraw/zinc/20/40/10/1054204010.db2.gz QSSWYNTZDJZXNH-UHFFFAOYSA-N -1 3 343.329 4.077 20 0 EIADHM O=C([N-]Cc1ccc(O)cc1)C(F)(F)c1cccc(Cl)c1Cl ZINC000857471768 1054262828 /nfs/dbraw/zinc/26/28/28/1054262828.db2.gz KHJMQYYJFRNWLX-UHFFFAOYSA-N -1 3 346.160 4.107 20 0 EIADHM Cc1cc(O)ccc1NC(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000857473939 1054266453 /nfs/dbraw/zinc/26/64/53/1054266453.db2.gz LFYUBOFMWDFHPZ-UHFFFAOYSA-N -1 3 333.387 4.249 20 0 EIADHM CCc1ccc(N(CC(C)C)C(=O)Cc2ccc([O-])c(F)c2)cc1 ZINC000857500757 1054285081 /nfs/dbraw/zinc/28/50/81/1054285081.db2.gz YFKUZEYQIBSMNL-UHFFFAOYSA-N -1 3 329.415 4.325 20 0 EIADHM Cc1cc(C[N-]C(=O)C(F)(F)c2cc(Cl)ccc2Cl)ccn1 ZINC000857519356 1054296039 /nfs/dbraw/zinc/29/60/39/1054296039.db2.gz XDRSCMBZUPDPFI-UHFFFAOYSA-N -1 3 345.176 4.105 20 0 EIADHM COc1ccc(S(=O)(=O)[N-]c2c(C)cc(Cl)cc2C)c(C)c1 ZINC001198943778 1054318824 /nfs/dbraw/zinc/31/88/24/1054318824.db2.gz QEJHACJNQSOXSA-UHFFFAOYSA-N -1 3 339.844 4.075 20 0 EIADHM O=C(OCc1ncc(-c2ccccc2)o1)c1cc(Cl)c(Cl)[n-]1 ZINC000011809827 1054322132 /nfs/dbraw/zinc/32/21/32/1054322132.db2.gz IZPRSHBJDAHAAX-UHFFFAOYSA-N -1 3 337.162 4.334 20 0 EIADHM Cc1cc(C)c(C(=O)COC(=O)c2cc(Cl)c(Cl)[n-]2)c(C)c1 ZINC000011809350 1054322522 /nfs/dbraw/zinc/32/25/22/1054322522.db2.gz LNSPRRLPGNVPPP-UHFFFAOYSA-N -1 3 340.206 4.286 20 0 EIADHM CCn1c2ccccc2nc1[C@@H](C)N[C@H](C)c1cccc([O-])c1F ZINC000872045215 1054359881 /nfs/dbraw/zinc/35/98/81/1054359881.db2.gz KAMBYJLDTMYXSJ-CHWSQXEVSA-N -1 3 327.403 4.313 20 0 EIADHM CC(=O)c1c(C)[nH]c(C(=O)Nc2ccc(Cl)cc2[O-])c1C(C)C ZINC000339007890 1054377534 /nfs/dbraw/zinc/37/75/34/1054377534.db2.gz VYRVRUNBQQNEDJ-UHFFFAOYSA-N -1 3 334.803 4.260 20 0 EIADHM C[C@@H](NCc1cc(C(F)(F)F)cc(Cl)n1)c1cccc([O-])c1F ZINC000872118874 1054398204 /nfs/dbraw/zinc/39/82/04/1054398204.db2.gz KPYDPUGQMWZKFM-MRVPVSSYSA-N -1 3 348.727 4.449 20 0 EIADHM Cc1oc(C(=O)[O-])cc1CN1CCC(Cc2ccc(Cl)cc2)CC1 ZINC000872164288 1054415723 /nfs/dbraw/zinc/41/57/23/1054415723.db2.gz RNNTVZKFDFVDIY-UHFFFAOYSA-N -1 3 347.842 4.394 20 0 EIADHM O=C([O-])c1ccc(CN2CCC(c3ccc(F)cc3)CC2)cc1F ZINC000872164001 1054416046 /nfs/dbraw/zinc/41/60/46/1054416046.db2.gz OFIWXGCQWSSVMM-UHFFFAOYSA-N -1 3 331.362 4.043 20 0 EIADHM O=C(Nc1cc([O-])cc(Cl)c1)c1cc(-c2ccccc2)cnc1F ZINC001199726460 1054452944 /nfs/dbraw/zinc/45/29/44/1054452944.db2.gz GFDFNIBRRBTCRR-UHFFFAOYSA-N -1 3 342.757 4.499 20 0 EIADHM Cc1nc2c(s1)[C@H]([N-]c1nc(-c3ccc(F)cc3)no1)CCC2 ZINC000858477400 1054496187 /nfs/dbraw/zinc/49/61/87/1054496187.db2.gz WOVODDIWHBXOJO-CYBMUJFWSA-N -1 3 330.388 4.130 20 0 EIADHM C[C@H](NCc1cccc([O-])c1Cl)c1ccc(C(F)(F)F)nc1 ZINC000873185289 1054505520 /nfs/dbraw/zinc/50/55/20/1054505520.db2.gz HQOSOVLIQHXTKN-VIFPVBQESA-N -1 3 330.737 4.310 20 0 EIADHM O=C(CCc1nc2ccccc2s1)Nc1cc(Cl)ccc1[O-] ZINC000060636157 1054714953 /nfs/dbraw/zinc/71/49/53/1054714953.db2.gz HWQYMLTZNRQLDC-UHFFFAOYSA-N -1 3 332.812 4.227 20 0 EIADHM CC(C)c1ccc2nc(-c3cccc(Br)c3)[n-]c(=O)c2c1 ZINC000060797346 1054722181 /nfs/dbraw/zinc/72/21/81/1054722181.db2.gz DXBCIXPKKHXNQC-UHFFFAOYSA-N -1 3 343.224 4.476 20 0 EIADHM O=c1[n-]c(CSc2nc3ccccc3[nH]2)nc2c3ccccc3oc21 ZINC000061124271 1054742807 /nfs/dbraw/zinc/74/28/07/1054742807.db2.gz UMWHUUZVVFXBGL-UHFFFAOYSA-N -1 3 348.387 4.250 20 0 EIADHM CCC(C)(C)C1CCC(NC(=O)c2cc(=O)c3ccccc3[n-]2)CC1 ZINC000061226329 1054748535 /nfs/dbraw/zinc/74/85/35/1054748535.db2.gz WSYPLBJHHSAXNT-UHFFFAOYSA-N -1 3 340.467 4.253 20 0 EIADHM C[C@H](NCc1cc(C(=O)[O-])cs1)c1ccccc1C(F)(F)F ZINC000902314218 1054779578 /nfs/dbraw/zinc/77/95/78/1054779578.db2.gz ZNBHSDQDHMTUQU-VIFPVBQESA-N -1 3 329.343 4.316 20 0 EIADHM COc1cc(F)c(NCc2cccc([O-])c2Br)cc1F ZINC001201873057 1054941888 /nfs/dbraw/zinc/94/18/88/1054941888.db2.gz ROGHFAUHFHKCIJ-UHFFFAOYSA-N -1 3 344.155 4.054 20 0 EIADHM CC(C)(C)OC(=O)c1ccc(NC(=O)Nc2ccccc2F)c([O-])c1 ZINC001202002759 1054992046 /nfs/dbraw/zinc/99/20/46/1054992046.db2.gz UZUIVBYHOKZPJJ-UHFFFAOYSA-N -1 3 346.358 4.131 20 0 EIADHM Cc1noc(C)c1[N-]C(=O)c1csc(-c2ccccc2Cl)n1 ZINC000066352530 1054996136 /nfs/dbraw/zinc/99/61/36/1054996136.db2.gz HIMGIILULRTKDJ-UHFFFAOYSA-N -1 3 333.800 4.321 20 0 EIADHM O=C(Nc1cc(Br)ccc1[O-])Nc1c(F)cccc1F ZINC001202042191 1055016145 /nfs/dbraw/zinc/01/61/45/1055016145.db2.gz RUYCAIPZVHGDGT-UHFFFAOYSA-N -1 3 343.127 4.077 20 0 EIADHM COc1cccc(-c2cc([N-]C(=O)Nc3ccccc3OC)on2)c1 ZINC001202113088 1055054868 /nfs/dbraw/zinc/05/48/68/1055054868.db2.gz FIBSXTRFVFNVJU-UHFFFAOYSA-N -1 3 339.351 4.003 20 0 EIADHM Cc1ccc([O-])c(CN[C@@H](C)c2ccc(C(F)(F)F)nc2Cl)n1 ZINC000862379764 1055059377 /nfs/dbraw/zinc/05/93/77/1055059377.db2.gz OGFHTGLZKDKBAV-VIFPVBQESA-N -1 3 345.752 4.014 20 0 EIADHM Cc1cccc([C@H]2CCCN2Cc2nnc(-c3ccccc3[O-])o2)c1 ZINC000877986553 1055169940 /nfs/dbraw/zinc/16/99/40/1055169940.db2.gz QCVQFNRUDPJKMY-QGZVFWFLSA-N -1 3 335.407 4.088 20 0 EIADHM Cc1ccccc1C1CCN(Cc2nnc(-c3ccccc3[O-])o2)CC1 ZINC000878082721 1055184381 /nfs/dbraw/zinc/18/43/81/1055184381.db2.gz XUQQCCQRVKTILU-UHFFFAOYSA-N -1 3 349.434 4.130 20 0 EIADHM C[C@H](c1cccc(F)c1)N1CCC(C(=O)c2ccc([O-])cc2)CC1 ZINC000616009587 1055251132 /nfs/dbraw/zinc/25/11/32/1055251132.db2.gz ZAIGLNAUXQYTRF-CQSZACIVSA-N -1 3 327.399 4.187 20 0 EIADHM CCc1cc2c(CSc3nc(C)cs3)cc(=O)oc2cc1[O-] ZINC000007196097 1055315477 /nfs/dbraw/zinc/31/54/77/1055315477.db2.gz CEIQSQPQXXZYBS-UHFFFAOYSA-N -1 3 333.434 4.118 20 0 EIADHM Cc1cccc2c1CC(C)(C)N(Cc1nnc(-c3ccccc3[O-])o1)C2 ZINC000878665604 1055370067 /nfs/dbraw/zinc/37/00/67/1055370067.db2.gz JEWLMOTXESUGLD-UHFFFAOYSA-N -1 3 349.434 4.088 20 0 EIADHM CC(C)(C)c1nnc([N-]C(=O)c2csc(-c3ccccc3)n2)s1 ZINC000055975802 1055830749 /nfs/dbraw/zinc/83/07/49/1055830749.db2.gz MCWVNFNOBKDXKR-UHFFFAOYSA-N -1 3 344.465 4.211 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)c1cccc(Oc2ccccc2)c1 ZINC000303749026 1056271148 /nfs/dbraw/zinc/27/11/48/1056271148.db2.gz BHXJVCRTZHWECN-UHFFFAOYSA-N -1 3 337.350 4.254 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)C1(c2ccc(Cl)cc2)CCCC1 ZINC000303790736 1056295663 /nfs/dbraw/zinc/29/56/63/1056295663.db2.gz JUGHRRXBPJRCED-UHFFFAOYSA-N -1 3 347.817 4.313 20 0 EIADHM CCC[C@]1(C)CCCN(Cc2nc3c4ccccc4oc3c(=O)[n-]2)C1 ZINC000072896129 1056506977 /nfs/dbraw/zinc/50/69/77/1056506977.db2.gz PUAFKQOKVRTLBT-HXUWFJFHSA-N -1 3 339.439 4.484 20 0 EIADHM FC(F)(F)[C@@H](C[C@H]1CCCO1)[N-]c1nc(C2CCCC2)ns1 ZINC000656227132 1056728597 /nfs/dbraw/zinc/72/85/97/1056728597.db2.gz JVNQDOVXCWVJDA-GHMZBOCLSA-N -1 3 335.395 4.108 20 0 EIADHM CC[C@@H](C)c1ccc(S(=O)(=O)[N-]c2ccc(OC)c(OC)c2)cc1 ZINC000007056288 1056762262 /nfs/dbraw/zinc/76/22/62/1056762262.db2.gz ZAAVOWGIHAIGMD-CYBMUJFWSA-N -1 3 349.452 4.018 20 0 EIADHM COc1cccc(-c2noc([N-][C@@H]3CSc4ccccc43)n2)c1 ZINC000742407994 1058606637 /nfs/dbraw/zinc/60/66/37/1058606637.db2.gz HBIWAGPWOSFZKR-CQSZACIVSA-N -1 3 325.393 4.004 20 0 EIADHM OCCCCCCCSc1nnc([N-]c2ccccc2F)s1 ZINC000742447206 1058624515 /nfs/dbraw/zinc/62/45/15/1058624515.db2.gz CAKACJCKLGYNSB-UHFFFAOYSA-N -1 3 341.477 4.456 20 0 EIADHM CCCc1ccc(C(=O)Oc2cccc(-c3nc(C)cc(=O)[n-]3)c2)cc1 ZINC000744219240 1059335841 /nfs/dbraw/zinc/33/58/41/1059335841.db2.gz PENNXNJVWSLDEV-UHFFFAOYSA-N -1 3 348.402 4.329 20 0 EIADHM Cc1cc(=O)[n-]c(-c2cccc(OC(=O)CCCC3CCCC3)c2)n1 ZINC000744218824 1059336157 /nfs/dbraw/zinc/33/61/57/1059336157.db2.gz UAVMPXRVLAWHIY-UHFFFAOYSA-N -1 3 340.423 4.424 20 0 EIADHM COC(=O)Nc1ccc(C(=O)O[C@H](C)c2ccc(Cl)cc2)cc1[O-] ZINC000745652302 1059865070 /nfs/dbraw/zinc/86/50/70/1059865070.db2.gz IAJKYZJDIAXTTJ-SNVBAGLBSA-N -1 3 349.770 4.142 20 0 EIADHM O=C(COc1cc(Cl)ccc1Cl)Nc1cc(Cl)ccc1[O-] ZINC000105323363 1060279798 /nfs/dbraw/zinc/27/97/98/1060279798.db2.gz CQJUPMPAKBMEDY-UHFFFAOYSA-N -1 3 346.597 4.370 20 0 EIADHM O=c1[n-]c(NCc2c(Cl)cncc2Cl)c(Cl)cc1Cl ZINC001169182876 1060689639 /nfs/dbraw/zinc/68/96/39/1060689639.db2.gz MGIFJPLIXSPNCV-UHFFFAOYSA-N -1 3 339.009 4.408 20 0 EIADHM Cc1nc(Nc2ccc(Cl)c([O-])c2)nc(Cl)c1Br ZINC001212588118 1060764249 /nfs/dbraw/zinc/76/42/49/1060764249.db2.gz FVBGPCMUOQOZBO-UHFFFAOYSA-N -1 3 349.015 4.304 20 0 EIADHM CCOc1cnc(Br)c(Nc2ccc(Cl)c([O-])c2)c1 ZINC001212589277 1060770246 /nfs/dbraw/zinc/77/02/46/1060770246.db2.gz DBSPSICGARWOBE-UHFFFAOYSA-N -1 3 343.608 4.345 20 0 EIADHM COC(=O)c1nc2ccccc2cc1Nc1ccc(Cl)c([O-])c1 ZINC001212591260 1060856705 /nfs/dbraw/zinc/85/67/05/1060856705.db2.gz CROWSHSDALFUSO-UHFFFAOYSA-N -1 3 328.755 4.124 20 0 EIADHM Nc1cc2c(ccn2-c2ccc(Cl)c([O-])c2)c(Br)c1 ZINC001212593614 1060912430 /nfs/dbraw/zinc/91/24/30/1060912430.db2.gz ANHOXSPZDYISQO-UHFFFAOYSA-N -1 3 337.604 4.334 20 0 EIADHM [O-]c1cccnc1CNc1ccc(-c2cc(Cl)ccc2Cl)nn1 ZINC001169733962 1060937116 /nfs/dbraw/zinc/93/71/16/1060937116.db2.gz RSBJGNSMARVQDP-UHFFFAOYSA-N -1 3 347.205 4.163 20 0 EIADHM COc1cc(Nc2ccc(Cl)c([O-])c2)ccc1-n1cnc(C)c1 ZINC001212594435 1060938340 /nfs/dbraw/zinc/93/83/40/1060938340.db2.gz ZEILYKVAMZDJPA-UHFFFAOYSA-N -1 3 329.787 4.292 20 0 EIADHM O=C(Nc1ccc(NCc2ncccc2[O-])cc1)Oc1ccccc1 ZINC001169737871 1060940068 /nfs/dbraw/zinc/94/00/68/1060940068.db2.gz WJSYNYZUYPFFRG-UHFFFAOYSA-N -1 3 335.363 4.010 20 0 EIADHM Cc1cc(=O)[n-]c(CSCc2nc(C3CCCCC3)cs2)n1 ZINC000766822340 1060949493 /nfs/dbraw/zinc/94/94/93/1060949493.db2.gz GOUNZOKIKGYWSY-UHFFFAOYSA-N -1 3 335.498 4.428 20 0 EIADHM CN1C(=O)CC(C)(C)c2cc(Nc3ccc(Cl)c([O-])c3)ccc21 ZINC001212595542 1060991584 /nfs/dbraw/zinc/99/15/84/1060991584.db2.gz YPJVAUCSSUZNLE-UHFFFAOYSA-N -1 3 330.815 4.433 20 0 EIADHM [O-]c1cc(Nc2ccccc2-c2nc(CO)cs2)ccc1Cl ZINC001212595512 1060992646 /nfs/dbraw/zinc/99/26/46/1060992646.db2.gz XLYOAQJHVWXXRV-UHFFFAOYSA-N -1 3 332.812 4.405 20 0 EIADHM O=C(Cc1ccc([O-])c(F)c1)Nc1ccc(COC2CCCC2)cc1 ZINC000449912305 1032118123 /nfs/dbraw/zinc/11/81/23/1032118123.db2.gz FFULGGOSJAKSCB-UHFFFAOYSA-N -1 3 343.398 4.172 20 0 EIADHM CCCCc1nnc([N-]C(=O)c2csc(-c3ccccc3)n2)s1 ZINC000025446672 1032157329 /nfs/dbraw/zinc/15/73/29/1032157329.db2.gz CKSZDIIPOCMTQW-UHFFFAOYSA-N -1 3 344.465 4.257 20 0 EIADHM CCN(Cc1ccc(Cl)c(Cl)c1)C(=O)c1ccc(O)cc1[O-] ZINC000193672632 1032167849 /nfs/dbraw/zinc/16/78/49/1032167849.db2.gz QFAUULLRALZPSV-UHFFFAOYSA-N -1 3 340.206 4.067 20 0 EIADHM Cc1nc(-c2ccc(NC(=O)N[C@H](C)CC(C)(C)C)cc2)cc(=O)[n-]1 ZINC000454362086 1032295561 /nfs/dbraw/zinc/29/55/61/1032295561.db2.gz QWAYQWLEQOIVKZ-GFCCVEGCSA-N -1 3 342.443 4.104 20 0 EIADHM Cc1ccc(C(=O)N2CCC[C@H](c3nc(C(C)C)cs3)C2)c([O-])c1 ZINC000172807156 1032335287 /nfs/dbraw/zinc/33/52/87/1032335287.db2.gz NZMGGCNZAIWWEP-AWEZNQCLSA-N -1 3 344.480 4.300 20 0 EIADHM O=C(COc1ccccc1C(F)(F)F)Nc1ccc(Cl)cc1[O-] ZINC000532836732 1032341191 /nfs/dbraw/zinc/34/11/91/1032341191.db2.gz BGVHYACYLYBNDG-UHFFFAOYSA-N -1 3 345.704 4.082 20 0 EIADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)C3=CC[C@@H](C)CC3)c2)n1 ZINC000454781149 1032491119 /nfs/dbraw/zinc/49/11/19/1032491119.db2.gz AKESVJTWNQLPPM-CYBMUJFWSA-N -1 3 337.423 4.097 20 0 EIADHM CSc1ccc(Cl)c(C(=O)Nc2n[n-]c(-c3ccc(C)o3)n2)c1 ZINC000177821064 1032508784 /nfs/dbraw/zinc/50/87/84/1032508784.db2.gz XMJXBHLADAZNBN-UHFFFAOYSA-N -1 3 348.815 4.001 20 0 EIADHM CC[C@@H](C)c1nc(C)c(CC(=O)Nc2cc(Cl)ccc2[O-])c(C)n1 ZINC000654936561 1019028094 /nfs/dbraw/zinc/02/80/94/1019028094.db2.gz ZRAWGBZOFLBLTD-SNVBAGLBSA-N -1 3 347.846 4.147 20 0 EIADHM Cc1ccc([N-]S(=O)(=O)c2cc(C)c(F)cc2Cl)c(F)c1 ZINC000471128398 1019038875 /nfs/dbraw/zinc/03/88/75/1019038875.db2.gz CHJBMTIDVLITLO-UHFFFAOYSA-N -1 3 331.771 4.036 20 0 EIADHM C[C@H](CCC[C@@H](C)C(=O)[O-])NCc1c(Cl)cccc1OC(F)F ZINC000683170299 1019082916 /nfs/dbraw/zinc/08/29/16/1019082916.db2.gz JDVXVQBTXLLWMR-GHMZBOCLSA-N -1 3 349.805 4.311 20 0 EIADHM CCSCc1cccc([N-]S(=O)(=O)c2ccc(F)cc2C)c1 ZINC000610193747 1019208476 /nfs/dbraw/zinc/20/84/76/1019208476.db2.gz GSBMFYJAKPQDFR-UHFFFAOYSA-N -1 3 339.457 4.188 20 0 EIADHM COc1cccc(-c2nc(-c3cccc(C(F)(F)F)c3)no2)c1[O-] ZINC000109036973 1019363363 /nfs/dbraw/zinc/36/33/63/1019363363.db2.gz DPHJRLUDNSVKFW-UHFFFAOYSA-N -1 3 336.269 4.137 20 0 EIADHM CC(C)c1ccc(NC(=O)NCc2ncccc2[O-])c(C(C)C)c1 ZINC000471182952 1019698106 /nfs/dbraw/zinc/69/81/06/1019698106.db2.gz VFKDGLCUTLBQQV-UHFFFAOYSA-N -1 3 327.428 4.356 20 0 EIADHM O=C(Nc1cc(F)ccc1[O-])c1cc(F)c(C(F)(F)F)c(F)c1 ZINC000683248466 1019733854 /nfs/dbraw/zinc/73/38/54/1019733854.db2.gz DSQNSCASHCEXBW-UHFFFAOYSA-N -1 3 335.203 4.081 20 0 EIADHM CC(C)n1ncc2ccc(NC(=O)c3cc([O-])ccc3Cl)cc21 ZINC000339648178 1019771931 /nfs/dbraw/zinc/77/19/31/1019771931.db2.gz QMRWVKJRRNZFNB-UHFFFAOYSA-N -1 3 329.787 4.229 20 0 EIADHM O=C([N-]c1c(F)cc(F)cc1F)c1cnc(Cc2ccccc2)s1 ZINC000087338249 1020259575 /nfs/dbraw/zinc/25/95/75/1020259575.db2.gz FXDHXKZZWSXCQE-UHFFFAOYSA-N -1 3 348.349 4.404 20 0 EIADHM CC(C)c1ccc(-c2nc(CN[C@@H](C)[C@@H](C)C(=O)[O-])cs2)cc1 ZINC000580085645 1021627274 /nfs/dbraw/zinc/62/72/74/1021627274.db2.gz WUMSVIBBJGYFLG-OLZOCXBDSA-N -1 3 332.469 4.132 20 0 EIADHM O=C(Nc1ccc2[nH]c(C(F)F)nc2c1)c1cc([O-])ccc1Cl ZINC000431814525 1021898605 /nfs/dbraw/zinc/89/86/05/1021898605.db2.gz PILLVXWTVKKIDA-UHFFFAOYSA-N -1 3 337.713 4.112 20 0 EIADHM O=C([O-])c1ccc(Cl)c(CN2CCC3(CCSCC3)CC2)c1 ZINC000634696009 1021978247 /nfs/dbraw/zinc/97/82/47/1021978247.db2.gz FWZSBMBIFWGNRF-UHFFFAOYSA-N -1 3 339.888 4.147 20 0 EIADHM CC(C)c1ncc(C(=O)[N-]c2nnc(/C=C\c3ccco3)s2)s1 ZINC000255717585 1022410097 /nfs/dbraw/zinc/41/00/97/1022410097.db2.gz WNEFKEYVGIBMJK-WAYWQWQTSA-N -1 3 346.437 4.134 20 0 EIADHM Cc1ccc([O-])c(CN[C@H](C)c2nc(-c3ccccc3)cs2)n1 ZINC000107321571 1022602702 /nfs/dbraw/zinc/60/27/02/1022602702.db2.gz ZKDZRAKYUMVFDO-CYBMUJFWSA-N -1 3 325.437 4.070 20 0 EIADHM CCn1c2ccccc2nc1[C@H](C)[N-]c1nnc(Cc2ccccc2)o1 ZINC000893192695 1022632280 /nfs/dbraw/zinc/63/22/80/1022632280.db2.gz YQLUZZWKECWWRL-AWEZNQCLSA-N -1 3 347.422 4.203 20 0 EIADHM O=C(Nc1ccc(-c2ncco2)cc1)c1cc([O-])c2ccccc2c1 ZINC000516518664 1022863247 /nfs/dbraw/zinc/86/32/47/1022863247.db2.gz NOSKJGZKEAAZJQ-UHFFFAOYSA-N -1 3 330.343 4.453 20 0 EIADHM Cc1ccc2c(c1)[C@H](NCc1cccc([O-])c1Br)CC2 ZINC000656497517 1023058724 /nfs/dbraw/zinc/05/87/24/1023058724.db2.gz FLOCBEHXHCGCFU-OAHLLOKOSA-N -1 3 332.241 4.240 20 0 EIADHM O=c1cc(CNc2ccccc2N2CCCCCC2)nc(C2CC2)[n-]1 ZINC000416991887 1023102522 /nfs/dbraw/zinc/10/25/22/1023102522.db2.gz GTAQEPTXSMEURY-UHFFFAOYSA-N -1 3 338.455 4.052 20 0 EIADHM Cc1ncc(-c2ccc(NC(=O)c3cc([O-])ccc3Cl)cc2)o1 ZINC000431920921 1023155670 /nfs/dbraw/zinc/15/56/70/1023155670.db2.gz HWZIWEHVYOJCTD-UHFFFAOYSA-N -1 3 328.755 4.261 20 0 EIADHM COc1ccc([C@H]2CCN(C(=O)c3ccc(C(C)C)cc3[O-])C2)cc1 ZINC000110067330 1033109588 /nfs/dbraw/zinc/10/95/88/1033109588.db2.gz AYTHHIVSAZORSE-KRWDZBQOSA-N -1 3 339.435 4.154 20 0 EIADHM [O-]C(=Cc1nc(-c2cccc3cccnc32)no1)c1ccccc1Cl ZINC001211646804 1023204883 /nfs/dbraw/zinc/20/48/83/1023204883.db2.gz ANAPYMAKXSMHRW-UHFFFAOYSA-N -1 3 349.777 4.364 20 0 EIADHM O=C([O-])c1ccc(CN2CC[C@@H](CSc3ccccc3)C2)c(F)c1 ZINC000581434909 1023214500 /nfs/dbraw/zinc/21/45/00/1023214500.db2.gz RPYCDMQSRLKOJR-CQSZACIVSA-N -1 3 345.439 4.138 20 0 EIADHM CCOc1ccccc1-c1noc(C=C([O-])c2ccccc2Cl)n1 ZINC001211647247 1023219976 /nfs/dbraw/zinc/21/99/76/1023219976.db2.gz KCSQKLZFIQIBCO-UHFFFAOYSA-N -1 3 342.782 4.214 20 0 EIADHM COc1cc(C)cc(-c2noc(C=C([O-])c3ccccc3Cl)n2)c1 ZINC001211647468 1023227398 /nfs/dbraw/zinc/22/73/98/1023227398.db2.gz RBUSRHGSLMAEFK-UHFFFAOYSA-N -1 3 342.782 4.132 20 0 EIADHM Cc1cc(-c2noc(C=C([O-])c3ccccc3Cl)n2)c(F)cc1F ZINC001211647619 1023233945 /nfs/dbraw/zinc/23/39/45/1023233945.db2.gz ZFKGRBCZHZZQET-UHFFFAOYSA-N -1 3 348.736 4.402 20 0 EIADHM O=C(N=c1cc(-c2cccc(Cl)c2)o[n-]1)c1cccc2[nH]ccc21 ZINC000581465255 1023246096 /nfs/dbraw/zinc/24/60/96/1023246096.db2.gz FDEMWVHRLZKYFZ-UHFFFAOYSA-N -1 3 337.766 4.151 20 0 EIADHM [O-]c1ccccc1-c1nc(-c2ccc(Oc3ccccc3)nc2)no1 ZINC000182499971 1023310873 /nfs/dbraw/zinc/31/08/73/1023310873.db2.gz SBMNYRSRBXUFIR-UHFFFAOYSA-N -1 3 331.331 4.297 20 0 EIADHM CC(C)Sc1c(Cl)cccc1NC([O-])=NO[C@@H]1CCCCO1 ZINC000160938983 1023340645 /nfs/dbraw/zinc/34/06/45/1023340645.db2.gz YUHOVQNLKDRZHE-CYBMUJFWSA-N -1 3 344.864 4.420 20 0 EIADHM CC(C)Sc1c(Cl)cccc1NC(=O)[N-]O[C@@H]1CCCCO1 ZINC000160938983 1023340651 /nfs/dbraw/zinc/34/06/51/1023340651.db2.gz YUHOVQNLKDRZHE-CYBMUJFWSA-N -1 3 344.864 4.420 20 0 EIADHM Cc1cc(F)c(CNC[C@@H](Cc2ccccc2C)C(=O)[O-])c(Cl)c1 ZINC000417575501 1023366222 /nfs/dbraw/zinc/36/62/22/1023366222.db2.gz XZIPQOBXQNACGW-OAHLLOKOSA-N -1 3 349.833 4.129 20 0 EIADHM Cc1cc(CN[C@H](CC(=O)[O-])c2cccc(C(F)(F)F)c2)cs1 ZINC000417592811 1023367488 /nfs/dbraw/zinc/36/74/88/1023367488.db2.gz UKQZSXXZTARUHJ-CQSZACIVSA-N -1 3 343.370 4.381 20 0 EIADHM CCC[C@@H](CCCCNCc1nc2c(s1)C[C@@H](C)CC2)C(=O)[O-] ZINC000417641413 1023394288 /nfs/dbraw/zinc/39/42/88/1023394288.db2.gz PXDXVIBRMRSLGZ-KBPBESRZSA-N -1 3 338.517 4.029 20 0 EIADHM CC[C@H](C)C[C@H](C)NC(=O)Nc1ccc(-c2cc(=O)[n-]c(C)n2)cc1 ZINC000341238630 1023425183 /nfs/dbraw/zinc/42/51/83/1023425183.db2.gz AROPHYLVZVVLFH-STQMWFEESA-N -1 3 342.443 4.104 20 0 EIADHM Cc1ccc(CN(C(=O)NCc2ccc([O-])c(F)c2)C(C)C)s1 ZINC000163704796 1023425458 /nfs/dbraw/zinc/42/54/58/1023425458.db2.gz WJXXOMGYWDJSNJ-UHFFFAOYSA-N -1 3 336.432 4.021 20 0 EIADHM C[C@@H]1CC(C)(C)N(C(=O)c2c[n-]c3ccccc3c2=O)c2ccccc21 ZINC001266773851 1023450424 /nfs/dbraw/zinc/45/04/24/1023450424.db2.gz BYXSXPAKPGJOFI-CQSZACIVSA-N -1 3 346.430 4.461 20 0 EIADHM CC[C@H](C)Oc1cccc(S(=O)(=O)[N-]c2c(C)cccc2F)c1 ZINC000656732829 1023472623 /nfs/dbraw/zinc/47/26/23/1023472623.db2.gz WTWMEBOEPIKAQJ-ZDUSSCGKSA-N -1 3 337.416 4.112 20 0 EIADHM O=C([O-])[C@@H]1CCN(Cc2cc(Cl)ccc2Cl)[C@@H]2CCCC[C@H]12 ZINC000656762471 1023503197 /nfs/dbraw/zinc/50/31/97/1023503197.db2.gz BBLREQZJQNPLKR-IIAWOOMASA-N -1 3 342.266 4.459 20 0 EIADHM CCC1(CC)CCCN(Cc2coc(-c3ccc(C(=O)[O-])cc3)n2)C1 ZINC000656764549 1023505998 /nfs/dbraw/zinc/50/59/98/1023505998.db2.gz YXMCFLSDQUEPHM-UHFFFAOYSA-N -1 3 342.439 4.442 20 0 EIADHM CC1(NC(=O)c2cc([O-])cc(C(F)(F)F)c2)CCC(F)(F)CC1 ZINC000623023881 1023514481 /nfs/dbraw/zinc/51/44/81/1023514481.db2.gz YGTPBOARIFGAHJ-UHFFFAOYSA-N -1 3 337.288 4.109 20 0 EIADHM Cc1ccc(C(=O)c2ccccc2C(=O)Nc2ccccc2[O-])cc1 ZINC000219131211 1023569787 /nfs/dbraw/zinc/56/97/87/1023569787.db2.gz YKBKLJXDUQDBBK-UHFFFAOYSA-N -1 3 331.371 4.184 20 0 EIADHM CSc1ccc([O-])c(C(=O)N2CCC(c3ccccc3F)CC2)c1 ZINC000668913222 1023587963 /nfs/dbraw/zinc/58/79/63/1023587963.db2.gz ZZGQQPHJEMTHGI-UHFFFAOYSA-N -1 3 345.439 4.273 20 0 EIADHM CCCOc1ccc(C=C(CC)c2nc(CCC)cc(=O)[n-]2)cc1 ZINC000581704483 1023625484 /nfs/dbraw/zinc/62/54/84/1023625484.db2.gz LBBQUWATIVJGNJ-DTQAZKPQSA-N -1 3 326.440 4.462 20 0 EIADHM CCSc1nccnc1C(=O)[N-]c1c(F)cc(Cl)c(C)c1F ZINC000430791126 1024043300 /nfs/dbraw/zinc/04/33/00/1024043300.db2.gz LNBHVOKNZIQYLY-UHFFFAOYSA-N -1 3 343.786 4.081 20 0 EIADHM C[C@@H](c1nc2ccccc2s1)N(C)C(=O)c1cc([O-])ccc1Cl ZINC000431021847 1024446229 /nfs/dbraw/zinc/44/62/29/1024446229.db2.gz DQVRUQXDVFDUPF-JTQLQIEISA-N -1 3 346.839 4.489 20 0 EIADHM CC(C)c1cccc(S(=O)(=O)[N-]c2cc(F)cc(F)c2F)c1 ZINC000431163074 1024753291 /nfs/dbraw/zinc/75/32/91/1024753291.db2.gz WEZNYPMQIISMDC-UHFFFAOYSA-N -1 3 329.343 4.028 20 0 EIADHM O=C([O-])[C@H](CCN(Cc1ccc(F)cc1F)C1CC1)c1ccccc1 ZINC000652388018 1024801243 /nfs/dbraw/zinc/80/12/43/1024801243.db2.gz LUUHEJGPQQSKOT-GOSISDBHSA-N -1 3 345.389 4.188 20 0 EIADHM CC(C)C[C@@H]1CCCCN1Cc1coc(-c2ccc(C(=O)[O-])cc2)n1 ZINC000652425685 1024826592 /nfs/dbraw/zinc/82/65/92/1024826592.db2.gz HALMNAVTJYQVLZ-SFHVURJKSA-N -1 3 342.439 4.440 20 0 EIADHM O=C([O-])c1ccc(CN2CCCC[C@@H]2Cc2ccccc2F)c(F)c1 ZINC000652507925 1024858435 /nfs/dbraw/zinc/85/84/35/1024858435.db2.gz RISYLZAZVFRNPF-QGZVFWFLSA-N -1 3 345.389 4.260 20 0 EIADHM CC(C)(C(=O)[O-])[C@@H]1CCCN(Cc2nc(-c3ccccc3)cs2)C1 ZINC000652498876 1024860650 /nfs/dbraw/zinc/86/06/50/1024860650.db2.gz XGMJMHHKTJEMNI-OAHLLOKOSA-N -1 3 344.480 4.133 20 0 EIADHM O=C(CCCSc1ccc(Cl)cc1)[N-]OCCC(F)(F)F ZINC000162867685 1024956014 /nfs/dbraw/zinc/95/60/14/1024956014.db2.gz IPKDEPBTCXBCSH-UHFFFAOYSA-N -1 3 341.782 4.213 20 0 EIADHM O=C([O-])[C@@H]1CN(CCSc2cccc(Cl)c2)Cc2ccccc21 ZINC000662221676 1024974803 /nfs/dbraw/zinc/97/48/03/1024974803.db2.gz BQJXAHKRRVJQGE-QGZVFWFLSA-N -1 3 347.867 4.116 20 0 EIADHM O=C([O-])C[C@@H](NCc1ccc(F)c(C(F)(F)F)c1)c1ccsc1 ZINC000276995540 1024980555 /nfs/dbraw/zinc/98/05/55/1024980555.db2.gz KMFJSAFWYLUDQQ-CYBMUJFWSA-N -1 3 347.333 4.212 20 0 EIADHM [O-]c1ccccc1-c1nc(-c2cccnc2Oc2ccccc2)no1 ZINC000184851948 1024982808 /nfs/dbraw/zinc/98/28/08/1024982808.db2.gz NXCHCMDQVGCFGB-UHFFFAOYSA-N -1 3 331.331 4.297 20 0 EIADHM CC1(C)C[C@H](Sc2nnc([N-]c3ccccc3F)s2)CO1 ZINC000657228223 1025309175 /nfs/dbraw/zinc/30/91/75/1025309175.db2.gz OTHFWXBXPOSSMD-VIFPVBQESA-N -1 3 325.434 4.080 20 0 EIADHM O=C(Cc1coc2ccc3ccccc3c12)[N-]OCc1ccccc1 ZINC000008096853 1025556629 /nfs/dbraw/zinc/55/66/29/1025556629.db2.gz ICHHLOODWDSRHO-UHFFFAOYSA-N -1 3 331.371 4.377 20 0 EIADHM Cc1ccc(-c2nc(CN[C@@H](C)CCCCC(=O)[O-])cs2)cc1 ZINC000426633023 1025819831 /nfs/dbraw/zinc/81/98/31/1025819831.db2.gz ATXZPPUOBQFNGR-AWEZNQCLSA-N -1 3 332.469 4.242 20 0 EIADHM O=C(CSc1ccc2c(c1)CCC2)Nc1cc(Cl)ccc1[O-] ZINC000111210721 1026098663 /nfs/dbraw/zinc/09/86/63/1026098663.db2.gz QNTJDCHLYLUPBL-UHFFFAOYSA-N -1 3 333.840 4.265 20 0 EIADHM Cc1cc([C@H](C)N2CCC(Cc3ccccc3F)CC2)oc1C(=O)[O-] ZINC000564662425 1026122453 /nfs/dbraw/zinc/12/24/53/1026122453.db2.gz ZCBQRZLMYULFJW-AWEZNQCLSA-N -1 3 345.414 4.441 20 0 EIADHM CC[C@H](C)n1ncc(NC(=O)c2cc([O-])ccc2Cl)c1C1CC1 ZINC000344360991 1026274875 /nfs/dbraw/zinc/27/48/75/1026274875.db2.gz KIPKSCXDVMJFTJ-JTQLQIEISA-N -1 3 333.819 4.343 20 0 EIADHM C[C@H](c1ncc(-c2ccc(Cl)cc2)o1)N1CCC[C@@](C)(C(=O)[O-])C1 ZINC000563277256 1026312112 /nfs/dbraw/zinc/31/21/12/1026312112.db2.gz NMKYEBYKMSHFBU-KZULUSFZSA-N -1 3 348.830 4.243 20 0 EIADHM Cc1n[nH]c(C)c1[C@H]1CCCCCN1C(=O)c1cc([O-])ccc1Cl ZINC000344583483 1026467654 /nfs/dbraw/zinc/46/76/54/1026467654.db2.gz VJCYLSURDQHBPY-MRXNPFEDSA-N -1 3 347.846 4.143 20 0 EIADHM Cc1cc(=O)[n-]c([C@H](C)N2CCC([C@@H](F)c3ccccc3F)CC2)n1 ZINC000511105548 1026511877 /nfs/dbraw/zinc/51/18/77/1026511877.db2.gz JDKHQUQGEAGAOC-SCLBCKFNSA-N -1 3 347.409 4.114 20 0 EIADHM Cc1cc(=O)[n-]c([C@@H](C)N2CCC([C@@H](F)c3ccccc3F)CC2)n1 ZINC000511105547 1026512518 /nfs/dbraw/zinc/51/25/18/1026512518.db2.gz JDKHQUQGEAGAOC-FZKQIMNGSA-N -1 3 347.409 4.114 20 0 EIADHM O=C([O-])C[C@H](NCc1cccs1)c1cc(Cl)cc(Cl)c1 ZINC000426755649 1026542179 /nfs/dbraw/zinc/54/21/79/1026542179.db2.gz DUEPDIDKRNYXHU-ZDUSSCGKSA-N -1 3 330.236 4.361 20 0 EIADHM Cc1cc(Cl)ccc1CN[C@H](C(=O)[O-])c1ccc(Cl)c(F)c1 ZINC000426760434 1026545391 /nfs/dbraw/zinc/54/53/91/1026545391.db2.gz RGDYUBJYECQUBK-HNNXBMFYSA-N -1 3 342.197 4.356 20 0 EIADHM O=C([O-])[C@@H](NCc1ccc(Cl)c(Cl)c1)c1ccc(F)cc1 ZINC000426783171 1026555757 /nfs/dbraw/zinc/55/57/57/1026555757.db2.gz IZHGVHFVLCCGOB-AWEZNQCLSA-N -1 3 328.170 4.048 20 0 EIADHM CC(=O)Nc1ccc(C)cc1NC(=O)c1cc([O-])c2ccccc2c1 ZINC000349528779 1026558360 /nfs/dbraw/zinc/55/83/60/1026558360.db2.gz MEGRDPLRYWVQQP-UHFFFAOYSA-N -1 3 334.375 4.065 20 0 EIADHM CCCOc1cccc(CN[C@H](CC(=O)[O-])c2cccc(Cl)c2)c1 ZINC000426806256 1026560345 /nfs/dbraw/zinc/56/03/45/1026560345.db2.gz JAEODLBTNFIWRE-GOSISDBHSA-N -1 3 347.842 4.434 20 0 EIADHM COc1cccc([C@H](CC(=O)[O-])NCc2ccc(C(C)C)cc2)c1 ZINC000426767893 1026561564 /nfs/dbraw/zinc/56/15/64/1026561564.db2.gz RTQVVNPSWWNBKT-IBGZPJMESA-N -1 3 327.424 4.124 20 0 EIADHM Cc1cc([C@@H](NCc2ccc(Cl)c(F)c2)C(=O)[O-])ccc1Cl ZINC000426829749 1026572422 /nfs/dbraw/zinc/57/24/22/1026572422.db2.gz RITYSGNHHFUGTJ-OAHLLOKOSA-N -1 3 342.197 4.356 20 0 EIADHM Cc1cc2[nH]c(CN[C@H](CC(=O)[O-])c3ccc(F)cc3)cc2c(C)c1 ZINC000426835162 1026594788 /nfs/dbraw/zinc/59/47/88/1026594788.db2.gz QFSJZHOVAWDOBU-GOSISDBHSA-N -1 3 340.398 4.229 20 0 EIADHM CN(Cc1cccc(Br)c1)Cc1c(F)ccc([O-])c1F ZINC000507189140 1026681629 /nfs/dbraw/zinc/68/16/29/1026681629.db2.gz TWDXDEAUCFYHIE-UHFFFAOYSA-N -1 3 342.183 4.065 20 0 EIADHM Cc1ccc([O-])c(CN(C)[C@H](C)c2ccccc2Br)n1 ZINC000507222401 1026708255 /nfs/dbraw/zinc/70/82/55/1026708255.db2.gz UFGMTMUXUXGWIQ-GFCCVEGCSA-N -1 3 335.245 4.051 20 0 EIADHM CCC(C)(C)c1ccc(NC(=O)CCc2c(C)nc(C)[n-]c2=O)cc1 ZINC000344992281 1026742860 /nfs/dbraw/zinc/74/28/60/1026742860.db2.gz ZLDSZAIFRSMINL-UHFFFAOYSA-N -1 3 341.455 4.058 20 0 EIADHM Cc1ccc(OC2CCN(Cc3c(F)ccc([O-])c3F)CC2)cc1 ZINC000507352863 1026757362 /nfs/dbraw/zinc/75/73/62/1026757362.db2.gz MQRGJSBXFVAWAY-UHFFFAOYSA-N -1 3 333.378 4.022 20 0 EIADHM O=C([N-]c1nnc(C(F)(F)F)s1)c1cc2ccccc2s1 ZINC000031565030 1026844996 /nfs/dbraw/zinc/84/49/96/1026844996.db2.gz NJUKNGSKLYDDTP-UHFFFAOYSA-N -1 3 329.328 4.024 20 0 EIADHM CC(=O)c1cc([N-]S(=O)(=O)c2ccc(CC(C)C)cc2)ccc1F ZINC000507606425 1026846638 /nfs/dbraw/zinc/84/66/38/1026846638.db2.gz PTFGYZVNVSXAOA-UHFFFAOYSA-N -1 3 349.427 4.028 20 0 EIADHM C/C(=C/c1ccccc1)CN(C)C(=O)CCCc1ccc([O-])c(F)c1 ZINC000427530759 1026883505 /nfs/dbraw/zinc/88/35/05/1026883505.db2.gz LDDMNOCUVUZCSC-SSZFMOIBSA-N -1 3 341.426 4.416 20 0 EIADHM CC(C)c1ccc2nc(-c3ccnc(OC(F)F)c3)[n-]c(=O)c2c1 ZINC000507711202 1026884678 /nfs/dbraw/zinc/88/46/78/1026884678.db2.gz XFHUDGCIWFTEDM-UHFFFAOYSA-N -1 3 331.322 4.122 20 0 EIADHM [O-]c1ccc(CNc2ncnc3sc4ccccc4c32)cc1F ZINC000440642210 1026997208 /nfs/dbraw/zinc/99/72/08/1026997208.db2.gz CNKMNGBORFHNQR-UHFFFAOYSA-N -1 3 325.368 4.301 20 0 EIADHM O=C(Nc1ccc([O-])c(C(F)(F)F)c1)c1cc2cc(F)ccc2[nH]1 ZINC000440994790 1027179659 /nfs/dbraw/zinc/17/96/59/1027179659.db2.gz UWBLLSFFCMBSNI-UHFFFAOYSA-N -1 3 338.260 4.284 20 0 EIADHM CCc1ccc(S(=O)(=O)[N-]c2ccc(C(F)(F)F)cc2)cc1 ZINC000014225355 1027492243 /nfs/dbraw/zinc/49/22/43/1027492243.db2.gz IAMFMVMQYPXTDH-UHFFFAOYSA-N -1 3 329.343 4.069 20 0 EIADHM CCCC(=O)Nc1cccc(NC(=O)c2cc([O-])ccc2Cl)c1 ZINC000582851341 1027506700 /nfs/dbraw/zinc/50/67/00/1027506700.db2.gz MKISQGDHOLAXMJ-UHFFFAOYSA-N -1 3 332.787 4.037 20 0 EIADHM Cc1cc(F)ccc1[N-]S(=O)(=O)c1ccc(OC(C)C)c(C)c1 ZINC000614750386 1027531149 /nfs/dbraw/zinc/53/11/49/1027531149.db2.gz GBIZBBJGRZVSFU-UHFFFAOYSA-N -1 3 337.416 4.031 20 0 EIADHM O=C(Nc1cc(Br)ccc1[O-])c1cc(F)cc(Cl)c1 ZINC000532055018 1027562067 /nfs/dbraw/zinc/56/20/67/1027562067.db2.gz MSNSBMUSECDUMU-UHFFFAOYSA-N -1 3 344.567 4.200 20 0 EIADHM CC(=O)c1ccc(C(=O)N2CC[C@H](C)Sc3ccccc32)cc1[O-] ZINC000665859426 1027790530 /nfs/dbraw/zinc/79/05/30/1027790530.db2.gz UMARQGCBODOQHZ-LBPRGKRZSA-N -1 3 341.432 4.126 20 0 EIADHM COc1cc(C)c(NC(=O)CCCc2ccc([O-])c(F)c2)cc1C ZINC000444619418 1027896746 /nfs/dbraw/zinc/89/67/46/1027896746.db2.gz XOMQAGBVGCXTHE-UHFFFAOYSA-N -1 3 331.387 4.118 20 0 EIADHM CCC(C)(C)c1ccc(CNC(=O)c2cc(=O)c3ccccc3[n-]2)cc1 ZINC000443963300 1028103230 /nfs/dbraw/zinc/10/32/30/1028103230.db2.gz UEKKTHFGCMTICX-UHFFFAOYSA-N -1 3 348.446 4.146 20 0 EIADHM O=C(NC1(c2ccc(F)cc2F)CCC1)c1cc([O-])ccc1Cl ZINC000583175175 1028172759 /nfs/dbraw/zinc/17/27/59/1028172759.db2.gz LTGWHIDMHNZOFY-UHFFFAOYSA-N -1 3 337.753 4.133 20 0 EIADHM Cc1sc2nc(C)nc(S[C@H](C)c3nc(C)cc(=O)[n-]3)c2c1C ZINC000346585568 1028531433 /nfs/dbraw/zinc/53/14/33/1028531433.db2.gz HENRAQPDSSOGGV-SNVBAGLBSA-N -1 3 346.481 4.274 20 0 EIADHM CC(C)(C)c1cc(Nc2ccc(S(=O)(=O)[O-])cc2Cl)ccn1 ZINC001213168601 1028613360 /nfs/dbraw/zinc/61/33/60/1028613360.db2.gz NFCGHZQCLIZMSV-UHFFFAOYSA-N -1 3 340.832 4.023 20 0 EIADHM O=c1[n-]c(-c2nnc(-c3ccccc3)s2)nc2cc(Cl)ccc12 ZINC000445481867 1028628067 /nfs/dbraw/zinc/62/80/67/1028628067.db2.gz JZOZUQINWQWAOV-UHFFFAOYSA-N -1 3 340.795 4.174 20 0 EIADHM CC[C@H](Oc1cccc([O-])c1I)C(C)(C)C ZINC001227379715 1028935097 /nfs/dbraw/zinc/93/50/97/1028935097.db2.gz HMSXPBLLKYJELA-NSHDSACASA-N -1 3 334.197 4.200 20 0 EIADHM Cc1cc(-n2c([O-])c(CC(F)(F)F)[nH]c2=O)ccc1-c1ccccc1 ZINC000445921904 1028999859 /nfs/dbraw/zinc/99/98/59/1028999859.db2.gz OVKKCWIQKOHZAK-HNNXBMFYSA-N -1 3 348.324 4.039 20 0 EIADHM C[C@@H]1CCC[C@@H](CCN(CCC(=O)[O-])Cc2cccc(F)c2F)C1 ZINC000583758083 1029132642 /nfs/dbraw/zinc/13/26/42/1029132642.db2.gz SRGTZSJSYMWLFF-CABCVRRESA-N -1 3 339.426 4.458 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@@H]3CCCC[C@H]3CC)nc2)n1 ZINC000524685219 1029154675 /nfs/dbraw/zinc/15/46/75/1029154675.db2.gz MTPLIHZKUCVPKA-CZUORRHYSA-N -1 3 326.444 4.187 20 0 EIADHM CCc1ccc([O-])c(C(=O)N2CC[C@H](CSc3ccccc3)C2)c1 ZINC000524744813 1029200219 /nfs/dbraw/zinc/20/02/19/1029200219.db2.gz KWDLTBHAIKHFOO-INIZCTEOSA-N -1 3 341.476 4.209 20 0 EIADHM C[C@@H](NCc1cccc([O-])c1Cl)c1ccccc1OC(F)F ZINC000294159958 1029200733 /nfs/dbraw/zinc/20/07/33/1029200733.db2.gz PJDSRPLSVKOWJV-SNVBAGLBSA-N -1 3 327.758 4.498 20 0 EIADHM CCC[C@@H]([N-]S(=O)(=O)c1cccc(Cl)c1Cl)C(C)(C)C ZINC001211894522 1029312568 /nfs/dbraw/zinc/31/25/68/1029312568.db2.gz RONDVBTZSYMIKM-GFCCVEGCSA-N -1 3 338.300 4.487 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])[C@@H]1CCCCN1Cc1ccccc1 ZINC000524916715 1029327661 /nfs/dbraw/zinc/32/76/61/1029327661.db2.gz PYGTZZLBWKSMJO-KRWDZBQOSA-N -1 3 344.842 4.039 20 0 EIADHM [O-]c1cc2ccccc2cc1-c1nc([C@@H]2CCOC3(CCC3)C2)no1 ZINC000897111100 1029425814 /nfs/dbraw/zinc/42/58/14/1029425814.db2.gz STPKMDAHBFRJGB-OAHLLOKOSA-N -1 3 336.391 4.412 20 0 EIADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)[C@H](C)CC(C)(C)C)c2)n1 ZINC000475376862 1029597972 /nfs/dbraw/zinc/59/79/72/1029597972.db2.gz YXFHUUBBZHVQJG-CYBMUJFWSA-N -1 3 341.455 4.422 20 0 EIADHM COc1ccc(CCCN(C)Cc2cccc(C(=O)[O-])c2Cl)cc1 ZINC000565103244 1029601290 /nfs/dbraw/zinc/60/12/90/1029601290.db2.gz JEQRHJCAMDGEJB-UHFFFAOYSA-N -1 3 347.842 4.111 20 0 EIADHM Cc1ccccc1C[C@@H](C)N(C)C(=O)CCCc1ccc([O-])c(F)c1 ZINC000447067212 1029681162 /nfs/dbraw/zinc/68/11/62/1029681162.db2.gz HKPJNHCPPOYJQH-MRXNPFEDSA-N -1 3 343.442 4.252 20 0 EIADHM CC(C)Oc1cccc(CN(C)C(=O)c2cc([O-])ccc2Cl)c1 ZINC000343737091 1029727014 /nfs/dbraw/zinc/72/70/14/1029727014.db2.gz SYWUCHNZSHRVAN-UHFFFAOYSA-N -1 3 333.815 4.105 20 0 EIADHM C[C@@H]1CN(Cc2nc3c4ccccc4oc3c(=O)[n-]2)[C@@H]1c1ccccc1 ZINC000081573310 1029805537 /nfs/dbraw/zinc/80/55/37/1029805537.db2.gz HMLVGZGMFGUVRV-YJYMSZOUSA-N -1 3 345.402 4.275 20 0 EIADHM O=C(Nc1c([O-])cccc1Cl)c1cc(-c2ccc(F)cc2)on1 ZINC000584402119 1029825273 /nfs/dbraw/zinc/82/52/73/1029825273.db2.gz WFLMSXLHDNTAFK-UHFFFAOYSA-N -1 3 332.718 4.092 20 0 EIADHM Cc1cc(C)cc(-c2nc3ccc(Br)cc3c(=O)[n-]2)c1 ZINC000525713755 1029949914 /nfs/dbraw/zinc/94/99/14/1029949914.db2.gz BUJCILBPZQECSS-UHFFFAOYSA-N -1 3 329.197 4.382 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@@H](CC)C3CCCC3)nc2)n1 ZINC000450873961 1030063629 /nfs/dbraw/zinc/06/36/29/1030063629.db2.gz LHSICZHQQWRTMS-INIZCTEOSA-N -1 3 326.444 4.187 20 0 EIADHM Cc1cc(S(=O)(=O)[N-]CC2(C)CCC(C)(C)CC2)c(F)cc1F ZINC001212179753 1030066756 /nfs/dbraw/zinc/06/67/56/1030066756.db2.gz KUZBZHJVLPQAQU-UHFFFAOYSA-N -1 3 345.455 4.158 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N(C)Cc3ccc(C)c(C)c3)nc2)n1 ZINC000450936345 1030113119 /nfs/dbraw/zinc/11/31/19/1030113119.db2.gz VIIGPDNBTDLXOM-UHFFFAOYSA-N -1 3 348.450 4.060 20 0 EIADHM Cc1c(C(=O)Nc2ccc(Cl)cc2[O-])cnn1-c1ccccc1C ZINC000536219125 1030114342 /nfs/dbraw/zinc/11/43/42/1030114342.db2.gz IIPOHEXBZWJBJT-UHFFFAOYSA-N -1 3 341.798 4.100 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N3CC[C@@H](CC(C)(C)C)C3)nc2)n1 ZINC000450943697 1030124132 /nfs/dbraw/zinc/12/41/32/1030124132.db2.gz IKYYBNAHYWNOOV-AWEZNQCLSA-N -1 3 340.471 4.069 20 0 EIADHM C[C@H]1CC(C(=O)[O-])C[C@H](C)N1Cc1csc(-c2ccc(F)cc2)n1 ZINC000530178472 1030202164 /nfs/dbraw/zinc/20/21/64/1030202164.db2.gz JEPPJCRNZXYMGH-RYUDHWBXSA-N -1 3 348.443 4.023 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)N[C@H](c1ccccc1)C1CC1 ZINC000468409108 1030508172 /nfs/dbraw/zinc/50/81/72/1030508172.db2.gz RXXIUKSMIVRTDY-HXUWFJFHSA-N -1 3 327.399 4.122 20 0 EIADHM Cc1c2ccccc2oc1C(=O)Nc1cc(Br)ccc1[O-] ZINC000530678200 1030647929 /nfs/dbraw/zinc/64/79/29/1030647929.db2.gz FRNPLLHMDLNAFH-UHFFFAOYSA-N -1 3 346.180 4.462 20 0 EIADHM Cc1ccc([C@H]2C[C@H](C)N(Cc3nc(=O)c4sccc4[n-]3)C2)cc1 ZINC000278782642 1030711758 /nfs/dbraw/zinc/71/17/58/1030711758.db2.gz XLKHWNIEIWCMBR-ZFWWWQNUSA-N -1 3 339.464 4.083 20 0 EIADHM Cc1ccc([C@@H]2C[C@H](C)N(Cc3nc(=O)c4sccc4[n-]3)C2)cc1 ZINC000278782635 1030711816 /nfs/dbraw/zinc/71/18/16/1030711816.db2.gz XLKHWNIEIWCMBR-DZGCQCFKSA-N -1 3 339.464 4.083 20 0 EIADHM CC[C@@H](N[C@@H](CCO)c1ccco1)c1ccc(Cl)c(Cl)c1[O-] ZINC000186421653 1030721440 /nfs/dbraw/zinc/72/14/40/1030721440.db2.gz VZNICZABIDPZBC-OLZOCXBDSA-N -1 3 344.238 4.456 20 0 EIADHM CSc1ccc([O-])c(C(=O)N2CC[C@@H](c3ccccc3)[C@@H]2C)c1 ZINC000612072113 1030847388 /nfs/dbraw/zinc/84/73/88/1030847388.db2.gz VGVYHPPRZKUVKN-XJKSGUPXSA-N -1 3 327.449 4.132 20 0 EIADHM C[C@@H](NCc1cccc(C(=O)[O-])c1)c1ccc(OCC2CC2)c(F)c1 ZINC000263403074 1030852417 /nfs/dbraw/zinc/85/24/17/1030852417.db2.gz IVGBDZFWRWPZRT-CYBMUJFWSA-N -1 3 343.398 4.164 20 0 EIADHM COc1ccc2oc([C@@H](C)NCc3cccc(C(=O)[O-])c3)c(C)c2c1 ZINC000263446253 1030872576 /nfs/dbraw/zinc/87/25/76/1030872576.db2.gz XXWGNJJELBFTSD-CYBMUJFWSA-N -1 3 339.391 4.299 20 0 EIADHM Cc1ccc([N-]S(=O)(=O)c2cccc3cc(C)cnc32)c(Cl)c1 ZINC000023371218 1030942220 /nfs/dbraw/zinc/94/22/20/1030942220.db2.gz IUDZCRZZGOPNJM-UHFFFAOYSA-N -1 3 346.839 4.306 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)NCC[C@H]1CCc2ccccc21 ZINC000452320704 1030944147 /nfs/dbraw/zinc/94/41/47/1030944147.db2.gz WPGBPYQUXYDOGI-QGZVFWFLSA-N -1 3 341.426 4.090 20 0 EIADHM Cc1ccc([C@@H](C)NC(=O)CCCc2ccc([O-])c(F)c2)cc1F ZINC000452327618 1030954907 /nfs/dbraw/zinc/95/49/07/1030954907.db2.gz PKWOACLOIIKDJA-CYBMUJFWSA-N -1 3 333.378 4.179 20 0 EIADHM O=C(Cc1ccc([O-])c(F)c1)N1CCC[C@H]1c1ccccc1Cl ZINC000448744780 1031029160 /nfs/dbraw/zinc/02/91/60/1031029160.db2.gz BHVQLABPHIYOAR-INIZCTEOSA-N -1 3 333.790 4.091 20 0 EIADHM O=C(Cc1ccc([O-])c(F)c1)N1CCC[C@@H]1c1ccccc1Cl ZINC000448744782 1031031659 /nfs/dbraw/zinc/03/16/59/1031031659.db2.gz BHVQLABPHIYOAR-MRXNPFEDSA-N -1 3 333.790 4.091 20 0 EIADHM CC[C@H]1CCCN(Cc2ccc(C(=O)[O-])cc2Br)CC1 ZINC000226732183 1031104883 /nfs/dbraw/zinc/10/48/83/1031104883.db2.gz CDQKITOCCFFFRA-LBPRGKRZSA-N -1 3 340.261 4.159 20 0 EIADHM CC(C)(C)c1nnc([N-]C(=O)c2ccsc2C(F)(F)F)s1 ZINC000528123811 1031159320 /nfs/dbraw/zinc/15/93/20/1031159320.db2.gz FLZUNAILPXVUQX-UHFFFAOYSA-N -1 3 335.376 4.168 20 0 EIADHM C[C@H](Oc1cccc(Cl)c1Cl)C(=O)Nc1cc(F)ccc1[O-] ZINC000531373991 1031160687 /nfs/dbraw/zinc/16/06/87/1031160687.db2.gz TZOJMRAEXWKNRQ-QMMMGPOBSA-N -1 3 344.169 4.244 20 0 EIADHM CC(C)Cc1nnc([N-]C(=O)c2ccsc2C(F)(F)F)s1 ZINC000528142700 1031199585 /nfs/dbraw/zinc/19/95/85/1031199585.db2.gz XKCSQUICYHGESJ-UHFFFAOYSA-N -1 3 335.376 4.069 20 0 EIADHM CCSc1ccc([C@H](C)NC(=O)Cc2ccc([O-])c(F)c2)cc1 ZINC000448915897 1031240069 /nfs/dbraw/zinc/24/00/69/1031240069.db2.gz VKGGQPXOSWTNRO-LBPRGKRZSA-N -1 3 333.428 4.063 20 0 EIADHM CCc1ccc(C(=O)N2[C@H](C)[C@H](CC(F)(F)F)C[C@@H]2C)c([O-])c1 ZINC000452666924 1031245667 /nfs/dbraw/zinc/24/56/67/1031245667.db2.gz ULZSCDANTMXOPY-LOWVWBTDSA-N -1 3 329.362 4.146 20 0 EIADHM CO[C@H](C)c1cccc(NCc2cccc([O-])c2Br)c1 ZINC000459344990 1031867529 /nfs/dbraw/zinc/86/75/29/1031867529.db2.gz CAFFEVDJAVEAQV-LLVKDONJSA-N -1 3 336.229 4.474 20 0 EIADHM Cc1nc(C(C)C)sc1[C@@H](C)N(C)Cc1cc(=O)[n-]c(C2CC2)n1 ZINC000459366275 1031954517 /nfs/dbraw/zinc/95/45/17/1031954517.db2.gz BRLDVIGOQJCKDQ-GFCCVEGCSA-N -1 3 346.500 4.141 20 0 EIADHM CCOc1ccc([N-]S(=O)(=O)c2ccc(CC)cc2)cc1Cl ZINC000614841494 1032017365 /nfs/dbraw/zinc/01/73/65/1032017365.db2.gz OTXKZDDINZITSE-UHFFFAOYSA-N -1 3 339.844 4.102 20 0 EIADHM Cc1noc(C2CC2)c1[N-]C(=O)c1sc2ncccc2c1Cl ZINC000529010432 1032028049 /nfs/dbraw/zinc/02/80/49/1032028049.db2.gz PNGYXDAXLUOJPI-UHFFFAOYSA-N -1 3 333.800 4.376 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1ccc(Cl)c2cccnc12 ZINC000303402550 1033755915 /nfs/dbraw/zinc/75/59/15/1033755915.db2.gz PFFJFUFEUXOKMH-UHFFFAOYSA-N -1 3 333.174 4.500 20 0 EIADHM Cc1ccc(C[C@@H](C)NC(=O)CCCc2ccc([O-])c(F)c2)c(C)c1 ZINC000469006986 1033830957 /nfs/dbraw/zinc/83/09/57/1033830957.db2.gz RHXRNFZVFYSNOR-MRXNPFEDSA-N -1 3 343.442 4.218 20 0 EIADHM CCCN(CCC)C(=O)c1ccc(Nc2ncc(Cl)cc2[O-])cc1 ZINC001211762140 1033851156 /nfs/dbraw/zinc/85/11/56/1033851156.db2.gz BHOSGJMJYZXLHY-UHFFFAOYSA-N -1 3 347.846 4.446 20 0 EIADHM Cc1cccc(C(=O)Nc2c(-c3cccs3)nc3ccccn32)c1[O-] ZINC000571076178 1033853284 /nfs/dbraw/zinc/85/32/84/1033853284.db2.gz XDSNDCCFOXQJJP-UHFFFAOYSA-N -1 3 349.415 4.329 20 0 EIADHM Cc1cc(F)cc2c(=O)c(C(=O)Nc3ccc(Cl)cc3F)c[n-]c12 ZINC000433111663 1033859362 /nfs/dbraw/zinc/85/93/62/1033859362.db2.gz VUBQOSIJNICKPQ-UHFFFAOYSA-N -1 3 348.736 4.020 20 0 EIADHM Cc1cc(Cl)ccc1NC(=O)c1c[n-]c2c(C)cc(F)cc2c1=O ZINC000433227784 1034079118 /nfs/dbraw/zinc/07/91/18/1034079118.db2.gz TYQMURDTYRQHJR-UHFFFAOYSA-N -1 3 344.773 4.190 20 0 EIADHM CC[C@@H]1C[C@@]1(NC(=O)c1cc([O-])ccc1Cl)c1cccc(C)c1 ZINC000512925565 1034201167 /nfs/dbraw/zinc/20/11/67/1034201167.db2.gz JPZPCDLIZCHTOA-YJYMSZOUSA-N -1 3 329.827 4.409 20 0 EIADHM O=c1nc(CSC2CCCC2)[n-]c2scc(-c3ccco3)c21 ZINC000025463356 1034560737 /nfs/dbraw/zinc/56/07/37/1034560737.db2.gz WXVLZJZXOFCWBP-UHFFFAOYSA-N -1 3 332.450 4.420 20 0 EIADHM CCN(Cc1nc2c3ccccc3oc2c(=O)[n-]1)c1ccccc1C ZINC000052781732 1034771021 /nfs/dbraw/zinc/77/10/21/1034771021.db2.gz MQTGUFDDADIZRN-UHFFFAOYSA-N -1 3 333.391 4.004 20 0 EIADHM O=C(NCCCCc1ccc(F)c(F)c1)c1cc([O-])ccc1Cl ZINC000501077820 1035373668 /nfs/dbraw/zinc/37/36/68/1035373668.db2.gz ZDDGFJKNMAZNPK-UHFFFAOYSA-N -1 3 339.769 4.077 20 0 EIADHM O=C(NC1CCCCC1)c1ccc(NCc2cc([O-])cc(F)c2)cc1 ZINC000419746606 1035406871 /nfs/dbraw/zinc/40/68/71/1035406871.db2.gz QVGDCYQXVZYTIV-UHFFFAOYSA-N -1 3 342.414 4.206 20 0 EIADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)[C@@H]3CCC(C)(C)C3)c2)n1 ZINC000513714767 1035453829 /nfs/dbraw/zinc/45/38/29/1035453829.db2.gz HNLXIQLIOQTTRT-CQSZACIVSA-N -1 3 339.439 4.176 20 0 EIADHM CCOc1ccc(S(=O)(=O)[N-]c2ccc(Cl)cc2C)c(C)c1 ZINC000501801507 1035612601 /nfs/dbraw/zinc/61/26/01/1035612601.db2.gz AXSKOXLJLHWEFH-UHFFFAOYSA-N -1 3 339.844 4.156 20 0 EIADHM CCc1nnc(-c2cccc(NCc3c([O-])cccc3Cl)c2)o1 ZINC000151467885 1035811580 /nfs/dbraw/zinc/81/15/80/1035811580.db2.gz ZTSDFUGNSOULCL-UHFFFAOYSA-N -1 3 329.787 4.270 20 0 EIADHM C[C@H](C(=O)N=c1cc(-c2cccc(Cl)c2)[n-][nH]1)c1ccccc1F ZINC000596316228 1035850637 /nfs/dbraw/zinc/85/06/37/1035850637.db2.gz SYJLCWBLPWCLAE-NSHDSACASA-N -1 3 343.789 4.033 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)N1CC[C@H](c2ccccc2F)C1 ZINC000502127458 1035858372 /nfs/dbraw/zinc/85/83/72/1035858372.db2.gz MQUBXJLOFCNGIZ-HNNXBMFYSA-N -1 3 345.389 4.009 20 0 EIADHM C[C@H]1C[C@H]1c1ccc(CNCCc2cc3ccc(C(=O)[O-])cc3o2)o1 ZINC000905804008 1035897597 /nfs/dbraw/zinc/89/75/97/1035897597.db2.gz OZTGEQAJBJZFIW-YVEFUNNKSA-N -1 3 339.391 4.180 20 0 EIADHM CCSc1cccc(F)c1[N-]S(=O)(=O)c1cccc(C)c1 ZINC000571101091 1035948293 /nfs/dbraw/zinc/94/82/93/1035948293.db2.gz MKUFRZSXQZCPSZ-UHFFFAOYSA-N -1 3 325.430 4.047 20 0 EIADHM COc1ccc2ccccc2c1CNC(=O)c1cc([O-])ccc1Cl ZINC000571366685 1036045241 /nfs/dbraw/zinc/04/52/41/1036045241.db2.gz IFUUUUDTFDSHSC-UHFFFAOYSA-N -1 3 341.794 4.137 20 0 EIADHM O=C(CO[C@@H]1CCCc2ccccc21)Nc1c([O-])cccc1Cl ZINC000571699433 1036131689 /nfs/dbraw/zinc/13/16/89/1036131689.db2.gz DSTJURHDCAVVGA-MRXNPFEDSA-N -1 3 331.799 4.078 20 0 EIADHM C[C@@H](Cc1cncc2ccccc21)C(=O)Nc1ccc(Cl)cc1[O-] ZINC000502518715 1036283577 /nfs/dbraw/zinc/28/35/77/1036283577.db2.gz PQNAPRJHSIEASL-LBPRGKRZSA-N -1 3 340.810 4.411 20 0 EIADHM O=c1cc(C=Cc2ccc3ccccc3c2)nc(-c2ccncc2)[n-]1 ZINC000486055156 1036459598 /nfs/dbraw/zinc/45/95/98/1036459598.db2.gz YCBJBCCVJWPEKF-SOFGYWHQSA-N -1 3 325.371 4.156 20 0 EIADHM O=c1cc(C=Cc2ccc(OCc3ccncc3)cc2)nc(C2CC2)[n-]1 ZINC000486077845 1036464998 /nfs/dbraw/zinc/46/49/98/1036464998.db2.gz SMHBIOGRKOHRQU-LZCJLJQNSA-N -1 3 345.402 4.204 20 0 EIADHM COc1ccccc1SCc1nc2c3ccccc3oc2c(=O)[n-]1 ZINC000502859963 1036738105 /nfs/dbraw/zinc/73/81/05/1036738105.db2.gz YZMQEUUSMNGNGY-UHFFFAOYSA-N -1 3 338.388 4.383 20 0 EIADHM Cc1onc(OC(F)F)c1[N-]C(=O)c1cc2c(cccc2F)s1 ZINC001269192965 1036873388 /nfs/dbraw/zinc/87/33/88/1036873388.db2.gz OVGKOEDLLVENGU-UHFFFAOYSA-N -1 3 342.298 4.191 20 0 EIADHM O=C([O-])C[C@H](NCc1ccc(Cl)c(Cl)c1)c1cccs1 ZINC000037087856 1036971715 /nfs/dbraw/zinc/97/17/15/1036971715.db2.gz QILQLVAUGMGVJC-LBPRGKRZSA-N -1 3 330.236 4.361 20 0 EIADHM CC(C)c1ccc(/C=C/CC(=O)Nc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000487047587 1036975317 /nfs/dbraw/zinc/97/53/17/1036975317.db2.gz YXMAKOUPEFACEL-ONEGZZNKSA-N -1 3 347.422 4.032 20 0 EIADHM CC(C)c1ccc(/C=C/CC(=O)Nc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000487047587 1036975333 /nfs/dbraw/zinc/97/53/33/1036975333.db2.gz YXMAKOUPEFACEL-ONEGZZNKSA-N -1 3 347.422 4.032 20 0 EIADHM CC(C)[C@H]1CCCN(Cc2coc(-c3ccc(C(=O)[O-])cc3)n2)CC1 ZINC000569818171 1037099925 /nfs/dbraw/zinc/09/99/25/1037099925.db2.gz MTTNKHHBWMBXDW-HNNXBMFYSA-N -1 3 342.439 4.298 20 0 EIADHM Cc1sc2[n-]c([C@@H](C)OC(=O)C=C3CCCCC3)nc(=O)c2c1C ZINC000166299735 1037153901 /nfs/dbraw/zinc/15/39/01/1037153901.db2.gz QHHTYQDIFWIWQE-LLVKDONJSA-N -1 3 346.452 4.096 20 0 EIADHM O=c1nc(CS[C@@H]2CCCOC2)[n-]c2scc(-c3ccco3)c21 ZINC000272410125 1037181858 /nfs/dbraw/zinc/18/18/58/1037181858.db2.gz GMCLEFDBAKVEHH-SNVBAGLBSA-N -1 3 348.449 4.069 20 0 EIADHM O=C(C[C@@H]1CCc2ccccc21)Nc1ccc(Br)cc1[O-] ZINC000604312897 1037339912 /nfs/dbraw/zinc/33/99/12/1037339912.db2.gz KFCPEMLVTYNGLJ-LBPRGKRZSA-N -1 3 346.224 4.213 20 0 EIADHM O=C(CCSc1ccccc1F)Nc1cc(Cl)ccc1[O-] ZINC000604789261 1037520192 /nfs/dbraw/zinc/52/01/92/1037520192.db2.gz UWWRYISKMNMNCH-UHFFFAOYSA-N -1 3 325.792 4.306 20 0 EIADHM COc1ccccc1[C@H]1CCCCN1C(=O)c1ccc(C)cc1[O-] ZINC000591980281 1037702192 /nfs/dbraw/zinc/70/21/92/1037702192.db2.gz KUGSRCUEKCBNSZ-QGZVFWFLSA-N -1 3 325.408 4.077 20 0 EIADHM O=C(CC1CCCCCC1)NCc1ccc([O-])c(Br)c1 ZINC000488673196 1037713820 /nfs/dbraw/zinc/71/38/20/1037713820.db2.gz GCCZUIPSUMDRAQ-UHFFFAOYSA-N -1 3 340.261 4.131 20 0 EIADHM Cc1oc(C(=O)[O-])cc1CN1CCC(Cc2c(F)cccc2F)CC1 ZINC000574101012 1037938850 /nfs/dbraw/zinc/93/88/50/1037938850.db2.gz DLJGOSSHYDCJDU-UHFFFAOYSA-N -1 3 349.377 4.019 20 0 EIADHM CCCCn1ncc([N-]S(=O)(=O)[C@@H](CC)CCC)c1C(C)C ZINC000574280065 1038050285 /nfs/dbraw/zinc/05/02/85/1038050285.db2.gz BUJHTLJXWJFMBZ-AWEZNQCLSA-N -1 3 329.510 4.127 20 0 EIADHM CC(C)Cn1cc(C(=O)NCc2ccc([O-])c(F)c2)c2ccccc21 ZINC000606537075 1038151797 /nfs/dbraw/zinc/15/17/97/1038151797.db2.gz FTQDBZOFBNGWAL-UHFFFAOYSA-N -1 3 340.398 4.072 20 0 EIADHM O=C(CCc1ccc(Cl)cc1Cl)NCc1ccc([O-])c(F)c1 ZINC000606537374 1038153902 /nfs/dbraw/zinc/15/39/02/1038153902.db2.gz KICCORMULKLSED-UHFFFAOYSA-N -1 3 342.197 4.087 20 0 EIADHM CC(C)c1scnc1C(=O)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000574326039 1038176889 /nfs/dbraw/zinc/17/68/89/1038176889.db2.gz HXLKSYQCYILOPV-UHFFFAOYSA-N -1 3 330.331 4.243 20 0 EIADHM Cc1ccc([C@@H]2CCCN2C(=O)NCc2ccc([O-])c(F)c2)cc1C ZINC000606714535 1038226515 /nfs/dbraw/zinc/22/65/15/1038226515.db2.gz ARXNKDIJBKOTFF-SFHVURJKSA-N -1 3 342.414 4.195 20 0 EIADHM COc1cc(/C=C2\COc3c(C)cc(C)cc3C2=O)cc(Cl)c1[O-] ZINC000063412020 1038309228 /nfs/dbraw/zinc/30/92/28/1038309228.db2.gz WNQSBZWIOOQBCO-AWNIVKPZSA-N -1 3 344.794 4.330 20 0 EIADHM CC[C@@H](Cc1ccc(C)cc1)N(CC)C(=O)c1ccc(C)cc1[O-] ZINC000607878708 1038354617 /nfs/dbraw/zinc/35/46/17/1038354617.db2.gz YWGFWYDVZNCOFW-SFHVURJKSA-N -1 3 325.452 4.492 20 0 EIADHM COc1ccc([O-])c(C(=O)Nc2cnn(CCC(C)C)c2C(C)C)c1 ZINC000490176267 1038371063 /nfs/dbraw/zinc/37/10/63/1038371063.db2.gz MSQZRYVCWJNBPR-UHFFFAOYSA-N -1 3 345.443 4.019 20 0 EIADHM C[C@@H](C(=O)Nc1ccc([O-])c(C(F)(F)F)c1)c1c(F)cccc1F ZINC000490210965 1038377321 /nfs/dbraw/zinc/37/73/21/1038377321.db2.gz QJRIUESMJMYBAM-MRVPVSSYSA-N -1 3 345.267 4.431 20 0 EIADHM Cc1oc([C@@H](C)N2CCC(OC3CCC(C)CC3)CC2)cc1C(=O)[O-] ZINC000516479464 1038803213 /nfs/dbraw/zinc/80/32/13/1038803213.db2.gz LNAJHEUZKGFBHI-NPCAHTBFSA-N -1 3 349.471 4.407 20 0 EIADHM CSc1ccc([O-])c(C(=O)N2CC[C@H](c3ccccc3C)C2)c1 ZINC000667828075 1039064032 /nfs/dbraw/zinc/06/40/32/1039064032.db2.gz HNNIBFRXHRBZDV-AWEZNQCLSA-N -1 3 327.449 4.052 20 0 EIADHM O=C([O-])c1cccc(-c2nc(CN3CCCC4(CC4)CC3)cs2)c1 ZINC000629378111 1039065423 /nfs/dbraw/zinc/06/54/23/1039065423.db2.gz OFAHOUWCIWNOTF-UHFFFAOYSA-N -1 3 342.464 4.274 20 0 EIADHM O=C([N-]c1nnc(CC2CCCCC2)s1)c1scnc1C1CC1 ZINC000089797661 1039117189 /nfs/dbraw/zinc/11/71/89/1039117189.db2.gz UBOAFJIZVRLLCC-UHFFFAOYSA-N -1 3 348.497 4.247 20 0 EIADHM Cc1csc(C(=O)[N-]c2nnc(-c3ccccc3)s2)c1Cl ZINC000477835466 1039132035 /nfs/dbraw/zinc/13/20/35/1039132035.db2.gz RJLNWTXIMKLMTG-UHFFFAOYSA-N -1 3 335.841 4.481 20 0 EIADHM O=C(Nc1cccc([O-])c1F)c1c[nH]cc1-c1ccc(Cl)s1 ZINC000534209953 1039205549 /nfs/dbraw/zinc/20/55/49/1039205549.db2.gz LADFAQSYOJASDA-UHFFFAOYSA-N -1 3 336.775 4.494 20 0 EIADHM O=C(Nc1c([O-])cccc1Cl)c1ccc(OC(F)(F)F)cc1 ZINC000552432358 1039507972 /nfs/dbraw/zinc/50/79/72/1039507972.db2.gz DWSQLOBOOAMACJ-UHFFFAOYSA-N -1 3 331.677 4.197 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2cc(C)c(F)cc2Cl)c(F)c1 ZINC000404823230 1039583136 /nfs/dbraw/zinc/58/31/36/1039583136.db2.gz PAJUSSHCHSULBA-UHFFFAOYSA-N -1 3 331.771 4.036 20 0 EIADHM Cc1ccc(C(C)C)cc1OCC(=O)Nc1c([O-])cccc1Cl ZINC000552782648 1039818079 /nfs/dbraw/zinc/81/80/79/1039818079.db2.gz YAIHVMBZWCIBTK-UHFFFAOYSA-N -1 3 333.815 4.495 20 0 EIADHM Cc1cc(OCC(=O)Nc2cc(Cl)ccc2[O-])ccc1Cl ZINC000069693101 1039871583 /nfs/dbraw/zinc/87/15/83/1039871583.db2.gz QZVXWDGVWRNIFB-UHFFFAOYSA-N -1 3 326.179 4.025 20 0 EIADHM O=C(Cc1ccc([O-])c(F)c1)N1CC2(CCCC2)[C@@H]1c1ccccc1 ZINC000457271776 1039894841 /nfs/dbraw/zinc/89/48/41/1039894841.db2.gz GPXLYXHHSSMMFF-FQEVSTJZSA-N -1 3 339.410 4.218 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)N1CC[C@H]1c1ccc(Cl)cc1 ZINC000552982998 1039896232 /nfs/dbraw/zinc/89/62/32/1039896232.db2.gz QIAACIQHTJIKJE-KRWDZBQOSA-N -1 3 347.817 4.481 20 0 EIADHM CCc1nc2c(s1)[C@H](N(C)C(=O)c1cc(CC)ccc1[O-])CCC2 ZINC000537683172 1039900013 /nfs/dbraw/zinc/90/00/13/1039900013.db2.gz HQVNEEWXISGZKK-OAHLLOKOSA-N -1 3 344.480 4.123 20 0 EIADHM CC(C)(C)c1cccc(OCCNC(=O)c2cc([O-])ccc2Cl)c1 ZINC000551149200 1040009801 /nfs/dbraw/zinc/00/98/01/1040009801.db2.gz FTHKVQNGQJZLNB-UHFFFAOYSA-N -1 3 347.842 4.152 20 0 EIADHM CCCc1cc(=O)[n-]c(C(=Cc2nc(-c3ccccc3)c[nH]2)CC)n1 ZINC000435337283 1040290659 /nfs/dbraw/zinc/29/06/59/1040290659.db2.gz VMYBQMXWNBSHLQ-SDNWHVSQSA-N -1 3 334.423 4.475 20 0 EIADHM CCc1cc(=O)[n-]c(CSCc2csc(-c3ccc(C)o3)n2)n1 ZINC000477353707 1040429203 /nfs/dbraw/zinc/42/92/03/1040429203.db2.gz UTKFNMQTQUXWCE-UHFFFAOYSA-N -1 3 347.465 4.203 20 0 EIADHM CCN(Cc1c[nH]c2ccccc12)[C@H](C)c1cc(C)c(C(=O)[O-])o1 ZINC000568064711 1040482965 /nfs/dbraw/zinc/48/29/65/1040482965.db2.gz NMCWFNCEDRJMHL-CYBMUJFWSA-N -1 3 326.396 4.351 20 0 EIADHM CC(C)C(C)(C)[N-]S(=O)(=O)c1ccc(Cl)cc1C(F)(F)F ZINC000551705283 1040516573 /nfs/dbraw/zinc/51/65/73/1040516573.db2.gz VQGKDKIOQDRIAS-UHFFFAOYSA-N -1 3 343.798 4.072 20 0 EIADHM CC[C@H](C)c1cc(C(=O)[N-]c2c(F)cccc2Br)on1 ZINC000084245184 1040546115 /nfs/dbraw/zinc/54/61/15/1040546115.db2.gz GUQOGMWEDQZAFX-QMMMGPOBSA-N -1 3 341.180 4.342 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)c1ccc(OC2CCC2)cc1Cl ZINC000533932494 1040555285 /nfs/dbraw/zinc/55/52/85/1040555285.db2.gz YBEQPWBNMWPLCU-UHFFFAOYSA-N -1 3 349.789 4.046 20 0 EIADHM CCc1ccc(-c2nc(C[S@](=O)c3ccc([O-])cc3)cs2)cc1 ZINC000194527245 1040591734 /nfs/dbraw/zinc/59/17/34/1040591734.db2.gz KMXYHKFFAGVOSG-QHCPKHFHSA-N -1 3 343.473 4.386 20 0 EIADHM O=C(CO[C@@H]1CCCc2ccccc21)Nc1ccc(Cl)cc1[O-] ZINC000435796360 1040617496 /nfs/dbraw/zinc/61/74/96/1040617496.db2.gz IKLNYNSUOWSGMP-QGZVFWFLSA-N -1 3 331.799 4.078 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)N1CCC[C@@H](c2ccccc2)C1 ZINC000554156498 1040845735 /nfs/dbraw/zinc/84/57/35/1040845735.db2.gz WOGXRZOBAAGRGU-GOSISDBHSA-N -1 3 341.426 4.260 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2ccc(OC3CCCC3)c(F)c2)cc1 ZINC000460825484 1040966866 /nfs/dbraw/zinc/96/68/66/1040966866.db2.gz XMUSCLKBKZIABA-UHFFFAOYSA-N -1 3 349.427 4.256 20 0 EIADHM Cc1cc(C)c(/C=C\CNCc2cc(F)c(C(=O)[O-])c(F)c2)cc1C ZINC000904016535 1041259014 /nfs/dbraw/zinc/25/90/14/1041259014.db2.gz CJJCIXWPEAALMW-PLNGDYQASA-N -1 3 345.389 4.391 20 0 EIADHM CC[C@H](CCNCc1csc(-c2ccc(Cl)cc2)n1)C(=O)[O-] ZINC000904018661 1041260692 /nfs/dbraw/zinc/26/06/92/1041260692.db2.gz RWRVQPSGLOJKIN-LLVKDONJSA-N -1 3 338.860 4.054 20 0 EIADHM CC(C)N(Cc1ccc(Br)cc1)C(=O)c1ccccc1[O-] ZINC000436551015 1041325181 /nfs/dbraw/zinc/32/51/81/1041325181.db2.gz VTXGHDLQICJQIN-UHFFFAOYSA-N -1 3 348.240 4.206 20 0 EIADHM COc1ccc(C(=O)N([C@@H](C)c2ccccc2Cl)C2CC2)c([O-])c1 ZINC000436552782 1041329009 /nfs/dbraw/zinc/32/90/09/1041329009.db2.gz BEFJWKWMJOQMPJ-LBPRGKRZSA-N -1 3 345.826 4.420 20 0 EIADHM CC(C)c1ccc(C(=O)N2CCC[C@H](C(F)(F)F)[C@@H]2C)c([O-])c1 ZINC000436544793 1041338339 /nfs/dbraw/zinc/33/83/39/1041338339.db2.gz KSGMVTBCVDLJGT-FZMZJTMJSA-N -1 3 329.362 4.319 20 0 EIADHM CCCCOc1ccc([N-]S(=O)(=O)c2cccc(C)c2)c(C)c1 ZINC000516019082 1041346054 /nfs/dbraw/zinc/34/60/54/1041346054.db2.gz HCYHHYTYCSTQKG-UHFFFAOYSA-N -1 3 333.453 4.283 20 0 EIADHM O=C(c1cc(CCc2ccccc2)ccc1[O-])N1CCc2ccccc21 ZINC000436580606 1041357769 /nfs/dbraw/zinc/35/77/69/1041357769.db2.gz CDLJOYKOJZLIER-UHFFFAOYSA-N -1 3 343.426 4.380 20 0 EIADHM C[C@H](N(C)C(=O)c1cc(Oc2ccccc2)ccc1[O-])C1(C)CC1 ZINC000436590654 1041365952 /nfs/dbraw/zinc/36/59/52/1041365952.db2.gz UFZKIRIBDZAMOL-AWEZNQCLSA-N -1 3 325.408 4.445 20 0 EIADHM O=C(c1cc(Oc2ccccc2)ccc1[O-])N1CC2(CCC2(F)F)C1 ZINC000436613466 1041372392 /nfs/dbraw/zinc/37/23/92/1041372392.db2.gz VJILJQHKGHSSKS-UHFFFAOYSA-N -1 3 345.345 4.056 20 0 EIADHM CCOc1ccc(CN(C)C(=O)c2ccc(C(C)C)cc2[O-])cc1 ZINC000436622271 1041390388 /nfs/dbraw/zinc/39/03/88/1041390388.db2.gz BZADLIWAZNPFHI-UHFFFAOYSA-N -1 3 327.424 4.187 20 0 EIADHM Cc1ccc(C(=O)Nc2ccc(OC(F)F)cc2F)c([O-])c1C ZINC000436668018 1041406451 /nfs/dbraw/zinc/40/64/51/1041406451.db2.gz VNVXMDSTPCBIEG-UHFFFAOYSA-N -1 3 325.286 4.002 20 0 EIADHM O=C(c1ccc(O)cc1[O-])N1CCCCC[C@@H]1/C=C/c1ccccc1 ZINC000436677890 1041417162 /nfs/dbraw/zinc/41/71/62/1041417162.db2.gz FYGXGOOQQNPEJR-SXSDINLZSA-N -1 3 337.419 4.196 20 0 EIADHM CCCCN(C(=O)c1cc(OC)c([O-])c(OC)c1)[C@@H]1CCC[C@@H](C)C1 ZINC000436701703 1041431845 /nfs/dbraw/zinc/43/18/45/1041431845.db2.gz ALKHCYJWSXBUIP-GDBMZVCRSA-N -1 3 349.471 4.230 20 0 EIADHM Cc1ccc(C(=O)NC23CCC(C(F)(F)F)(CC2)CC3)c([O-])c1 ZINC000436712673 1041439473 /nfs/dbraw/zinc/43/94/73/1041439473.db2.gz BHJNQGQSUJWIMF-UHFFFAOYSA-N -1 3 327.346 4.086 20 0 EIADHM Cc1ccc(C(=O)Nc2nnc(-c3ccccc3Cl)s2)c([O-])c1 ZINC000436719858 1041442377 /nfs/dbraw/zinc/44/23/77/1041442377.db2.gz IRMBYJKCDHIBFJ-UHFFFAOYSA-N -1 3 345.811 4.125 20 0 EIADHM Cc1ccc(C(=O)N(Cc2ccc([C@H]3C[C@H]3C)o2)C2CC2)c([O-])c1 ZINC000436759887 1041457961 /nfs/dbraw/zinc/45/79/61/1041457961.db2.gz HVOLVPMKXGAVRY-DYVFJYSZSA-N -1 3 325.408 4.222 20 0 EIADHM Cc1ccc(C(=O)Nc2ccc(-c3cnc(C4CC4)o3)cc2)c([O-])c1 ZINC000436762057 1041459971 /nfs/dbraw/zinc/45/99/71/1041459971.db2.gz PTWLTTNSICDDOU-UHFFFAOYSA-N -1 3 334.375 4.485 20 0 EIADHM O=C(c1cc(Cc2ccccc2)ccc1[O-])N1Cc2ccccc2C1 ZINC000436765709 1041473734 /nfs/dbraw/zinc/47/37/34/1041473734.db2.gz QPSVTJQCVRSPEA-UHFFFAOYSA-N -1 3 329.399 4.139 20 0 EIADHM CSCCCN(C)C(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436783068 1041479452 /nfs/dbraw/zinc/47/94/52/1041479452.db2.gz PUXSELAGOVKBQD-UHFFFAOYSA-N -1 3 331.437 4.010 20 0 EIADHM CCc1ccc(C(=O)N(Cc2ccco2)Cc2cccs2)c([O-])c1 ZINC000436794528 1041485107 /nfs/dbraw/zinc/48/51/07/1041485107.db2.gz BLBMMVZPVYNZLH-UHFFFAOYSA-N -1 3 341.432 4.452 20 0 EIADHM CN(C(=O)c1ccc2c(c1[O-])OC(C)(C)C2)c1ccc(F)c(Cl)c1 ZINC000436818021 1041487604 /nfs/dbraw/zinc/48/76/04/1041487604.db2.gz UAQMCDVGHGNQPJ-UHFFFAOYSA-N -1 3 349.789 4.175 20 0 EIADHM O=C(c1cc(Cc2ccccc2)ccc1[O-])N1CC2(CCC2)[C@H]1C1CC1 ZINC000436819886 1041493646 /nfs/dbraw/zinc/49/36/46/1041493646.db2.gz ZQCVOTFOGYJQIL-OAQYLSRUSA-N -1 3 347.458 4.388 20 0 EIADHM CCc1ccc(C(=O)Nc2cc(-c3nc(C)co3)ccc2C)c([O-])c1 ZINC000436833266 1041497836 /nfs/dbraw/zinc/49/78/36/1041497836.db2.gz VJJFRERNLBSKMA-UHFFFAOYSA-N -1 3 336.391 4.479 20 0 EIADHM Cc1c(NC(=O)c2ccc3c(c2[O-])CCCC3)cccc1-c1ncco1 ZINC000436825495 1041503115 /nfs/dbraw/zinc/50/31/15/1041503115.db2.gz LFIMGEBFCMROQL-UHFFFAOYSA-N -1 3 348.402 4.487 20 0 EIADHM CCc1ccc(C(=O)N2CCC(OC3CCC(C)CC3)CC2)c([O-])c1 ZINC000436825801 1041504366 /nfs/dbraw/zinc/50/43/66/1041504366.db2.gz MOPKTSLLXHRQMD-UHFFFAOYSA-N -1 3 345.483 4.155 20 0 EIADHM Cc1ccc(C(=O)N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)c([O-])c1 ZINC000436854505 1041507285 /nfs/dbraw/zinc/50/72/85/1041507285.db2.gz SOLWDKMRJKYEGU-AWEZNQCLSA-N -1 3 349.352 4.349 20 0 EIADHM CCc1ccc(-c2nc(Cc3ccc(C(F)(F)F)cn3)no2)c([O-])c1 ZINC000436845712 1041513464 /nfs/dbraw/zinc/51/34/64/1041513464.db2.gz FGYXEKNGYXJDPH-UHFFFAOYSA-N -1 3 349.312 4.009 20 0 EIADHM Cc1ccc(C(=O)N2CC[C@H](Sc3cccc(Cl)c3)C2)c([O-])c1 ZINC000436846503 1041515847 /nfs/dbraw/zinc/51/58/47/1041515847.db2.gz XWJHAFQIJCMYMM-HNNXBMFYSA-N -1 3 347.867 4.361 20 0 EIADHM CCc1cccc(C(=O)N2CCn3cccc3[C@H]2c2ccccc2)c1[O-] ZINC000538744174 1041518943 /nfs/dbraw/zinc/51/89/43/1041518943.db2.gz REPCBAMAVCQIPQ-HXUWFJFHSA-N -1 3 346.430 4.002 20 0 EIADHM Cc1ccc2ncc(-c3noc(-c4ccc(C(C)C)cc4[O-])n3)n2c1 ZINC000436882817 1041540415 /nfs/dbraw/zinc/54/04/15/1041540415.db2.gz WMZGJNWBEMPIFD-UHFFFAOYSA-N -1 3 334.379 4.189 20 0 EIADHM CC(C)c1ccc(-c2nc(Cc3cc(F)cc(F)c3)no2)c([O-])c1 ZINC000436891710 1041544891 /nfs/dbraw/zinc/54/48/91/1041544891.db2.gz YLNZOVUKTFTPPW-UHFFFAOYSA-N -1 3 330.334 4.435 20 0 EIADHM COc1cccc(-c2nc(-c3ccc(C(F)(F)F)cc3)no2)c1[O-] ZINC000436893076 1041545426 /nfs/dbraw/zinc/54/54/26/1041545426.db2.gz MJTRBYWKMWQYIZ-UHFFFAOYSA-N -1 3 336.269 4.137 20 0 EIADHM CC(C)c1ccc(-c2nc(Cc3ccc(F)cc3F)no2)c([O-])c1 ZINC000436901270 1041553333 /nfs/dbraw/zinc/55/33/33/1041553333.db2.gz LSTCGJMGZJKWBZ-UHFFFAOYSA-N -1 3 330.334 4.435 20 0 EIADHM O=C(c1ccc(O)cc1[O-])N1CCCC[C@@H]1c1cccc(Cl)c1 ZINC000436913835 1041554923 /nfs/dbraw/zinc/55/49/23/1041554923.db2.gz ZLWHYJRZHZGYNK-MRXNPFEDSA-N -1 3 331.799 4.119 20 0 EIADHM CCCCOc1ccc(C(=O)N2CC[C@@H](c3ccccc3)C2)c([O-])c1 ZINC000436973294 1041578105 /nfs/dbraw/zinc/57/81/05/1041578105.db2.gz SRNCINVLYHVWHP-QGZVFWFLSA-N -1 3 339.435 4.201 20 0 EIADHM CCCCOc1ccc(C(=O)N[C@H](CC)c2c(C)noc2C)c([O-])c1 ZINC000436979800 1041581033 /nfs/dbraw/zinc/58/10/33/1041581033.db2.gz BRHBMZGNRZXHOR-MRXNPFEDSA-N -1 3 346.427 4.057 20 0 EIADHM CCCCOc1ccc(C(=O)N(C)Cc2ccc(C)s2)c([O-])c1 ZINC000436970393 1041582608 /nfs/dbraw/zinc/58/26/08/1041582608.db2.gz FCKHHKIGNWSMCJ-UHFFFAOYSA-N -1 3 333.453 4.213 20 0 EIADHM CCc1ccc(C(=O)N2CC[C@H](c3cccc(Cl)c3)C2)c([O-])c1 ZINC000436985814 1041587743 /nfs/dbraw/zinc/58/77/43/1041587743.db2.gz PRCYTBRHRSTLKX-HNNXBMFYSA-N -1 3 329.827 4.238 20 0 EIADHM CCCOc1ccc(-c2noc(-c3ccc(C)cc3[O-])n2)cc1OC ZINC000437002550 1041588953 /nfs/dbraw/zinc/58/89/53/1041588953.db2.gz STABDTLVZXQNDI-UHFFFAOYSA-N -1 3 340.379 4.215 20 0 EIADHM CCC(CC)[C@@H](NC(=O)c1cc(=O)c2ccccc2[n-]1)c1ccccc1 ZINC000464304365 1041943702 /nfs/dbraw/zinc/94/37/02/1041943702.db2.gz DZMWXZWCNOPOHC-OAQYLSRUSA-N -1 3 348.446 4.435 20 0 EIADHM O=C([N-]c1nc2cc(Cl)ccn2n1)c1cc(Cl)sc1Cl ZINC000464632300 1042084638 /nfs/dbraw/zinc/08/46/38/1042084638.db2.gz DDETXYCQURBZAH-UHFFFAOYSA-N -1 3 347.614 4.003 20 0 EIADHM Cc1cccc(C(C)(C)NC(=O)CCCc2ccc([O-])c(F)c2)c1 ZINC000469394608 1042174625 /nfs/dbraw/zinc/17/46/25/1042174625.db2.gz BHEWPYVKXYNPCC-UHFFFAOYSA-N -1 3 329.415 4.214 20 0 EIADHM CCCOc1ccc(NC(=O)c2cccc(OC)c2[O-])cc1Cl ZINC000302931273 1042191556 /nfs/dbraw/zinc/19/15/56/1042191556.db2.gz DDMBNBPHFNJVDV-UHFFFAOYSA-N -1 3 335.787 4.095 20 0 EIADHM Cc1ccc(C(=O)Nc2ccc(COC3CCCC3)cc2)c([O-])c1 ZINC000303754815 1042504808 /nfs/dbraw/zinc/50/48/08/1042504808.db2.gz CTEIZZKOWNLVNW-UHFFFAOYSA-N -1 3 325.408 4.412 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1ccc(Br)cc1F ZINC000518796666 1042700785 /nfs/dbraw/zinc/70/07/85/1042700785.db2.gz QWUGYGSWLRQPHF-UHFFFAOYSA-N -1 3 344.567 4.200 20 0 EIADHM Cc1nc(C(C)C)oc1C(=O)[N-]c1nnc(CC2CCCCC2)s1 ZINC000519006503 1042788240 /nfs/dbraw/zinc/78/82/40/1042788240.db2.gz XGDDVNWKAOIBPU-UHFFFAOYSA-N -1 3 348.472 4.333 20 0 EIADHM C[C@@H](Oc1c(Cl)ccc([O-])c1F)c1ccc(Br)nc1 ZINC001234264752 1042883073 /nfs/dbraw/zinc/88/30/73/1042883073.db2.gz RTMPKGJETNCYMY-SSDOTTSWSA-N -1 3 346.583 4.482 20 0 EIADHM CC[C@@H]1CC[C@H](C)N1Cc1csc(-c2ccc(C(=O)[O-])cc2)n1 ZINC000520594937 1042917913 /nfs/dbraw/zinc/91/79/13/1042917913.db2.gz YHACEVPGKUKKBP-BLLLJJGKSA-N -1 3 330.453 4.271 20 0 EIADHM CCOc1ccc2nc(NC(=O)c3cc([O-])ccc3Cl)sc2c1 ZINC000391629374 1042946273 /nfs/dbraw/zinc/94/62/73/1042946273.db2.gz ITXGHHCQGGDURU-UHFFFAOYSA-N -1 3 348.811 4.306 20 0 EIADHM COc1ccc(C(C)(C)C)cc1NC(=O)c1ccc(C(C)=O)c([O-])c1 ZINC000665159508 1043018140 /nfs/dbraw/zinc/01/81/40/1043018140.db2.gz PAJHICXQXFRHEQ-UHFFFAOYSA-N -1 3 341.407 4.153 20 0 EIADHM [O-]c1ccc(F)c(CNc2cccc(OCc3cccnc3)c2)c1F ZINC000509156025 1043089116 /nfs/dbraw/zinc/08/91/16/1043089116.db2.gz UFAAPZOTOFGSOK-UHFFFAOYSA-N -1 3 342.345 4.257 20 0 EIADHM COc1cccc(C2=CCN(Cc3cccc([O-])c3Cl)CC2)c1 ZINC000507886772 1043175151 /nfs/dbraw/zinc/17/51/51/1043175151.db2.gz IFVDXQRUYLXAOR-UHFFFAOYSA-N -1 3 329.827 4.344 20 0 EIADHM [O-]c1cc(F)cc(CNc2ccccc2OC[C@@H]2CCCCO2)c1 ZINC000185590589 1043200312 /nfs/dbraw/zinc/20/03/12/1043200312.db2.gz JCBSNJGJDSLUAO-KRWDZBQOSA-N -1 3 331.387 4.091 20 0 EIADHM COc1ccc(C)cc1[N-]S(=O)(=O)/C=C/c1ccccc1Cl ZINC000727349318 1043203906 /nfs/dbraw/zinc/20/39/06/1043203906.db2.gz AVISCEFLCOWAOG-MDZDMXLPSA-N -1 3 337.828 4.070 20 0 EIADHM COCCC1(CNC(=O)c2cc([O-])c3ccccc3c2)CCCCC1 ZINC000525927255 1043234901 /nfs/dbraw/zinc/23/49/01/1043234901.db2.gz WHLVPYNSWRDZES-UHFFFAOYSA-N -1 3 341.451 4.262 20 0 EIADHM O=C(NCCc1c[nH]c2cc(F)ccc12)c1cc([O-])c2ccccc2c1 ZINC000525921831 1043235395 /nfs/dbraw/zinc/23/53/95/1043235395.db2.gz YANZQCIEYCTSRJ-UHFFFAOYSA-N -1 3 348.377 4.138 20 0 EIADHM O=C(Nc1csc(-c2ccccn2)n1)c1cc([O-])c2ccccc2c1 ZINC000525931224 1043236522 /nfs/dbraw/zinc/23/65/22/1043236522.db2.gz APKCYCBHLBSEFL-UHFFFAOYSA-N -1 3 347.399 4.316 20 0 EIADHM C[C@@H](CNC(=O)c1cc([O-])c2ccccc2c1)c1ccc(F)cc1F ZINC000525934628 1043236816 /nfs/dbraw/zinc/23/68/16/1043236816.db2.gz YGPQIUSRFRGOBI-LBPRGKRZSA-N -1 3 341.357 4.357 20 0 EIADHM CCOc1ccc(CNC(=O)c2cc([O-])c3ccccc3c2)cc1F ZINC000526880660 1043243601 /nfs/dbraw/zinc/24/36/01/1043243601.db2.gz IEFRLDCUFFPXII-UHFFFAOYSA-N -1 3 339.366 4.013 20 0 EIADHM CCC(=O)Nc1ccc(C)c(NC(=O)c2cc([O-])c3ccccc3c2)c1 ZINC000526849709 1043243867 /nfs/dbraw/zinc/24/38/67/1043243867.db2.gz SBDSNJJNNYVBJT-UHFFFAOYSA-N -1 3 348.402 4.455 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N1C[C@H]2CCCN2c2ccccc21 ZINC000526876013 1043244354 /nfs/dbraw/zinc/24/43/54/1043244354.db2.gz NAIPUFANKUFVDA-QGZVFWFLSA-N -1 3 344.414 4.175 20 0 EIADHM CO[C@@H]1CCOc2c(NC(=O)c3cc([O-])c4ccccc4c3)cccc21 ZINC000526934885 1043245579 /nfs/dbraw/zinc/24/55/79/1043245579.db2.gz MCSIWIYTPCQGNZ-LJQANCHMSA-N -1 3 349.386 4.268 20 0 EIADHM O=C(NC[C@@H]1CCO[C@@H]1c1ccccc1)c1cc([O-])c2ccccc2c1 ZINC000527183953 1043252847 /nfs/dbraw/zinc/25/28/47/1043252847.db2.gz RNVURHPSGLVHLO-LAUBAEHRSA-N -1 3 347.414 4.053 20 0 EIADHM CC[C@@H](C)N(Cc1ccccc1)C(=O)NCc1ccc([O-])c(F)c1 ZINC000163675815 1043258337 /nfs/dbraw/zinc/25/83/37/1043258337.db2.gz NKDVSFUAIFPZMC-CQSZACIVSA-N -1 3 330.403 4.042 20 0 EIADHM CC[C@@H](NC(=O)c1cc([O-])c2ccccc2c1)c1nc2ccccc2[nH]1 ZINC000527449520 1043260548 /nfs/dbraw/zinc/26/05/48/1043260548.db2.gz NRNWSWKMPJUONW-MRXNPFEDSA-N -1 3 345.402 4.303 20 0 EIADHM O=C(c1ccccc1[O-])N(Cc1ccc(C(F)(F)F)cc1)C1CC1 ZINC000219950802 1043275675 /nfs/dbraw/zinc/27/56/75/1043275675.db2.gz XBNFNYGXWOPJRW-UHFFFAOYSA-N -1 3 335.325 4.216 20 0 EIADHM O=C(CCCc1csc2ccccc12)NCc1ccc([O-])c(F)c1 ZINC000427955313 1043276470 /nfs/dbraw/zinc/27/64/70/1043276470.db2.gz AQDRFUOZUKVTHJ-UHFFFAOYSA-N -1 3 343.423 4.385 20 0 EIADHM O=C(N[C@H]1CCOC2(CCCCC2)C1)c1cc([O-])c2ccccc2c1 ZINC000281691168 1043300479 /nfs/dbraw/zinc/30/04/79/1043300479.db2.gz VDTPYWAXEYAQDL-KRWDZBQOSA-N -1 3 339.435 4.157 20 0 EIADHM Cc1noc(-c2ccccc2)c1[N-]C(=O)c1csc(C2CC2)n1 ZINC000186727687 1043306348 /nfs/dbraw/zinc/30/63/48/1043306348.db2.gz HCINAFDJPWELGD-UHFFFAOYSA-N -1 3 325.393 4.236 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@H](C)CCCC(C)C)nc2)n1 ZINC000428118679 1043332454 /nfs/dbraw/zinc/33/24/54/1043332454.db2.gz XCGRHGHGOUJYCU-CQSZACIVSA-N -1 3 328.460 4.433 20 0 EIADHM Fc1ccccc1[N-]c1nnc(SCCc2cccnc2)s1 ZINC000134297646 1043371279 /nfs/dbraw/zinc/37/12/79/1043371279.db2.gz HLABTRQHVHTNNU-UHFFFAOYSA-N -1 3 332.429 4.151 20 0 EIADHM O=c1[n-]c(Sc2nnc(-c3ccccc3)s2)nc2ccccc21 ZINC000729987958 1043425061 /nfs/dbraw/zinc/42/50/61/1043425061.db2.gz WNFJAQDEEWFNNV-UHFFFAOYSA-N -1 3 338.417 4.005 20 0 EIADHM Cc1ccc(F)c([N-]S(=O)(=O)c2ccc(CC(F)(F)F)cc2)c1 ZINC000189229472 1043497787 /nfs/dbraw/zinc/49/77/87/1043497787.db2.gz RHSDYLYLHLOVPR-UHFFFAOYSA-N -1 3 347.333 4.040 20 0 EIADHM C[C@@H](CS(=O)(=O)[N-]c1cc(Cl)ccc1F)c1ccccc1 ZINC000494486156 1043515407 /nfs/dbraw/zinc/51/54/07/1043515407.db2.gz TZDHUFDKGQBJFM-NSHDSACASA-N -1 3 327.808 4.025 20 0 EIADHM C[C@@H](OC(=O)c1cccc(Cl)c1[O-])c1ccc(C(F)(F)F)cn1 ZINC001128382798 1043659231 /nfs/dbraw/zinc/65/92/31/1043659231.db2.gz HVUDHSOFKUOYFC-MRVPVSSYSA-N -1 3 345.704 4.377 20 0 EIADHM O=C(CCOc1ccccc1)[N-]OCc1c(Cl)cccc1Cl ZINC000731841719 1043835967 /nfs/dbraw/zinc/83/59/67/1043835967.db2.gz OBDZUCKZAGOPIV-UHFFFAOYSA-N -1 3 340.206 4.010 20 0 EIADHM COc1c(F)ccc(Nc2cccc([O-])c2Br)c1F ZINC001212508278 1043845165 /nfs/dbraw/zinc/84/51/65/1043845165.db2.gz LYINSIFUPLJIGB-UHFFFAOYSA-N -1 3 330.128 4.185 20 0 EIADHM C[C@@H](NC(=O)c1nnc2ccccc2c1[O-])c1csc2ccccc21 ZINC000732289445 1043896559 /nfs/dbraw/zinc/89/65/59/1043896559.db2.gz QYMJJKYLHHQGKK-LLVKDONJSA-N -1 3 349.415 4.041 20 0 EIADHM Cc1sc2[n-]c([C@H](C)OC(=O)/C=C\C(C)(C)C)nc(=O)c2c1C ZINC000732401420 1043914499 /nfs/dbraw/zinc/91/44/99/1043914499.db2.gz GEICICHGHMWWQT-DMEOUFDRSA-N -1 3 334.441 4.220 20 0 EIADHM Cc1cnn(-c2ccc(C)cc2NCc2c(F)ccc([O-])c2F)c1 ZINC000509239841 1044048615 /nfs/dbraw/zinc/04/86/15/1044048615.db2.gz YDKPXOZKYWIAAI-UHFFFAOYSA-N -1 3 329.350 4.085 20 0 EIADHM Cc1ccc([N-]S(=O)(=O)c2ccccc2OC(F)F)c(Cl)c1 ZINC000195438369 1044079388 /nfs/dbraw/zinc/07/93/88/1044079388.db2.gz MDBBXETTWODHJD-UHFFFAOYSA-N -1 3 347.770 4.051 20 0 EIADHM O=[S@@](c1ccc([O-])cc1)[C@@H]1CCc2c1cc(Cl)cc2Cl ZINC000443392004 1044245881 /nfs/dbraw/zinc/24/58/81/1044245881.db2.gz IZWDRRSLAYAVER-QRWLVFNGSA-N -1 3 327.232 4.494 20 0 EIADHM [O-]c1ccc(-c2nc(-c3ccc(Cl)cc3C(F)(F)F)no2)nc1 ZINC001212558160 1044306106 /nfs/dbraw/zinc/30/61/06/1044306106.db2.gz UPTBFSOPWGZVJP-UHFFFAOYSA-N -1 3 341.676 4.176 20 0 EIADHM Cc1cc(C(=O)Nc2ccc(Cl)cc2[O-])c(C)n1-c1nccs1 ZINC000153494210 1044350863 /nfs/dbraw/zinc/35/08/63/1044350863.db2.gz IDOVGGWZXJZPDR-UHFFFAOYSA-N -1 3 347.827 4.162 20 0 EIADHM CC(C)(C)c1nnc([N-]C(=O)c2ccc(-c3ccco3)s2)s1 ZINC000675751024 1044466931 /nfs/dbraw/zinc/46/69/31/1044466931.db2.gz NZFIAPZGYWNDNA-UHFFFAOYSA-N -1 3 333.438 4.409 20 0 EIADHM CCCCC[C@H](NC(=O)c1cc(=O)c2ccccc2[n-]1)C(C)(C)C ZINC000734449307 1044576950 /nfs/dbraw/zinc/57/69/50/1044576950.db2.gz WWHXFMGFPCGEDV-SFHVURJKSA-N -1 3 328.456 4.253 20 0 EIADHM O=C(Nc1cc(C(F)(F)F)ccc1F)c1cc([O-])ccc1Cl ZINC000389090766 1044579402 /nfs/dbraw/zinc/57/94/02/1044579402.db2.gz CLJPMONTIGIIGN-UHFFFAOYSA-N -1 3 333.668 4.456 20 0 EIADHM O=C(c1ccc([O-])cc1)C1CCN(Cc2cc3ccccc3o2)CC1 ZINC000676038040 1044623031 /nfs/dbraw/zinc/62/30/31/1044623031.db2.gz BFNREEFRTGTNCV-UHFFFAOYSA-N -1 3 335.403 4.233 20 0 EIADHM C[C@@H](CCC1CCCCC1)NC(=O)c1cc(=O)c2ccccc2[n-]1 ZINC000522386950 1044691955 /nfs/dbraw/zinc/69/19/55/1044691955.db2.gz QHQKZKCRPMAMKP-AWEZNQCLSA-N -1 3 326.440 4.007 20 0 EIADHM Cc1ccc([N-]S(=O)(=O)c2c(C)c(C)c(C)c(C)c2C)cc1O ZINC000033923454 1044785679 /nfs/dbraw/zinc/78/56/79/1044785679.db2.gz DDRCHRYUJBAOLQ-UHFFFAOYSA-N -1 3 333.453 4.044 20 0 EIADHM Cc1c([O-])ccc2c(CSc3ncc(C(C)(C)C)o3)cc(=O)oc12 ZINC000761888739 1044820192 /nfs/dbraw/zinc/82/01/92/1044820192.db2.gz YDZBZRSYTHUSSC-UHFFFAOYSA-N -1 3 345.420 4.385 20 0 EIADHM Cc1cc(C)c(C(=O)COC(=O)c2cc3ccsc3[n-]2)c(C)c1 ZINC000914891834 1044853034 /nfs/dbraw/zinc/85/30/34/1044853034.db2.gz OSISYFPZFIBYQT-UHFFFAOYSA-N -1 3 327.405 4.194 20 0 EIADHM CCc1cc(=O)[n-]c(CSC[C@H](OC)c2ccc(Cl)cc2)n1 ZINC000508997730 1044892470 /nfs/dbraw/zinc/89/24/70/1044892470.db2.gz AHWAZGZZKSPXFC-AWEZNQCLSA-N -1 3 338.860 4.019 20 0 EIADHM Cc1cc(C)cc(NNC(=O)c2cn[n-]c2-c2ccc(Cl)s2)c1 ZINC000187086793 1044950623 /nfs/dbraw/zinc/95/06/23/1044950623.db2.gz JOVDUVZEJYVYFI-UHFFFAOYSA-N -1 3 346.843 4.165 20 0 EIADHM Cc1cc(C)cc(NNC(=O)c2c[n-]nc2-c2ccc(Cl)s2)c1 ZINC000187086793 1044950629 /nfs/dbraw/zinc/95/06/29/1044950629.db2.gz JOVDUVZEJYVYFI-UHFFFAOYSA-N -1 3 346.843 4.165 20 0 EIADHM COc1nc(Br)ccc1Nc1c(Cl)ccc([O-])c1F ZINC001214554243 1044951273 /nfs/dbraw/zinc/95/12/73/1044951273.db2.gz NODYVWUNNSLZSG-UHFFFAOYSA-N -1 3 347.571 4.094 20 0 EIADHM O=C([N-]c1ccc(-c2ccco2)cc1F)c1conc1C(F)(F)F ZINC001626087246 1044980631 /nfs/dbraw/zinc/98/06/31/1044980631.db2.gz KXVNPLKDUDXMQO-UHFFFAOYSA-N -1 3 340.232 4.345 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1cc(-c2ccccc2Cl)[nH]n1 ZINC000303351363 1044989082 /nfs/dbraw/zinc/98/90/82/1044989082.db2.gz FWLNPHGRRHIYAA-UHFFFAOYSA-N -1 3 348.189 4.341 20 0 EIADHM CC[C@H](OC(=O)c1cc2ccsc2[n-]1)C(=O)c1ccc(OC)cc1 ZINC000738588579 1045068128 /nfs/dbraw/zinc/06/81/28/1045068128.db2.gz UKCOPGUBUNBGJE-HNNXBMFYSA-N -1 3 343.404 4.056 20 0 EIADHM Cc1cc(=O)[n-]c(-c2ccc(NC(=O)C[C@@H](C)CC(C)(C)C)cc2)n1 ZINC000625168127 1045134741 /nfs/dbraw/zinc/13/47/41/1045134741.db2.gz UGKBZPPIRXPERV-CYBMUJFWSA-N -1 3 341.455 4.146 20 0 EIADHM CC(C)(C(=O)[O-])[C@@H]1CCCN(Cc2cc(Cl)cc(Cl)c2)C1 ZINC000135051249 1045195733 /nfs/dbraw/zinc/19/57/33/1045195733.db2.gz FMBZFHNAACPOMC-GFCCVEGCSA-N -1 3 330.255 4.316 20 0 EIADHM CC(C)(C)Sc1ccc(-c2noc(-c3ccccc3[O-])n2)nc1 ZINC000762390683 1045216367 /nfs/dbraw/zinc/21/63/67/1045216367.db2.gz VHHSVALDQMBGAT-UHFFFAOYSA-N -1 3 327.409 4.395 20 0 EIADHM O=C(Nc1ccc(Cl)cc1[O-])c1cccnc1SC(F)F ZINC000153539898 1045234319 /nfs/dbraw/zinc/23/43/19/1045234319.db2.gz KGGVCKUNHLMHJU-UHFFFAOYSA-N -1 3 330.743 4.008 20 0 EIADHM [O-]c1ccc(Nc2ncccc2OCc2ccccc2)c(F)c1F ZINC001211997970 1045701998 /nfs/dbraw/zinc/70/19/98/1045701998.db2.gz VFJPWGFORBBUET-UHFFFAOYSA-N -1 3 328.318 4.388 20 0 EIADHM O=C(Nc1ccn(Cc2ccccc2)n1)c1cc2sccc2c([O-])c1 ZINC000791341645 1045724592 /nfs/dbraw/zinc/72/45/92/1045724592.db2.gz ZMUBMSPSBFVOHU-UHFFFAOYSA-N -1 3 349.415 4.104 20 0 EIADHM CC(C)(CNC(=O)c1cc2sccc2c([O-])c1)c1cccs1 ZINC000791364965 1045731672 /nfs/dbraw/zinc/73/16/72/1045731672.db2.gz YQTUAQMNXRELMK-UHFFFAOYSA-N -1 3 331.462 4.376 20 0 EIADHM Cc1cc(=O)[n-]c(CSCc2csc(-c3ccccc3F)n2)n1 ZINC000763209410 1045749962 /nfs/dbraw/zinc/74/99/62/1045749962.db2.gz FYWUHOJKWQPVQG-UHFFFAOYSA-N -1 3 347.440 4.187 20 0 EIADHM Cc1cc(=O)[n-]c(CSCc2coc(-c3ccc(Cl)cc3)n2)n1 ZINC000763219533 1045773891 /nfs/dbraw/zinc/77/38/91/1045773891.db2.gz ZQMPYMDUROPLOP-UHFFFAOYSA-N -1 3 347.827 4.232 20 0 EIADHM O=C(Nc1nc(-c2ccccc2)co1)c1cc([O-])c2ccccc2c1 ZINC000508532751 1045783334 /nfs/dbraw/zinc/78/33/34/1045783334.db2.gz GEDCLCYPXXCBGI-UHFFFAOYSA-N -1 3 330.343 4.453 20 0 EIADHM COc1cc(Br)ccc1Nc1ccc([O-])c(F)c1F ZINC001212007515 1045826779 /nfs/dbraw/zinc/82/67/79/1045826779.db2.gz KQNPNULNVQKFOL-UHFFFAOYSA-N -1 3 330.128 4.185 20 0 EIADHM [O-]c1ccc(Nc2cc(Br)c(F)cc2F)c(F)c1F ZINC001212007494 1045827695 /nfs/dbraw/zinc/82/76/95/1045827695.db2.gz IURKFDQULLACJL-UHFFFAOYSA-N -1 3 336.082 4.455 20 0 EIADHM [O-]c1ccc(Nc2ccc3cnn([C@@H]4CCCCO4)c3c2)c(F)c1F ZINC001212009908 1045831503 /nfs/dbraw/zinc/83/15/03/1045831503.db2.gz YMKQUCJIVJRTEL-INIZCTEOSA-N -1 3 345.349 4.463 20 0 EIADHM COc1c(C)cc(Nc2ccc([O-])c(F)c2F)cc1Br ZINC001212013740 1045834866 /nfs/dbraw/zinc/83/48/66/1045834866.db2.gz HRLZRWHHPMAHIA-UHFFFAOYSA-N -1 3 344.155 4.494 20 0 EIADHM COc1cccc(Br)c1Nc1ccc([O-])c(F)c1F ZINC001212013850 1045835511 /nfs/dbraw/zinc/83/55/11/1045835511.db2.gz MFKCELLVPWHFST-UHFFFAOYSA-N -1 3 330.128 4.185 20 0 EIADHM CCOc1ccccc1[N-]S(=O)(=O)/C=C/c1cccc(Cl)c1 ZINC000768867457 1045849897 /nfs/dbraw/zinc/84/98/97/1045849897.db2.gz RFVDBWFSWFZVLU-ZHACJKMWSA-N -1 3 337.828 4.151 20 0 EIADHM CSc1cc(O)ccc1NC(=O)c1cc([O-])c2ccccc2c1 ZINC000792481862 1045900093 /nfs/dbraw/zinc/90/00/93/1045900093.db2.gz YMACEHGFEWRTLA-UHFFFAOYSA-N -1 3 325.389 4.225 20 0 EIADHM Cc1ccc(Cl)cc1NC(=O)c1c[n-]c2c(C)cc(F)cc2c1=O ZINC000161615896 1046009498 /nfs/dbraw/zinc/00/94/98/1046009498.db2.gz QJIGJTNGUFOLOR-UHFFFAOYSA-N -1 3 344.773 4.190 20 0 EIADHM CC(C)Sc1cccc(Cl)c1CN1C[C@H](C)C[C@H](C(=O)[O-])C1 ZINC000263092156 1046251963 /nfs/dbraw/zinc/25/19/63/1046251963.db2.gz UNQRBAJDPJIYSQ-OLZOCXBDSA-N -1 3 341.904 4.383 20 0 EIADHM O=C([O-])c1ccc(CN2CCC(=Cc3ccccc3F)CC2)cc1 ZINC000263485913 1046294309 /nfs/dbraw/zinc/29/43/09/1046294309.db2.gz PJUFWQWLIGNORL-UHFFFAOYSA-N -1 3 325.383 4.203 20 0 EIADHM CC[C@@H](NCc1cccc(C(=O)[O-])c1)c1ccccc1OC(F)F ZINC000263491578 1046296065 /nfs/dbraw/zinc/29/60/65/1046296065.db2.gz RKSSSDHEEZQBJV-OAHLLOKOSA-N -1 3 335.350 4.227 20 0 EIADHM CCc1cc(=O)[n-]c(CSCc2nc(-c3ccccc3)oc2C)n1 ZINC000125701272 1046325665 /nfs/dbraw/zinc/32/56/65/1046325665.db2.gz JRJICMYKMBOPOP-UHFFFAOYSA-N -1 3 341.436 4.141 20 0 EIADHM O=C(c1cc([O-])ccc1Cl)N1CC[C@H](c2cccc(Cl)c2)C1 ZINC000497094364 1046338345 /nfs/dbraw/zinc/33/83/45/1046338345.db2.gz DGQXIWUSOMIQDS-LBPRGKRZSA-N -1 3 336.218 4.329 20 0 EIADHM Cc1cnc(CSc2nnc([N-]c3ccccc3F)s2)s1 ZINC000771527054 1046436055 /nfs/dbraw/zinc/43/60/55/1046436055.db2.gz ZJAVFZMVEUEIAF-UHFFFAOYSA-N -1 3 338.458 4.478 20 0 EIADHM CSc1ccncc1[N-]C(=O)c1cc(F)c(C(F)(F)F)cc1F ZINC000804433551 1046493304 /nfs/dbraw/zinc/49/33/04/1046493304.db2.gz YUTRMLFJYYOSES-UHFFFAOYSA-N -1 3 348.296 4.353 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N(C)Cc3cc(C)ccc3C)nc2)n1 ZINC000428666834 1046508518 /nfs/dbraw/zinc/50/85/18/1046508518.db2.gz JRKXXMRXPRVUJC-UHFFFAOYSA-N -1 3 348.450 4.060 20 0 EIADHM [O-]c1cccc(CN[C@H]2CCc3c2cccc3F)c1Br ZINC000459402702 1046601958 /nfs/dbraw/zinc/60/19/58/1046601958.db2.gz ZULOOGXMWMFEAY-AWEZNQCLSA-N -1 3 336.204 4.071 20 0 EIADHM CCc1nc([C@@H](C)NCc2cccc([O-])c2Br)cs1 ZINC000459447304 1046677443 /nfs/dbraw/zinc/67/74/43/1046677443.db2.gz QEDVJMWYZXDBLW-SECBINFHSA-N -1 3 341.274 4.024 20 0 EIADHM CCOc1cc(CNc2ccccc2CCOC)cc(Cl)c1[O-] ZINC000459516564 1046741371 /nfs/dbraw/zinc/74/13/71/1046741371.db2.gz VOKYKXANGHSUKJ-UHFFFAOYSA-N -1 3 335.831 4.245 20 0 EIADHM Cc1ccccc1-c1noc([C@H](C)OC(=O)c2cc3occc3[n-]2)n1 ZINC000786031076 1046803737 /nfs/dbraw/zinc/80/37/37/1046803737.db2.gz IZEPMKQZKOJMLI-NSHDSACASA-N -1 3 337.335 4.037 20 0 EIADHM O=C(OCc1csc(-c2cccs2)n1)c1cc2occc2[n-]1 ZINC000786030005 1046803890 /nfs/dbraw/zinc/80/38/90/1046803890.db2.gz KYVZGYJIBBRDPI-UHFFFAOYSA-N -1 3 330.390 4.303 20 0 EIADHM Cc1c(F)ccc(Cl)c1[N-]S(=O)(=O)c1ccccc1Cl ZINC000433118979 1046808097 /nfs/dbraw/zinc/80/80/97/1046808097.db2.gz DPZGARIHHPDPJF-UHFFFAOYSA-N -1 3 334.199 4.242 20 0 EIADHM CSc1cc(F)ccc1[N-]C(=O)c1cc(Br)co1 ZINC001130089922 1046852671 /nfs/dbraw/zinc/85/26/71/1046852671.db2.gz BMWOPPMYJKDRBM-UHFFFAOYSA-N -1 3 330.178 4.155 20 0 EIADHM C[C@H](Cc1ccccc1Cl)NC(=O)CCCc1ccc([O-])c(F)c1 ZINC000786776887 1046869682 /nfs/dbraw/zinc/86/96/82/1046869682.db2.gz FUQLQFGREHBPPL-CYBMUJFWSA-N -1 3 349.833 4.255 20 0 EIADHM CSc1cc(F)ccc1[N-]C(=O)c1c(C)onc1-c1cccnc1 ZINC001130290795 1046946810 /nfs/dbraw/zinc/94/68/10/1046946810.db2.gz SJIHZFOSKCMPBN-UHFFFAOYSA-N -1 3 343.383 4.158 20 0 EIADHM O=C(CCSc1ccc(Cl)cc1)Nc1cccc([O-])c1F ZINC000128710733 1047036442 /nfs/dbraw/zinc/03/64/42/1047036442.db2.gz BNCTVOAHBJRZTI-UHFFFAOYSA-N -1 3 325.792 4.306 20 0 EIADHM CCCCOc1ccccc1[N-]S(=O)(=O)/C=C/c1ccccc1 ZINC000917761913 1047099176 /nfs/dbraw/zinc/09/91/76/1047099176.db2.gz PMJUUJMMGQTCKZ-FYWRMAATSA-N -1 3 331.437 4.278 20 0 EIADHM CC(C)c1nc(CCNC(=O)c2cc3sccc3c([O-])c2)cs1 ZINC000788297603 1047151098 /nfs/dbraw/zinc/15/10/98/1047151098.db2.gz ZKOFDRKPWMBLFX-UHFFFAOYSA-N -1 3 346.477 4.159 20 0 EIADHM COc1ccc([O-])c(C(=O)Nc2cccc(SC(F)(F)F)c2)c1 ZINC001170093070 1047334740 /nfs/dbraw/zinc/33/47/40/1047334740.db2.gz NTTACZHXENZQQE-UHFFFAOYSA-N -1 3 343.326 4.265 20 0 EIADHM O=C(Nc1cccc([O-])c1F)c1cccnc1Nc1ccccc1F ZINC000129270712 1047344026 /nfs/dbraw/zinc/34/40/26/1047344026.db2.gz FSPGGTQMJLSHPS-UHFFFAOYSA-N -1 3 341.317 4.061 20 0 EIADHM CS[C@H](C)C(=O)Nc1ccc([O-])c(-c2nc3ccccc3s2)c1 ZINC000129478803 1047401599 /nfs/dbraw/zinc/40/15/99/1047401599.db2.gz NINPQRQXMDJUBP-SNVBAGLBSA-N -1 3 344.461 4.359 20 0 EIADHM CCO[C@@H](CC(=O)Nc1ccc([O-])c(C(F)(F)F)c1)C1=CCCC1 ZINC000476177702 1047403775 /nfs/dbraw/zinc/40/37/75/1047403775.db2.gz WVVVSDYHJXLSJR-HNNXBMFYSA-N -1 3 343.345 4.255 20 0 EIADHM Cc1ccccc1NCCC(=O)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000476180142 1047406055 /nfs/dbraw/zinc/40/60/55/1047406055.db2.gz WNOPHQXQRDGBCT-UHFFFAOYSA-N -1 3 338.329 4.160 20 0 EIADHM Cc1nc(CC(C)C)oc1C(=O)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000476314020 1047466446 /nfs/dbraw/zinc/46/64/46/1047466446.db2.gz WNFGTHOVAXUNJC-UHFFFAOYSA-N -1 3 342.317 4.158 20 0 EIADHM Cc1nc(-c2ccc([C@H](C)[N-]C(=O)C(F)(F)C(F)F)cc2)cs1 ZINC000749342292 1047481478 /nfs/dbraw/zinc/48/14/78/1047481478.db2.gz OLJUCBDWBQMHMY-QMMMGPOBSA-N -1 3 346.349 4.196 20 0 EIADHM O=C([N-]c1nnc(-c2cc(Cl)cc(Cl)c2)s1)c1ccco1 ZINC001131033292 1047496204 /nfs/dbraw/zinc/49/62/04/1047496204.db2.gz VIVPVWFINLPZLK-UHFFFAOYSA-N -1 3 340.191 4.357 20 0 EIADHM CCCC1CCC(N(C)Cn2[n-]c(-c3ccccn3)nc2=S)CC1 ZINC000790476561 1047594743 /nfs/dbraw/zinc/59/47/43/1047594743.db2.gz FZMDDOLVKSFSOL-UHFFFAOYSA-N -1 3 345.516 4.251 20 0 EIADHM CC(=O)c1cccc(NC(=O)C=Cc2cnc(C(C)(C)C)s2)c1[O-] ZINC000808187788 1047622903 /nfs/dbraw/zinc/62/29/03/1047622903.db2.gz KVYDBRAWLGUVNZ-CMDGGOBGSA-N -1 3 344.436 4.001 20 0 EIADHM CC(C)[C@H](OC(=O)c1cc(Cl)c(Cl)[n-]1)C(=O)c1ccccc1 ZINC000919046253 1047740315 /nfs/dbraw/zinc/74/03/15/1047740315.db2.gz HZPNHYQHPCWGHB-AWEZNQCLSA-N -1 3 340.206 4.386 20 0 EIADHM O=C(Nc1ccc(Cl)cc1[O-])c1ccc(Br)s1 ZINC000533159898 1047760046 /nfs/dbraw/zinc/76/00/46/1047760046.db2.gz DNFFGXHBWNOSCD-UHFFFAOYSA-N -1 3 332.606 4.122 20 0 EIADHM C[C@H]1CCc2c(sc3[n-]c(COc4ccc(F)cc4)nc(=O)c23)C1 ZINC000556488976 1047786846 /nfs/dbraw/zinc/78/68/46/1047786846.db2.gz KBZKBVGZNAJWEH-JTQLQIEISA-N -1 3 344.411 4.240 20 0 EIADHM Cc1cc(S(=O)(=O)[N-]c2cc(Cl)ccc2F)cc(C)c1F ZINC000460431602 1047814540 /nfs/dbraw/zinc/81/45/40/1047814540.db2.gz WHAYENDMDSNOIJ-UHFFFAOYSA-N -1 3 331.771 4.036 20 0 EIADHM CCc1ccc(C(=O)N[C@@H](C)[C@@H](OC)c2ccc(Cl)cc2)c([O-])c1 ZINC001136846342 1047855467 /nfs/dbraw/zinc/85/54/67/1047855467.db2.gz AWKYRFXXWJZMGP-KPZWWZAWSA-N -1 3 347.842 4.114 20 0 EIADHM CC(C)CCc1ccc(NC(=O)c2[n-]cnc2C(F)(F)F)cc1 ZINC000824409636 1047863375 /nfs/dbraw/zinc/86/33/75/1047863375.db2.gz GGXFKSXGDSFZIN-UHFFFAOYSA-N -1 3 325.334 4.269 20 0 EIADHM CC(C)CCc1ccc(NC(=O)c2nc[n-]c2C(F)(F)F)cc1 ZINC000824409636 1047863378 /nfs/dbraw/zinc/86/33/78/1047863378.db2.gz GGXFKSXGDSFZIN-UHFFFAOYSA-N -1 3 325.334 4.269 20 0 EIADHM O=S(=O)(/C=C\c1ccc(Cl)cc1)[N-]c1cc(F)cc(F)c1F ZINC000814213054 1047892123 /nfs/dbraw/zinc/89/21/23/1047892123.db2.gz UZBIIJZCJMZSER-WAYWQWQTSA-N -1 3 347.745 4.170 20 0 EIADHM CC[C@@H](C)[C@@H]1CCCCN1C(=O)c1c[n-]c2c(Cl)cccc2c1=O ZINC001136909654 1047898016 /nfs/dbraw/zinc/89/80/16/1047898016.db2.gz XEOILWYCCMAYNB-WBMJQRKESA-N -1 3 346.858 4.222 20 0 EIADHM CC(=O)c1cccc(NC(=O)c2cc3cc(Cl)ccc3o2)c1[O-] ZINC000556892961 1048118907 /nfs/dbraw/zinc/11/89/07/1048118907.db2.gz ZPOWIGFIDMPBKG-UHFFFAOYSA-N -1 3 329.739 4.247 20 0 EIADHM Cc1ccc(-c2csc3[n-]c(-c4cccc(F)n4)nc(=O)c23)cc1 ZINC000155139604 1048344662 /nfs/dbraw/zinc/34/46/62/1048344662.db2.gz ODJQOQRPZZFXJI-UHFFFAOYSA-N -1 3 337.379 4.161 20 0 EIADHM CCOC(=O)c1cccc2[n-]c(NC(=O)C[C@H](CC)C(C)(C)C)nc21 ZINC001134940353 1048398824 /nfs/dbraw/zinc/39/88/24/1048398824.db2.gz CKWLLWWFQMQXHU-LBPRGKRZSA-N -1 3 345.443 4.141 20 0 EIADHM Cc1ccccc1[C@@H](C)[N-]C(=O)C(F)(F)c1c(F)cccc1F ZINC001131877160 1048527210 /nfs/dbraw/zinc/52/72/10/1048527210.db2.gz UTOGNLUXQVTGCV-LLVKDONJSA-N -1 3 325.305 4.242 20 0 EIADHM Cc1cc(=O)[n-]c(-c2cccc(OC(=O)C(C)(C)C(C)(C)C)c2)n1 ZINC000815961020 1048645968 /nfs/dbraw/zinc/64/59/68/1048645968.db2.gz BDJVKHTXZMJEJK-UHFFFAOYSA-N -1 3 328.412 4.135 20 0 EIADHM CSc1nc2ccc(NC(=O)c3cc(C)ccc3[O-])cc2s1 ZINC001135341928 1048671804 /nfs/dbraw/zinc/67/18/04/1048671804.db2.gz OEPKWAQKVCYHKS-UHFFFAOYSA-N -1 3 330.434 4.285 20 0 EIADHM CCCOc1ccccc1[N-]S(=O)(=O)/C=C/c1ccc(F)cc1 ZINC000747596597 1048677879 /nfs/dbraw/zinc/67/78/79/1048677879.db2.gz PWJQOSMASFOWPY-ACCUITESSA-N -1 3 335.400 4.027 20 0 EIADHM Cc1onc(-c2ccc(F)cc2)c1C(=O)[N-]c1cc(C(C)(C)F)on1 ZINC001135374071 1048691150 /nfs/dbraw/zinc/69/11/50/1048691150.db2.gz XHHPCSVJJGPRNE-UHFFFAOYSA-N -1 3 347.321 4.234 20 0 EIADHM COc1cccc(C2CCN(Cc3c(F)cc([O-])cc3F)CC2)c1 ZINC001144561719 1048730644 /nfs/dbraw/zinc/73/06/44/1048730644.db2.gz MVAGOLYHJKCDFT-UHFFFAOYSA-N -1 3 333.378 4.059 20 0 EIADHM Cc1ccc(NC(=O)c2ccc(C(=O)OCc3ccccc3)[n-]2)c(C)c1 ZINC001135498626 1048760594 /nfs/dbraw/zinc/76/05/94/1048760594.db2.gz ORZUDSQUUXJMNO-UHFFFAOYSA-N -1 3 348.402 4.241 20 0 EIADHM O=C([O-])c1ccsc1CN1CC=C(c2ccc(Cl)cc2)CC1 ZINC001144664596 1048781263 /nfs/dbraw/zinc/78/12/63/1048781263.db2.gz KQPVMPKZXUWQSV-UHFFFAOYSA-N -1 3 333.840 4.389 20 0 EIADHM O=C(OCc1cnc2ccccc2n1)c1cc2cc(Cl)sc2[n-]1 ZINC000810562283 1048812390 /nfs/dbraw/zinc/81/23/90/1048812390.db2.gz LFHILFVDRBDNID-UHFFFAOYSA-N -1 3 343.795 4.183 20 0 EIADHM C/C(=C\CN(C)[C@H](C)c1sc(-c2ccccc2)nc1C)C(=O)[O-] ZINC000846250680 1048849423 /nfs/dbraw/zinc/84/94/23/1048849423.db2.gz QFXQYNIZUFTJKB-IEZBTEQYSA-N -1 3 330.453 4.142 20 0 EIADHM CCc1ccc(C(=O)Nc2cc(OC)ccc2OC(C)C)c([O-])c1 ZINC001144884695 1048883562 /nfs/dbraw/zinc/88/35/62/1048883562.db2.gz VLUFWNKCARRRRK-UHFFFAOYSA-N -1 3 329.396 4.003 20 0 EIADHM O=C([N-]OCCC1CC1)[C@@H]1CC=CC[C@H]1c1nc2ccccc2s1 ZINC000817388534 1048967777 /nfs/dbraw/zinc/96/77/77/1048967777.db2.gz YMZUXNMYJKHLNU-HUUCEWRRSA-N -1 3 342.464 4.194 20 0 EIADHM O=C(OCc1cccc(Cl)n1)c1cc2cc(Cl)sc2[n-]1 ZINC000811397193 1049051359 /nfs/dbraw/zinc/05/13/59/1049051359.db2.gz XNPJHIHRTWRLIO-UHFFFAOYSA-N -1 3 327.192 4.288 20 0 EIADHM CCc1ccc(C(=O)N[C@@H](C)c2ncc(-c3ccccc3)o2)c([O-])c1 ZINC001147441039 1049158666 /nfs/dbraw/zinc/15/86/66/1049158666.db2.gz KUDWMSIDFVXYNU-ZDUSSCGKSA-N -1 3 336.391 4.101 20 0 EIADHM Cc1ccc([O-])c(C(=O)Nc2cc(F)ccc2SCC(F)F)c1 ZINC001147618297 1049193000 /nfs/dbraw/zinc/19/30/00/1049193000.db2.gz UTTYXMLFEDBORI-UHFFFAOYSA-N -1 3 341.354 4.449 20 0 EIADHM CCN(Cc1ccc2ccccc2c1)C(=O)c1ccc(C(C)=O)c([O-])c1 ZINC001136176303 1049226605 /nfs/dbraw/zinc/22/66/05/1049226605.db2.gz PDJMICDMOHQTQE-UHFFFAOYSA-N -1 3 347.414 4.410 20 0 EIADHM CCSCC[C@H](C)NC(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC001148095103 1049261403 /nfs/dbraw/zinc/26/14/03/1049261403.db2.gz FIZVTYZJVMJMSR-AWEZNQCLSA-N -1 3 345.464 4.446 20 0 EIADHM O=C(Nc1ccc(-c2ccccc2)cc1F)c1cc(=O)[n-]c(C2CC2)n1 ZINC001136195292 1049273870 /nfs/dbraw/zinc/27/38/70/1049273870.db2.gz NQKUFDOIPVAETO-UHFFFAOYSA-N -1 3 349.365 4.118 20 0 EIADHM CC[C@H](Cc1ccccc1)N(C)C(=O)c1cc(SC)ccc1[O-] ZINC001148232927 1049281534 /nfs/dbraw/zinc/28/15/34/1049281534.db2.gz JVHUMOIAMSKFHQ-OAHLLOKOSA-N -1 3 329.465 4.207 20 0 EIADHM O=C(Nc1ccc(C(F)(F)F)c(F)c1)c1cc([O-])ccc1Cl ZINC001148223526 1049282781 /nfs/dbraw/zinc/28/27/81/1049282781.db2.gz POMPRHIJJQXYIP-UHFFFAOYSA-N -1 3 333.668 4.456 20 0 EIADHM O=C(Nc1cc(Cl)c([O-])c2ccccc12)c1ccc(O)c(F)c1 ZINC001148253856 1049288900 /nfs/dbraw/zinc/28/89/00/1049288900.db2.gz WXGQYYCLFINSIC-UHFFFAOYSA-N -1 3 331.730 4.296 20 0 EIADHM Cc1ccc(C(=O)Nc2cc(F)c(OCC3CC3)c(F)c2)c([O-])c1 ZINC001148500854 1049328709 /nfs/dbraw/zinc/32/87/09/1049328709.db2.gz XASDAMVXGWNDTI-UHFFFAOYSA-N -1 3 333.334 4.020 20 0 EIADHM O=C(NC1(c2ccc(F)cc2)CCC1)c1cc([O-])c2ccccc2c1 ZINC001148712650 1049359156 /nfs/dbraw/zinc/35/91/56/1049359156.db2.gz FYNYZRBLZXMESL-UHFFFAOYSA-N -1 3 335.378 4.494 20 0 EIADHM CSc1ccc([O-])c(C(=O)N(C)CCCCc2ccccc2)c1 ZINC001136291318 1049400441 /nfs/dbraw/zinc/40/04/41/1049400441.db2.gz UDJLPLXAFKAUBE-UHFFFAOYSA-N -1 3 329.465 4.209 20 0 EIADHM CCc1cccc(C(=O)Nc2nc(-c3ccc(O)cc3)cs2)c1[O-] ZINC001137532967 1049498921 /nfs/dbraw/zinc/49/89/21/1049498921.db2.gz ULTLEXBRHFHUSN-UHFFFAOYSA-N -1 3 340.404 4.036 20 0 EIADHM [O-]c1ccc(NC(=S)Nc2c(F)cc(F)cc2F)cc1Cl ZINC001247427645 1049504085 /nfs/dbraw/zinc/50/40/85/1049504085.db2.gz XEDWZJXMZBOTRN-UHFFFAOYSA-N -1 3 332.734 4.272 20 0 EIADHM Cc1sc2[n-]c([C@H](C)OC(=O)[C@@H]3CCCC[C@H]3C)nc(=O)c2c1C ZINC000820938531 1049578302 /nfs/dbraw/zinc/57/83/02/1049578302.db2.gz CJGRQVYQXDSZBZ-SUZMYJTESA-N -1 3 348.468 4.444 20 0 EIADHM O=C(C[C@H](c1ccc(O)cc1)C1CC1)Nc1c([O-])cccc1Cl ZINC000615321378 1049635286 /nfs/dbraw/zinc/63/52/86/1049635286.db2.gz DXMIZKQVFPADAH-AWEZNQCLSA-N -1 3 331.799 4.274 20 0 EIADHM COc1ccc(Cl)cc1C(F)(F)C(=O)[N-]C(C)(C)/C=C\Cl ZINC001133744618 1049763513 /nfs/dbraw/zinc/76/35/13/1049763513.db2.gz SAPCDUWPGOJXDT-SREVYHEPSA-N -1 3 338.181 4.088 20 0 EIADHM CCOc1ccc(N(CC2CC2)C(=O)c2cc(C)ccc2[O-])cc1 ZINC001171642934 1049780443 /nfs/dbraw/zinc/78/04/43/1049780443.db2.gz DRPYXWJHRCSBQK-UHFFFAOYSA-N -1 3 325.408 4.156 20 0 EIADHM CC(C)(C)c1ccc(CNC(=O)CCCc2ccc([O-])c(F)c2)o1 ZINC001171694510 1049787746 /nfs/dbraw/zinc/78/77/46/1049787746.db2.gz JQJFILBZUMPKRL-UHFFFAOYSA-N -1 3 333.403 4.061 20 0 EIADHM CCC[C@@H]1CCCC[C@H]1NC(=O)c1c[n-]c2c(Cl)cccc2c1=O ZINC001136622268 1049790133 /nfs/dbraw/zinc/79/01/33/1049790133.db2.gz CZRCAHFKBOIZHY-MLGOLLRUSA-N -1 3 346.858 4.270 20 0 EIADHM CCc1ccc(C(=O)NCC2(c3cccc(Cl)c3)CCC2)c([O-])c1 ZINC001171824114 1049803021 /nfs/dbraw/zinc/80/30/21/1049803021.db2.gz STLTURRGWSVDOK-UHFFFAOYSA-N -1 3 343.854 4.460 20 0 EIADHM CC(C)(CNC(=O)c1cc([O-])c2ccccc2c1)c1ccc(F)cc1 ZINC001136643026 1049805763 /nfs/dbraw/zinc/80/57/63/1049805763.db2.gz VWHLMNFBXFMBME-UHFFFAOYSA-N -1 3 337.394 4.392 20 0 EIADHM [O-]c1cc(Br)cnc1Nc1ccc(C(F)(F)F)cc1O ZINC001212629531 1049814218 /nfs/dbraw/zinc/81/42/18/1049814218.db2.gz XQSFXUBHZLIVHJ-UHFFFAOYSA-N -1 3 349.106 4.018 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2cccc(-c3nccs3)c2)c(C)c1 ZINC000615958812 1049821097 /nfs/dbraw/zinc/82/10/97/1049821097.db2.gz LUTPBMURGQBCGI-UHFFFAOYSA-N -1 3 344.461 4.228 20 0 EIADHM Cc1ccc(N(Cc2ccccc2)C(=O)c2cccc3n[n-]nc32)cc1 ZINC001136698163 1049834318 /nfs/dbraw/zinc/83/43/18/1049834318.db2.gz XHKSMSCNAJQERA-UHFFFAOYSA-N -1 3 342.402 4.113 20 0 EIADHM CCc1ccc(C(=O)N2CCS[C@@H](C)[C@H]2c2ccccc2)c([O-])c1 ZINC001136790735 1049884280 /nfs/dbraw/zinc/88/42/80/1049884280.db2.gz DDWMMTPNLWTKMP-LIRRHRJNSA-N -1 3 341.476 4.273 20 0 EIADHM COc1cc(/C=C2/CCOc3cc(F)ccc3C2=O)cc(Cl)c1[O-] ZINC000180460431 1049899365 /nfs/dbraw/zinc/89/93/65/1049899365.db2.gz ZFJKJEGZUYALKD-WDZFZDKYSA-N -1 3 348.757 4.242 20 0 EIADHM O=C([N-]c1nnc(-c2ccco2)s1)c1cc2sccc2s1 ZINC000616992543 1049939175 /nfs/dbraw/zinc/93/91/75/1049939175.db2.gz KETWCMYLHFPMGK-UHFFFAOYSA-N -1 3 333.419 4.327 20 0 EIADHM Cc1cc(F)ccc1C[C@H](C)NC(=O)CCCc1ccc([O-])c(F)c1 ZINC000617320183 1049979490 /nfs/dbraw/zinc/97/94/90/1049979490.db2.gz KWZUPXIZAWBKNT-AWEZNQCLSA-N -1 3 347.405 4.049 20 0 EIADHM CC(C)Oc1cccc(Nc2cc(=O)n(-c3ccccc3)[n-]2)c1F ZINC001212319272 1050035770 /nfs/dbraw/zinc/03/57/70/1050035770.db2.gz CIXNREHYYHKURG-UHFFFAOYSA-N -1 3 327.359 4.248 20 0 EIADHM CCc1onc(C)c1[N-]C(=O)c1cc2cc(Br)ccc2o1 ZINC000089397984 1050116669 /nfs/dbraw/zinc/11/66/69/1050116669.db2.gz RDIYWWJQJZAXBP-UHFFFAOYSA-N -1 3 349.184 4.306 20 0 EIADHM Cc1cc(Cl)cc(Cl)c1C[N-]C(=O)C(F)(F)c1ccccn1 ZINC001177302771 1050180308 /nfs/dbraw/zinc/18/03/08/1050180308.db2.gz BCBFVUSQEVJVOI-UHFFFAOYSA-N -1 3 345.176 4.105 20 0 EIADHM CCc1ccc2ccccc2c1CNC(=O)c1c([O-])cccc1OC ZINC001177338945 1050194338 /nfs/dbraw/zinc/19/43/38/1050194338.db2.gz RILBGBQDKSJDTN-UHFFFAOYSA-N -1 3 335.403 4.046 20 0 EIADHM [O-]c1cncc(-c2nc(-c3cccc(C(F)(F)F)c3Cl)no2)c1 ZINC001212708691 1050329761 /nfs/dbraw/zinc/32/97/61/1050329761.db2.gz PDWYVELKOOKGLK-UHFFFAOYSA-N -1 3 341.676 4.176 20 0 EIADHM O=C(CCc1nccc2c3ccccc3[nH]c21)Nc1ccc(F)c([O-])c1 ZINC001186751914 1050405047 /nfs/dbraw/zinc/40/50/47/1050405047.db2.gz LRGYPJSGAJZLGN-UHFFFAOYSA-N -1 3 349.365 4.132 20 0 EIADHM O=C(Nc1cc(Cl)cc(Cl)c1)Nc1ncc([O-])cc1Cl ZINC001187128005 1050487668 /nfs/dbraw/zinc/48/76/68/1050487668.db2.gz JEWIBYYMEHNDKS-UHFFFAOYSA-N -1 3 332.574 4.391 20 0 EIADHM O=C(Nc1cc(F)cc(F)c1)Nc1ccc(Br)cc1[O-] ZINC001187571208 1050575082 /nfs/dbraw/zinc/57/50/82/1050575082.db2.gz MAZOBCXZQDJWTJ-UHFFFAOYSA-N -1 3 343.127 4.077 20 0 EIADHM Cc1scc(C(=O)Oc2cccc(-c3nc(C)cc(=O)[n-]3)c2)c1C ZINC000773783232 1050583851 /nfs/dbraw/zinc/58/38/51/1050583851.db2.gz FGGWWERMPDMEKF-UHFFFAOYSA-N -1 3 340.404 4.055 20 0 EIADHM O=CNc1cccc(NC(=O)c2cc(Oc3ccccc3)ccc2[O-])c1 ZINC001179070111 1050624143 /nfs/dbraw/zinc/62/41/43/1050624143.db2.gz IVLCJAHGKCFERL-UHFFFAOYSA-N -1 3 348.358 4.005 20 0 EIADHM COc1ccc(OC)c(Nc2cc(Br)cc(F)c2[O-])c1 ZINC001173920015 1050627887 /nfs/dbraw/zinc/62/78/87/1050627887.db2.gz BGPZFOISBIDYDO-UHFFFAOYSA-N -1 3 342.164 4.055 20 0 EIADHM O=C(Nc1cccc(-n2cccn2)c1)c1cc2sccc2c([O-])c1 ZINC000773804047 1050647298 /nfs/dbraw/zinc/64/72/98/1050647298.db2.gz AZODEDYTSUHYIQ-UHFFFAOYSA-N -1 3 335.388 4.045 20 0 EIADHM O=C(c1cc2sccc2c([O-])c1)N1COCC[C@@H]1c1ccccc1 ZINC001179188835 1050654111 /nfs/dbraw/zinc/65/41/11/1050654111.db2.gz YKZNRASXXAUPQL-MRXNPFEDSA-N -1 3 339.416 4.168 20 0 EIADHM Cc1ccc(C(=O)N[C@@H](c2ccc(F)cc2F)C(C)(C)C)c([O-])c1 ZINC001150882218 1050779833 /nfs/dbraw/zinc/77/98/33/1050779833.db2.gz XCMVELPJNMCEPT-KRWDZBQOSA-N -1 3 333.378 4.496 20 0 EIADHM Cc1cccc([O-])c1C(=O)Nc1cc(F)c(OCC2CC2)c(F)c1 ZINC001188655297 1050814086 /nfs/dbraw/zinc/81/40/86/1050814086.db2.gz NPOOCMKFOJJLTH-UHFFFAOYSA-N -1 3 333.334 4.020 20 0 EIADHM Cc1cccc([O-])c1C(=O)Nc1ccc(F)c(C(=O)OC(C)(C)C)c1 ZINC001188655681 1050814246 /nfs/dbraw/zinc/81/42/46/1050814246.db2.gz VOKJICMECXAXNT-UHFFFAOYSA-N -1 3 345.370 4.047 20 0 EIADHM CC(C)(C)[C@H]1CCCN(Cc2ncc(Br)cc2[O-])CC1 ZINC001179931608 1050821926 /nfs/dbraw/zinc/82/19/26/1050821926.db2.gz OYUBGLZETZJGGG-LBPRGKRZSA-N -1 3 341.293 4.198 20 0 EIADHM O=S(=O)(Cc1ccc(F)c(F)c1)[N-]c1ccccc1-c1ccco1 ZINC001189319911 1050964266 /nfs/dbraw/zinc/96/42/66/1050964266.db2.gz ZICJPOZTKODLMI-UHFFFAOYSA-N -1 3 349.358 4.167 20 0 EIADHM Cc1ccc(F)c([N-]S(=O)(=O)Cc2ccccc2C(F)(F)F)c1 ZINC001189531736 1051014851 /nfs/dbraw/zinc/01/48/51/1051014851.db2.gz NRYZYHPNJDANEU-UHFFFAOYSA-N -1 3 347.333 4.095 20 0 EIADHM CCCc1c(C(=O)Nc2ccc(Cl)cc2[O-])[nH]c(C)c1C(C)=O ZINC000153450432 1051044185 /nfs/dbraw/zinc/04/41/85/1051044185.db2.gz FZSIAEGQAAFSEB-UHFFFAOYSA-N -1 3 334.803 4.090 20 0 EIADHM N#Cc1ccccc1-c1ccccc1C(=O)Nc1ccc([O-])cc1F ZINC000183258005 1051047016 /nfs/dbraw/zinc/04/70/16/1051047016.db2.gz YPBHRNDPLPUIGC-UHFFFAOYSA-N -1 3 332.334 4.322 20 0 EIADHM CCc1cccc(CC)c1NC(=O)[N-]c1cc(C(F)(F)F)no1 ZINC001189745866 1051047894 /nfs/dbraw/zinc/04/78/94/1051047894.db2.gz ZSQUIHMTVDRZCI-UHFFFAOYSA-N -1 3 327.306 4.462 20 0 EIADHM Cc1cccnc1[C@@H](C)NC(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC001180703222 1051068427 /nfs/dbraw/zinc/06/84/27/1051068427.db2.gz UDNDFQIWRHICPB-MRXNPFEDSA-N -1 3 346.430 4.177 20 0 EIADHM COc1cc(Nc2cc(Br)cc(F)c2[O-])cc(F)c1F ZINC001174586545 1051070516 /nfs/dbraw/zinc/07/05/16/1051070516.db2.gz YFLKQYPCSSESNF-UHFFFAOYSA-N -1 3 348.118 4.324 20 0 EIADHM COc1ccc(-c2cccc(C(=O)Nc3nc(C)ccc3[O-])c2)cc1 ZINC001190305438 1051145936 /nfs/dbraw/zinc/14/59/36/1051145936.db2.gz ANRYKHKIXATREP-UHFFFAOYSA-N -1 3 334.375 4.024 20 0 EIADHM Cc1ccccc1-c1cccc(C(=O)Nc2nnc(C(F)(F)F)[n-]2)c1 ZINC001190281053 1051149285 /nfs/dbraw/zinc/14/92/85/1051149285.db2.gz NPIHYCBYWVDUSP-UHFFFAOYSA-N -1 3 346.312 4.051 20 0 EIADHM Cc1ccccc1-c1cccc(C(=O)Nc2nc(C(F)(F)F)n[n-]2)c1 ZINC001190281053 1051149292 /nfs/dbraw/zinc/14/92/92/1051149292.db2.gz NPIHYCBYWVDUSP-UHFFFAOYSA-N -1 3 346.312 4.051 20 0 EIADHM Cc1cc(=O)[n-]c(CN(Cc2ccccc2)Cc2ccccc2C)n1 ZINC001190596860 1051228990 /nfs/dbraw/zinc/22/89/90/1051228990.db2.gz FNKQNSHKFQFVSQ-UHFFFAOYSA-N -1 3 333.435 4.001 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-][C@@H]2CCCCC23CCCC3)c(F)c1F ZINC001190816722 1051283756 /nfs/dbraw/zinc/28/37/56/1051283756.db2.gz BTMWFZYORZVMMS-CQSZACIVSA-N -1 3 343.439 4.055 20 0 EIADHM CCOC(=O)c1ccc2c(cccc2Nc2c(F)cc([O-])cc2F)n1 ZINC001175099412 1051345271 /nfs/dbraw/zinc/34/52/71/1051345271.db2.gz FQLKZWPQNPFYPM-UHFFFAOYSA-N -1 3 344.317 4.139 20 0 EIADHM CCOC(=O)c1cc2cc(Nc3c(F)cc([O-])cc3F)ccc2o1 ZINC001175100014 1051348346 /nfs/dbraw/zinc/34/83/46/1051348346.db2.gz MZCRAZYDERDDIO-UHFFFAOYSA-N -1 3 333.290 4.337 20 0 EIADHM CCCCc1ccc(S(=O)(=O)[N-]c2c(C)cc(OC)cc2C)cc1 ZINC001191249605 1051393279 /nfs/dbraw/zinc/39/32/79/1051393279.db2.gz XDOVCFNWCDITAK-UHFFFAOYSA-N -1 3 347.480 4.455 20 0 EIADHM C[C@H](CC(=O)[N-]OCCCC(F)(F)F)Cc1ccc(Cl)cc1 ZINC001175284625 1051484313 /nfs/dbraw/zinc/48/43/13/1051484313.db2.gz OJFILABHFSMQPE-NSHDSACASA-N -1 3 337.769 4.299 20 0 EIADHM [O-]c1ccc(F)c(Nc2nc(Cl)c(Cl)nc2Cl)c1F ZINC001175266154 1051503486 /nfs/dbraw/zinc/50/34/86/1051503486.db2.gz OTEHBWZQUTZWNS-UHFFFAOYSA-N -1 3 326.517 4.164 20 0 EIADHM [O-]c1ccc(F)c(Nc2cccc(F)c2OC[C@H]2CCCO2)c1F ZINC001175270583 1051510230 /nfs/dbraw/zinc/51/02/30/1051510230.db2.gz FMCMAIMAYBHZIU-SNVBAGLBSA-N -1 3 339.313 4.111 20 0 EIADHM [O-]c1c(F)cc(Br)cc1Nc1ccc(-n2cccn2)cc1 ZINC001175375094 1051560000 /nfs/dbraw/zinc/56/00/00/1051560000.db2.gz SLROIUGQCTZBFB-UHFFFAOYSA-N -1 3 348.175 4.223 20 0 EIADHM Cc1c(F)ccc([N-]S(=O)(=O)Cc2ccc(Cl)cc2F)c1F ZINC001191904011 1051584773 /nfs/dbraw/zinc/58/47/73/1051584773.db2.gz LVCTXMGAKLLWLZ-UHFFFAOYSA-N -1 3 349.761 4.008 20 0 EIADHM COc1ccccc1-c1ccc(Nc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC001175429970 1051587403 /nfs/dbraw/zinc/58/74/03/1051587403.db2.gz YJUBIBKUAIBREZ-UHFFFAOYSA-N -1 3 343.390 4.286 20 0 EIADHM c1ccc2c(c1)Cc1cc(Nc3ccc(-c4nn[n-]n4)cc3)ccc1-2 ZINC001175430247 1051588399 /nfs/dbraw/zinc/58/83/99/1051588399.db2.gz MDBFXCGMVOVXAT-UHFFFAOYSA-N -1 3 325.375 4.182 20 0 EIADHM COc1ccc2cc(S(=O)(=O)[N-]c3cc(C)ccc3F)ccc2c1 ZINC001191965978 1051601776 /nfs/dbraw/zinc/60/17/76/1051601776.db2.gz CFVFOFKATAXFLR-UHFFFAOYSA-N -1 3 345.395 4.097 20 0 EIADHM C[C@@H]1CN(CCSc2cc(Cl)ccc2Cl)CC[C@H]1C(=O)[O-] ZINC000385874455 1051607362 /nfs/dbraw/zinc/60/73/62/1051607362.db2.gz OBXASROZKKMASS-ZYHUDNBSSA-N -1 3 348.295 4.128 20 0 EIADHM COc1cc(NC2=CCN(Cc3ccccc3)CC2)ccc1[S-] ZINC001175507778 1051638689 /nfs/dbraw/zinc/63/86/89/1051638689.db2.gz WBILIHQNAJXXGI-UHFFFAOYSA-N -1 3 326.465 4.186 20 0 EIADHM CC1=Nc2ccccc2C12CCN(Cc1ccc([O-])c(F)c1F)CC2 ZINC001182653166 1051670243 /nfs/dbraw/zinc/67/02/43/1051670243.db2.gz GAJQCAIWZZYWAI-UHFFFAOYSA-N -1 3 342.389 4.310 20 0 EIADHM O=C(Nc1ccc(OC(F)F)c(Cl)c1)Nc1cc(F)ccc1[O-] ZINC001192315640 1051688860 /nfs/dbraw/zinc/68/88/60/1051688860.db2.gz ZSIFHMCTXQHYGB-UHFFFAOYSA-N -1 3 346.692 4.430 20 0 EIADHM CC(C)(C)c1ccc(C(=O)N2C[C@@H]3C[C@H](C2)c2ccccc23)c([O-])c1 ZINC001192322856 1051689502 /nfs/dbraw/zinc/68/95/02/1051689502.db2.gz QFCDLEUGHHDVKP-GASCZTMLSA-N -1 3 335.447 4.417 20 0 EIADHM CN(CCc1ccc(F)cc1)C(=O)c1ccc(C(C)(C)C)cc1[O-] ZINC001192322615 1051689805 /nfs/dbraw/zinc/68/98/05/1051689805.db2.gz GNEVXSCLVMOKOW-UHFFFAOYSA-N -1 3 329.415 4.144 20 0 EIADHM C[C@@H](C(=O)Nc1ncccc1[O-])c1cccc(Oc2ccccc2)c1 ZINC001182735699 1051694511 /nfs/dbraw/zinc/69/45/11/1051694511.db2.gz HLAQMWRGZGAZPF-CQSZACIVSA-N -1 3 334.375 4.322 20 0 EIADHM CCN(CC)C(=O)c1ccc(F)c([N-]c2nc3ccc(F)cc3o2)c1 ZINC001176069468 1051885235 /nfs/dbraw/zinc/88/52/35/1051885235.db2.gz AOSWDZFBHZCYQS-UHFFFAOYSA-N -1 3 345.349 4.332 20 0 EIADHM CC[C@]1(C(=O)[O-])CCCN(Cc2csc(-c3ccc(C)cc3)n2)C1 ZINC000324975840 1051984154 /nfs/dbraw/zinc/98/41/54/1051984154.db2.gz PPEQCQAQIWSZSM-IBGZPJMESA-N -1 3 344.480 4.195 20 0 EIADHM O=C([O-])[C@@H]1CN(CCCCc2cccc(Cl)c2)Cc2ccccc21 ZINC000622002035 1052069553 /nfs/dbraw/zinc/06/95/53/1052069553.db2.gz SPWSKBOYWGUXQM-LJQANCHMSA-N -1 3 343.854 4.347 20 0 EIADHM Cc1cc(Br)ccc1NC(=O)Nc1cc(F)ccc1[O-] ZINC001184817088 1052111528 /nfs/dbraw/zinc/11/15/28/1052111528.db2.gz CSKLARAHTGLAEG-UHFFFAOYSA-N -1 3 339.164 4.246 20 0 EIADHM Cc1cc([O-])c(NC(=O)N[C@H](C)c2ccccc2)cc1Br ZINC001185022253 1052146489 /nfs/dbraw/zinc/14/64/89/1052146489.db2.gz RSZHSDSCPSSSFO-LLVKDONJSA-N -1 3 349.228 4.346 20 0 EIADHM O=C(Nc1ccc(F)c(F)c1)Nc1ccc(C(F)(F)F)cc1[O-] ZINC001185090426 1052164518 /nfs/dbraw/zinc/16/45/18/1052164518.db2.gz XOPNAETYFCIAES-UHFFFAOYSA-N -1 3 332.228 4.333 20 0 EIADHM CCCOc1ccc(Cl)cc1NC(=O)Cc1ccc([O-])c(F)c1 ZINC000622317213 1052204619 /nfs/dbraw/zinc/20/46/19/1052204619.db2.gz QQKVTFPUTDSUON-UHFFFAOYSA-N -1 3 337.778 4.155 20 0 EIADHM CCCN(CCc1cccc(F)c1)C(=O)c1cc([O-])ccc1Cl ZINC000622371507 1052227212 /nfs/dbraw/zinc/22/72/12/1052227212.db2.gz PMKLBMPRMYVWGX-UHFFFAOYSA-N -1 3 335.806 4.280 20 0 EIADHM O=C(Cc1ccc([O-])c(F)c1)Nc1ccc(OC2CCCCC2)cc1 ZINC000622376003 1052228714 /nfs/dbraw/zinc/22/87/14/1052228714.db2.gz WVYAMQSRBUZMLT-UHFFFAOYSA-N -1 3 343.398 4.424 20 0 EIADHM Cc1ccc(C[C@H](C)NC(=O)c2cc([O-])cc(C(F)(F)F)c2)s1 ZINC000622383749 1052238944 /nfs/dbraw/zinc/23/89/44/1052238944.db2.gz MQVBSJWZSURMAF-VIFPVBQESA-N -1 3 343.370 4.142 20 0 EIADHM Cc1cc(S(=O)(=O)[N-]c2cccc(Cl)c2F)ccc1Cl ZINC001185521332 1052255813 /nfs/dbraw/zinc/25/58/13/1052255813.db2.gz QGIXTAJDYRGTQE-UHFFFAOYSA-N -1 3 334.199 4.242 20 0 EIADHM CC(C)C[C@H]1CCCCN1C(=O)c1cc([O-])cc(C(F)(F)F)c1 ZINC000622431471 1052266626 /nfs/dbraw/zinc/26/66/26/1052266626.db2.gz CHYMNFRDNRIOSL-CQSZACIVSA-N -1 3 329.362 4.452 20 0 EIADHM O=C(Cc1ccc([O-])c(F)c1)N1CCC[C@H]1CCC1CCCCC1 ZINC000622447395 1052280103 /nfs/dbraw/zinc/28/01/03/1052280103.db2.gz HBMLJALEZNUWDE-KRWDZBQOSA-N -1 3 333.447 4.425 20 0 EIADHM CCN(CC(C)(C)C)C(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000622611538 1052348281 /nfs/dbraw/zinc/34/82/81/1052348281.db2.gz VABONQGPIUATBX-UHFFFAOYSA-N -1 3 325.452 4.491 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)NCc1cc(C2CC2)ccc1F ZINC000622629064 1052358222 /nfs/dbraw/zinc/35/82/22/1052358222.db2.gz YAFSBOXSEDGKEO-UHFFFAOYSA-N -1 3 345.389 4.187 20 0 EIADHM CCc1cccc(C(=O)N2CCC[C@H]2c2ccc(F)cc2C)c1[O-] ZINC000622667623 1052371374 /nfs/dbraw/zinc/37/13/74/1052371374.db2.gz MXAQYOLYVQQMQO-SFHVURJKSA-N -1 3 327.399 4.379 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)N1CC[C@H](C2CCCCC2)C1 ZINC000622750510 1052424468 /nfs/dbraw/zinc/42/44/68/1052424468.db2.gz JODLBTWRZFGLBL-KRWDZBQOSA-N -1 3 333.447 4.283 20 0 EIADHM O=C(Nc1cc(F)ccc1[O-])c1ncoc1-c1ccccc1Cl ZINC000174906128 1052576719 /nfs/dbraw/zinc/57/67/19/1052576719.db2.gz QTZLEPUSMDHZQS-UHFFFAOYSA-N -1 3 332.718 4.092 20 0 EIADHM Cc1noc(C)c1[N-]C(=O)c1cnc(-c2ccc(C)cc2C)s1 ZINC000623286695 1052615643 /nfs/dbraw/zinc/61/56/43/1052615643.db2.gz WHZHHDWLYGSPTE-UHFFFAOYSA-N -1 3 327.409 4.284 20 0 EIADHM Cc1cc(=O)[n-]c([C@@H](C)N[C@H](C)c2ccc(SC(C)C)cc2)n1 ZINC000192731850 1052634414 /nfs/dbraw/zinc/63/44/14/1052634414.db2.gz ZTABGHVUWSJXPO-ZIAGYGMSSA-N -1 3 331.485 4.403 20 0 EIADHM CCc1ccc([O-])c(C(=O)N(C)[C@H](C)c2nc3ccccc3s2)c1 ZINC000180335079 1052794695 /nfs/dbraw/zinc/79/46/95/1052794695.db2.gz QQWVZGRGPDPZHN-GFCCVEGCSA-N -1 3 340.448 4.398 20 0 EIADHM Clc1ccc(-c2ccc(C[N-]c3nnc([C@@H]4CCCO4)o3)o2)cc1 ZINC000181796589 1052898044 /nfs/dbraw/zinc/89/80/44/1052898044.db2.gz APMSOFQGQPLBRV-HNNXBMFYSA-N -1 3 345.786 4.447 20 0 EIADHM c1c2ccccc2oc1C[N-]c1nnc([C@H]2Cc3ccccc3O2)o1 ZINC000181957241 1052905463 /nfs/dbraw/zinc/90/54/63/1052905463.db2.gz PRGNVCHRKMLVBV-QGZVFWFLSA-N -1 3 333.347 4.104 20 0 EIADHM CCC(=O)c1cccc(NC(=O)c2cc([O-])ccc2C(F)(F)F)c1 ZINC000193610419 1053028452 /nfs/dbraw/zinc/02/84/52/1053028452.db2.gz NLXPGSVXDSQGKT-UHFFFAOYSA-N -1 3 337.297 4.256 20 0 EIADHM O=C(Nc1cc([O-])cc(Cl)c1)c1ccc(-c2ccc(F)cc2)cn1 ZINC001194758588 1053096453 /nfs/dbraw/zinc/09/64/53/1053096453.db2.gz OIXFZPNSJILGQK-UHFFFAOYSA-N -1 3 342.757 4.499 20 0 EIADHM Cc1noc(-c2ccccc2)c1[N-]C(=O)c1ccc(C)c(F)c1F ZINC001127780980 1053210808 /nfs/dbraw/zinc/21/08/08/1053210808.db2.gz VAJKRCPVJHPOKX-UHFFFAOYSA-N -1 3 328.318 4.489 20 0 EIADHM Cc1cc(=O)[n-]c(CS[C@H](C)c2cccc(Br)c2)n1 ZINC000764655906 1053249685 /nfs/dbraw/zinc/24/96/85/1053249685.db2.gz YTTRAENGZOKWDG-SNVBAGLBSA-N -1 3 339.258 4.248 20 0 EIADHM CC(C)(C)c1csc(CNCCC2(CC(=O)[O-])CCCCC2)n1 ZINC000864514087 1053301090 /nfs/dbraw/zinc/30/10/90/1053301090.db2.gz OAMCQHHCLYNVHH-UHFFFAOYSA-N -1 3 338.517 4.346 20 0 EIADHM Cc1ccc([N-]S(=O)(=O)c2c(C)cccc2Cl)c(F)c1F ZINC001195310243 1053375859 /nfs/dbraw/zinc/37/58/59/1053375859.db2.gz VSZIUBARAUKCFD-UHFFFAOYSA-N -1 3 331.771 4.036 20 0 EIADHM [O-]c1cc(Cl)ccc1NC(=S)NCc1cccc(Cl)c1 ZINC001195979733 1053538847 /nfs/dbraw/zinc/53/88/47/1053538847.db2.gz MLAMERWSNZJKIW-UHFFFAOYSA-N -1 3 327.236 4.186 20 0 EIADHM CCc1cc2c(CSc3nc(C)c(C)s3)cc(=O)oc2cc1[O-] ZINC000741857601 1053547408 /nfs/dbraw/zinc/54/74/08/1053547408.db2.gz PQKSGLHZVOLNHQ-UHFFFAOYSA-N -1 3 347.461 4.427 20 0 EIADHM COc1cccc(NC(=S)Nc2ccc(C(F)(F)F)cc2[O-])c1 ZINC001196048951 1053572105 /nfs/dbraw/zinc/57/21/05/1053572105.db2.gz AHYGHPFBHVXMKQ-UHFFFAOYSA-N -1 3 342.342 4.229 20 0 EIADHM CCC[C@@H](CCc1ccccc1)NC(=O)c1cc(=O)c2ccccc2[n-]1 ZINC000265955383 1053589433 /nfs/dbraw/zinc/58/94/33/1053589433.db2.gz DVSFIKONLTUZSB-KRWDZBQOSA-N -1 3 348.446 4.472 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1ccc2nc(Cl)ccc2c1 ZINC000111210207 1053663591 /nfs/dbraw/zinc/66/35/91/1053663591.db2.gz KLAQRPNQPBOQLA-UHFFFAOYSA-N -1 3 333.174 4.500 20 0 EIADHM [O-]c1cccc(Cl)c1NC(=S)NCc1ccccc1Cl ZINC001196828012 1053783411 /nfs/dbraw/zinc/78/34/11/1053783411.db2.gz NZUWUZRNMSCBCI-UHFFFAOYSA-N -1 3 327.236 4.186 20 0 EIADHM [O-]c1cccc(Br)c1NC(=S)Nc1ccc(F)cc1 ZINC001196941935 1053809756 /nfs/dbraw/zinc/80/97/56/1053809756.db2.gz BMJRBTYCYWSBKR-UHFFFAOYSA-N -1 3 341.205 4.103 20 0 EIADHM COc1ccc(NC(=O)c2cc([O-])c3ccccc3c2)c2cccnc12 ZINC000471856275 1053908357 /nfs/dbraw/zinc/90/83/57/1053908357.db2.gz KCPFSVGWFHAEBJ-UHFFFAOYSA-N -1 3 344.370 4.355 20 0 EIADHM Cc1ccc(NC(=S)NCc2ccc(Cl)cc2)c(Cl)c1[O-] ZINC001197577719 1053930743 /nfs/dbraw/zinc/93/07/43/1053930743.db2.gz FAPFRHPFWKMMCK-UHFFFAOYSA-N -1 3 341.263 4.494 20 0 EIADHM CC(C)(C)c1nnc([N-]C(=O)c2ccc(C(F)(F)F)s2)s1 ZINC000671664996 1053963291 /nfs/dbraw/zinc/96/32/91/1053963291.db2.gz REHDKVOOKASNLU-UHFFFAOYSA-N -1 3 335.376 4.168 20 0 EIADHM COc1ccc2oc(C(=O)[N-]c3nc(CC(C)C)ns3)c(C)c2c1 ZINC000855706058 1053965626 /nfs/dbraw/zinc/96/56/26/1053965626.db2.gz SSORETONPNPYPG-UHFFFAOYSA-N -1 3 345.424 4.052 20 0 EIADHM Cc1ccc(F)c([N-]S(=O)(=O)Cc2cccc(Cl)c2Cl)c1 ZINC001197749885 1053990191 /nfs/dbraw/zinc/99/01/91/1053990191.db2.gz MBOVBQICTCKLGI-UHFFFAOYSA-N -1 3 348.226 4.383 20 0 EIADHM Cc1cccc([O-])c1C(=O)N1CCC(=Cc2cccc(F)c2)CC1 ZINC000624293826 1054015885 /nfs/dbraw/zinc/01/58/85/1054015885.db2.gz UDABXPIKFBINFU-UHFFFAOYSA-N -1 3 325.383 4.159 20 0 EIADHM O=C([N-]OCC1CCC1)[C@H]1CC=CC[C@H]1c1nc2ccccc2s1 ZINC000856346076 1054060587 /nfs/dbraw/zinc/06/05/87/1054060587.db2.gz NUBOBBHLSLRBHT-LSDHHAIUSA-N -1 3 342.464 4.194 20 0 EIADHM CCN(Cc1cccs1)Cc1nc2c3ccccc3oc2c(=O)[n-]1 ZINC000034872273 1054129001 /nfs/dbraw/zinc/12/90/01/1054129001.db2.gz SSMNEPKXAKZYIB-UHFFFAOYSA-N -1 3 339.420 4.165 20 0 EIADHM O=C(NCC1([C@H]2CCCCO2)CCC1)c1cc([O-])c2ccccc2c1 ZINC000871044080 1054149388 /nfs/dbraw/zinc/14/93/88/1054149388.db2.gz DSEAOQNXNRTAGB-LJQANCHMSA-N -1 3 339.435 4.015 20 0 EIADHM O=C(CCc1cccc(C(F)(F)F)c1)[N-]OCCCC(F)(F)F ZINC000871214679 1054169949 /nfs/dbraw/zinc/16/99/49/1054169949.db2.gz IUUKIZNJZRWBET-UHFFFAOYSA-N -1 3 343.267 4.028 20 0 EIADHM Cc1cn(-c2ccc(Cl)cc2)nc1NC(=O)c1c(C)cccc1[O-] ZINC001626052874 1054198627 /nfs/dbraw/zinc/19/86/27/1054198627.db2.gz WEZIQYPKIKVZRP-UHFFFAOYSA-N -1 3 341.798 4.100 20 0 EIADHM Cn1cccc1[C@@H]1CCCCN1C(=O)c1cc([O-])c2ccccc2c1 ZINC000472248113 1054251351 /nfs/dbraw/zinc/25/13/51/1054251351.db2.gz AKOHBMRKERDTDD-IBGZPJMESA-N -1 3 334.419 4.251 20 0 EIADHM O=S(=O)([N-]c1cc(Cl)ccc1F)c1ccc2occc2c1 ZINC001198854138 1054279784 /nfs/dbraw/zinc/27/97/84/1054279784.db2.gz ANECFLLHFOGECO-UHFFFAOYSA-N -1 3 325.748 4.026 20 0 EIADHM C[C@H](CCc1ccc(O)cc1)NC(=O)c1cc([O-])c2ccccc2c1 ZINC000472353709 1054284148 /nfs/dbraw/zinc/28/41/48/1054284148.db2.gz SHRZRCCYAAHTIR-CQSZACIVSA-N -1 3 335.403 4.002 20 0 EIADHM CCOCC(C)(C)[N-]C(=O)C(F)(F)c1cccc(Cl)c1Cl ZINC000857512509 1054290699 /nfs/dbraw/zinc/29/06/99/1054290699.db2.gz NYBROSAEASIXGM-UHFFFAOYSA-N -1 3 340.197 4.017 20 0 EIADHM C[C@@H]([N-]C(=O)C(F)(F)c1ccccc1F)c1ccc(Cl)cc1 ZINC000857536013 1054303343 /nfs/dbraw/zinc/30/33/43/1054303343.db2.gz MAHYZSOFEABRJM-SNVBAGLBSA-N -1 3 327.733 4.448 20 0 EIADHM Cc1cc(C)c(C(=O)COC(=O)c2cc(Cl)c(Cl)[n-]2)cc1C ZINC000011809349 1054322670 /nfs/dbraw/zinc/32/26/70/1054322670.db2.gz SZUNNYWDKHFJAD-UHFFFAOYSA-N -1 3 340.206 4.286 20 0 EIADHM COCCCOc1cc(C)ccc1CN[C@@H](C)c1cccc([O-])c1F ZINC000872043233 1054356953 /nfs/dbraw/zinc/35/69/53/1054356953.db2.gz VXBSRQACEIWOON-HNNXBMFYSA-N -1 3 347.430 4.106 20 0 EIADHM C[C@@H](N[C@@H]1CCc2cc(F)c(F)c(F)c21)c1cccc([O-])c1F ZINC000872076711 1054381167 /nfs/dbraw/zinc/38/11/67/1054381167.db2.gz QKXURFRVAQGPTA-PRHODGIISA-N -1 3 325.305 4.287 20 0 EIADHM C[C@H](N[C@@H](CCO)c1ccc(Cl)c(F)c1)c1cccc([O-])c1F ZINC000872093670 1054387665 /nfs/dbraw/zinc/38/76/65/1054387665.db2.gz WCUCVJJZWBXGOR-BONVTDFDSA-N -1 3 341.785 4.098 20 0 EIADHM COc1cccc(CNCc2ccc([O-])c(Cl)c2)c1OC(C)C ZINC000873179587 1054501672 /nfs/dbraw/zinc/50/16/72/1054501672.db2.gz RJNLFKZGDRMQSI-UHFFFAOYSA-N -1 3 335.831 4.131 20 0 EIADHM [O-]c1cccc(C(F)(F)F)c1NC(=S)Nc1ccc(F)cc1F ZINC001200933028 1054582148 /nfs/dbraw/zinc/58/21/48/1054582148.db2.gz NQHNWWJXGXEXHU-UHFFFAOYSA-N -1 3 348.296 4.498 20 0 EIADHM Cc1csc([C@H]2CCN(C(=O)c3cc4sccc4c([O-])c3)C2)n1 ZINC000874497440 1054688105 /nfs/dbraw/zinc/68/81/05/1054688105.db2.gz BNLSYTPXRRQCFY-NSHDSACASA-N -1 3 344.461 4.002 20 0 EIADHM CN(Cc1c(F)cccc1Cl)C(=O)c1cc(=O)c2ccccc2[n-]1 ZINC000061205512 1054748201 /nfs/dbraw/zinc/74/82/01/1054748201.db2.gz BMFNMJXRTNRTTI-UHFFFAOYSA-N -1 3 344.773 4.005 20 0 EIADHM CC(C)Cc1nnc([N-]C(=O)c2cc3c(cccc3F)s2)s1 ZINC000021353668 1054838835 /nfs/dbraw/zinc/83/88/35/1054838835.db2.gz QXNTWLXYNCVMQO-UHFFFAOYSA-N -1 3 335.429 4.343 20 0 EIADHM CCCCC1CCC(CNC(=O)c2cc(=O)c3ccccc3[n-]2)CC1 ZINC000065848440 1054967635 /nfs/dbraw/zinc/96/76/35/1054967635.db2.gz VTCGNUSLZZIKPS-UHFFFAOYSA-N -1 3 340.467 4.255 20 0 EIADHM CCOc1ccccc1NC(=O)Nc1ccc(C(F)(F)F)cc1[O-] ZINC001202147772 1055051831 /nfs/dbraw/zinc/05/18/31/1055051831.db2.gz LONPIPSMHTYAHE-UHFFFAOYSA-N -1 3 340.301 4.454 20 0 EIADHM COCc1c2ccccc2oc1C(=O)[N-]c1c(F)cc(F)cc1F ZINC000072504911 1055134703 /nfs/dbraw/zinc/13/47/03/1055134703.db2.gz LALWQNRCHGGTAI-UHFFFAOYSA-N -1 3 335.281 4.249 20 0 EIADHM O=c1[n-]c(CSC2=Nc3ccccc3C2)nc2c3ccccc3oc21 ZINC000119249482 1055144424 /nfs/dbraw/zinc/14/44/24/1055144424.db2.gz RINRXLYLGHPGAF-UHFFFAOYSA-N -1 3 347.399 4.189 20 0 EIADHM [O-]c1ccccc1-c1nnc(CN2CCCCC[C@@H]2c2ccco2)o1 ZINC000878116608 1055189371 /nfs/dbraw/zinc/18/93/71/1055189371.db2.gz JXGLMXVAOVJGGI-OAHLLOKOSA-N -1 3 339.395 4.153 20 0 EIADHM Cc1sc2[n-]c([C@H](C)OC(=O)CCC3CCCC3)nc(=O)c2c1C ZINC000006292008 1055232656 /nfs/dbraw/zinc/23/26/56/1055232656.db2.gz FLSRMNJHFDLDPA-NSHDSACASA-N -1 3 348.468 4.176 20 0 EIADHM [O-]c1ccccc1-c1nnc(CN[C@H](CC2CCC2)c2ccccc2)o1 ZINC000878383180 1055283328 /nfs/dbraw/zinc/28/33/28/1055283328.db2.gz KIRPGEDVYZLDQQ-GOSISDBHSA-N -1 3 349.434 4.463 20 0 EIADHM COCCOc1c(Cl)cccc1N[C@H](C)c1ccc(F)cc1[O-] ZINC000186342470 1055370449 /nfs/dbraw/zinc/37/04/49/1055370449.db2.gz KQRKXSXNLIPUSQ-LLVKDONJSA-N -1 3 339.794 4.383 20 0 EIADHM C[C@]([N-]C(=O)c1c(F)cccc1F)(c1ccc(F)cc1)C(F)(F)F ZINC000542869122 1056375653 /nfs/dbraw/zinc/37/56/53/1056375653.db2.gz MNPQMEIGXUQLBT-HNNXBMFYSA-N -1 3 347.258 4.311 20 0 EIADHM O=C(CNc1cccc(C(F)(F)F)c1)Nc1cc(Cl)ccc1[O-] ZINC000111100459 1056746957 /nfs/dbraw/zinc/74/69/57/1056746957.db2.gz OAQHZPGQZDGYKC-UHFFFAOYSA-N -1 3 344.720 4.115 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1cc(-c2ccccc2F)on1 ZINC000111210408 1056771806 /nfs/dbraw/zinc/77/18/06/1056771806.db2.gz LFONJTSCCVBEFK-UHFFFAOYSA-N -1 3 332.718 4.092 20 0 EIADHM CC[C@@](C)([N-]C(=O)C(F)(F)c1ccc(F)cc1)c1nc(C)cs1 ZINC000741616881 1058312031 /nfs/dbraw/zinc/31/20/31/1058312031.db2.gz QPWKNTDMTZPVPS-OAHLLOKOSA-N -1 3 342.386 4.124 20 0 EIADHM Cc1nc(SCc2nc3c4ccccc4oc3c(=O)[n-]2)sc1C ZINC000741861157 1058406453 /nfs/dbraw/zinc/40/64/53/1058406453.db2.gz ZTEKDIJEIDHBBD-UHFFFAOYSA-N -1 3 343.433 4.447 20 0 EIADHM CCCCC[C@@H](C)CC(=O)Nc1ccc(-c2nc(C)cc(=O)[n-]2)cc1 ZINC000742583323 1058681323 /nfs/dbraw/zinc/68/13/23/1058681323.db2.gz OQOZMKUBWZLPTH-CQSZACIVSA-N -1 3 341.455 4.290 20 0 EIADHM CC(=O)CCCOC(=O)c1cc(-c2ccccc2)cc(Cl)c1[O-] ZINC000746080013 1060005318 /nfs/dbraw/zinc/00/53/18/1060005318.db2.gz QQUNKSIACGOBHW-UHFFFAOYSA-N -1 3 332.783 4.239 20 0 EIADHM O=C(OCc1ccon1)c1cc(-c2ccccc2)cc(Cl)c1[O-] ZINC000746080688 1060006501 /nfs/dbraw/zinc/00/65/01/1060006501.db2.gz ZHMAKRFYHWVLQA-UHFFFAOYSA-N -1 3 329.739 4.058 20 0 EIADHM COc1ccc(-c2cc(Nc3ccc(Cl)c([O-])c3)n(C)n2)cc1 ZINC001212588647 1060759474 /nfs/dbraw/zinc/75/94/74/1060759474.db2.gz WQBBLJZTEGEIBI-UHFFFAOYSA-N -1 3 329.787 4.198 20 0 EIADHM [O-]c1cc(Nc2cccn3c(Br)cnc23)ccc1Cl ZINC001212588162 1060763661 /nfs/dbraw/zinc/76/36/61/1060763661.db2.gz HUQKQRIPNYZBCD-UHFFFAOYSA-N -1 3 338.592 4.199 20 0 EIADHM [O-]c1cc(Nc2cc(Cl)ccc2N2CCOCC2)ccc1Cl ZINC001212592221 1060882867 /nfs/dbraw/zinc/88/28/67/1060882867.db2.gz FIAXCCYQJQCUCA-UHFFFAOYSA-N -1 3 339.222 4.279 20 0 EIADHM Cc1cc(Br)cc2ccc(NCc3ncccc3[O-])nc12 ZINC001169731653 1060933062 /nfs/dbraw/zinc/93/30/62/1060933062.db2.gz FJZDXVFJMJIXEV-UHFFFAOYSA-N -1 3 344.212 4.018 20 0 EIADHM CC(C)(C)c1ccc(Br)c(NCc2ncccc2[O-])c1 ZINC001169731816 1060934829 /nfs/dbraw/zinc/93/48/29/1060934829.db2.gz HSPRFNIXTLXUFK-UHFFFAOYSA-N -1 3 335.245 4.459 20 0 EIADHM Cn1c(-c2cc(Br)ccc2[O-])nc2cccc(Cl)c21 ZINC000037444495 213147957 /nfs/dbraw/zinc/14/79/57/213147957.db2.gz STRQOIQFSRVCLK-UHFFFAOYSA-N -1 3 337.604 4.362 20 0 EIADHM O=c1nc(-c2ccccn2)[n-]c2scc(-c3ccc(Cl)cc3)c21 ZINC000020369430 212123695 /nfs/dbraw/zinc/12/36/95/212123695.db2.gz KXWRQQLLDHKSON-UHFFFAOYSA-N -1 3 339.807 4.367 20 0 EIADHM CCCc1cc(=O)[n-]c(C(=Cc2ccc(SC)c(OC)c2)CC)n1 ZINC000193618946 1032164955 /nfs/dbraw/zinc/16/49/55/1032164955.db2.gz GUEHLEQYNXWYPM-GXDHUFHOSA-N -1 3 344.480 4.404 20 0 EIADHM CC(C)(C)[C@H](NCc1cc(=O)[n-]c(C2CC2)n1)c1ccc(F)cc1F ZINC000459382038 1032249912 /nfs/dbraw/zinc/24/99/12/1032249912.db2.gz DTMVURYIZQYKHS-QGZVFWFLSA-N -1 3 347.409 4.215 20 0 EIADHM Cc1ccc(C(=O)Nc2ccc([O-])c(C(F)(F)F)c2)c(C(C)C)n1 ZINC000450296601 1032408277 /nfs/dbraw/zinc/40/82/77/1032408277.db2.gz FPWCSQRGINBKCG-UHFFFAOYSA-N -1 3 338.329 4.490 20 0 EIADHM CC(C)(c1ccc(NC([O-])=NO[C@@H]2CCCCO2)cc1)C(F)(F)F ZINC000760146936 1032411072 /nfs/dbraw/zinc/41/10/72/1032411072.db2.gz UBOYUEVQFCSENB-CYBMUJFWSA-N -1 3 346.349 4.106 20 0 EIADHM CC(C)(c1ccc(NC(=O)[N-]O[C@@H]2CCCCO2)cc1)C(F)(F)F ZINC000760146936 1032411076 /nfs/dbraw/zinc/41/10/76/1032411076.db2.gz UBOYUEVQFCSENB-CYBMUJFWSA-N -1 3 346.349 4.106 20 0 EIADHM O=C(Nc1ccc(Cl)cc1[O-])c1cccc(OCC(F)(F)F)c1 ZINC000533158818 1032513072 /nfs/dbraw/zinc/51/30/72/1032513072.db2.gz SRXOANRMQKKJNQ-UHFFFAOYSA-N -1 3 345.704 4.239 20 0 EIADHM [O-]c1cccc(CNC2(c3ccccc3)CCC2)c1Br ZINC000459385012 1032531615 /nfs/dbraw/zinc/53/16/15/1032531615.db2.gz FBIAKHMARPCYIX-UHFFFAOYSA-N -1 3 332.241 4.324 20 0 EIADHM CCCCOc1ccc(F)cc1Nc1cccc(C(=O)N(C)C)c1[O-] ZINC001211721565 1032740346 /nfs/dbraw/zinc/74/03/46/1032740346.db2.gz KFNHXLLNUDCVMR-UHFFFAOYSA-N -1 3 346.402 4.156 20 0 EIADHM Cc1ccc(C(F)(F)F)c(-c2noc(-c3cc(Cl)n[n-]3)n2)c1 ZINC001213500985 1018851762 /nfs/dbraw/zinc/85/17/62/1018851762.db2.gz VLOGINARYNPPIH-UHFFFAOYSA-N -1 3 328.681 4.107 20 0 EIADHM Cc1ccc(C)c(CN(C)C(=O)CCCc2ccc([O-])c(F)c2)c1 ZINC000430208704 1019352490 /nfs/dbraw/zinc/35/24/90/1019352490.db2.gz VDYGVJJCAZFICV-UHFFFAOYSA-N -1 3 329.415 4.129 20 0 EIADHM C[C@@H](NC(=O)CCCc1ccc([O-])c(F)c1)C1CCC(F)(F)CC1 ZINC000655341068 1019723808 /nfs/dbraw/zinc/72/38/08/1019723808.db2.gz MPRVUXOXFUQITO-GFCCVEGCSA-N -1 3 343.389 4.184 20 0 EIADHM CC(C)c1cc(C(=O)[N-]c2cc(F)c(Br)cc2F)on1 ZINC000510133039 1019816828 /nfs/dbraw/zinc/81/68/28/1019816828.db2.gz MFDXEGAMWYOLEK-UHFFFAOYSA-N -1 3 345.143 4.091 20 0 EIADHM CC1=C[C@H](C)CN(Cc2nc(=O)c3c(-c4ccco4)csc3[n-]2)C1 ZINC000430284028 1019978316 /nfs/dbraw/zinc/97/83/16/1019978316.db2.gz MFCPARLCPGIBBA-NSHDSACASA-N -1 3 341.436 4.055 20 0 EIADHM CCCOCc1nc(=O)c2c(-c3ccc(C)c(C)c3)csc2[n-]1 ZINC000060090501 1020022056 /nfs/dbraw/zinc/02/20/56/1020022056.db2.gz GTTUDANLHJKDPX-UHFFFAOYSA-N -1 3 328.437 4.195 20 0 EIADHM CC[C@@](C)(NC(=O)c1cc(CCc2ccccc2)ccc1[O-])C1CC1 ZINC001167197701 1020530575 /nfs/dbraw/zinc/53/05/75/1020530575.db2.gz ZKAPHTGBZXQALP-JOCHJYFZSA-N -1 3 337.463 4.486 20 0 EIADHM CSCc1cc(C(=O)Nc2ccc(Cl)cc2[O-])ccc1F ZINC000533616439 1020736314 /nfs/dbraw/zinc/73/63/14/1020736314.db2.gz FSFRRZMUSGBWME-UHFFFAOYSA-N -1 3 325.792 4.300 20 0 EIADHM O=C(OCc1ncccc1C(F)(F)F)c1cc(Cl)c(Cl)[n-]1 ZINC000784971674 1020902085 /nfs/dbraw/zinc/90/20/85/1020902085.db2.gz KKIVNXLIDNXMJA-UHFFFAOYSA-N -1 3 339.100 4.092 20 0 EIADHM Cc1ccnc2c1cccc2S(=O)(=O)[N-]c1c(C)cccc1Cl ZINC000547952796 1020953169 /nfs/dbraw/zinc/95/31/69/1020953169.db2.gz XLLKKMCRWQTQID-UHFFFAOYSA-N -1 3 346.839 4.306 20 0 EIADHM CC(C)c1cc(Cl)ccc1NC(=O)c1nnc2ccccc2c1[O-] ZINC001167304702 1020993042 /nfs/dbraw/zinc/99/30/42/1020993042.db2.gz QGEZHANFEVLMBR-UHFFFAOYSA-N -1 3 341.798 4.365 20 0 EIADHM CC(C)c1ccc(-c2nc(C3(c4ccncc4)CCC3)no2)c([O-])c1 ZINC000656033675 1021299484 /nfs/dbraw/zinc/29/94/84/1021299484.db2.gz YECVZULGKSMTGA-UHFFFAOYSA-N -1 3 335.407 4.431 20 0 EIADHM [O-]c1ccc(F)c(CNCc2ccc(-c3cccnc3)cc2)c1F ZINC000511378295 1021368876 /nfs/dbraw/zinc/36/88/76/1021368876.db2.gz BFDMYILJICUWNQ-UHFFFAOYSA-N -1 3 326.346 4.022 20 0 EIADHM O=C(Nc1nc2c(s1)CSCC2)c1cc([O-])c2ccccc2c1 ZINC000376118509 1021515512 /nfs/dbraw/zinc/51/55/12/1021515512.db2.gz UIMCWTZZUCBGMJ-UHFFFAOYSA-N -1 3 342.445 4.044 20 0 EIADHM [O-]c1cccc(Nc2ccccc2-n2cccn2)c1Br ZINC001210734558 1021583777 /nfs/dbraw/zinc/58/37/77/1021583777.db2.gz HPAJXKGSXRKXSM-UHFFFAOYSA-N -1 3 330.185 4.084 20 0 EIADHM Cc1cc(C(=O)Nc2ccc(Cl)cc2[O-])c(C)n1C1CCOCC1 ZINC000613026645 1021636501 /nfs/dbraw/zinc/63/65/01/1021636501.db2.gz HLOOUNOARJPEGI-UHFFFAOYSA-N -1 3 348.830 4.068 20 0 EIADHM CC(C)(C)OCCCCOC(=O)c1cccc2[n-]c(C(F)F)nc21 ZINC000924080392 1021802130 /nfs/dbraw/zinc/80/21/30/1021802130.db2.gz SLTYPCRVYZIINY-UHFFFAOYSA-N -1 3 340.370 4.253 20 0 EIADHM COc1ccc2c(c1)C[C@@H](C(C)C)CN2C(=O)c1ccc(C)cc1[O-] ZINC000622728567 1021838125 /nfs/dbraw/zinc/83/81/25/1021838125.db2.gz FNIPOVRSJFIZDY-MRXNPFEDSA-N -1 3 339.435 4.184 20 0 EIADHM CCc1nc(C)c([C@H](C)N(C)C(=O)c2cc([O-])ccc2Cl)s1 ZINC000340653451 1021875106 /nfs/dbraw/zinc/87/51/06/1021875106.db2.gz IPLRNKIFPOXBHO-JTQLQIEISA-N -1 3 338.860 4.206 20 0 EIADHM CC(C)Oc1ccc2ccccc2c1C[N-]C(=O)C(F)(F)C(F)F ZINC001267707881 1022034934 /nfs/dbraw/zinc/03/49/34/1022034934.db2.gz BCTJVMUVPUEANC-UHFFFAOYSA-N -1 3 343.320 4.144 20 0 EIADHM Cc1ccc(-c2csc(CN3[C@H](C)CC[C@H](C(=O)[O-])[C@@H]3C)n2)cc1 ZINC000580466525 1022054598 /nfs/dbraw/zinc/05/45/98/1022054598.db2.gz DIEPRWCUSIMWRU-YCPHGPKFSA-N -1 3 344.480 4.192 20 0 EIADHM Cc1ccc(NC2CCN(C(=O)c3cc([O-])ccc3Cl)CC2)cc1 ZINC000377905030 1022086707 /nfs/dbraw/zinc/08/67/07/1022086707.db2.gz QPVXDYFMNSIDIP-UHFFFAOYSA-N -1 3 344.842 4.071 20 0 EIADHM CC(C)c1scnc1C(=O)[N-]c1nnc(-c2ccsc2)s1 ZINC000377957154 1022152205 /nfs/dbraw/zinc/15/22/05/1022152205.db2.gz XBYYHLFPSCFVRA-UHFFFAOYSA-N -1 3 336.467 4.099 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)C12CCC(C(F)(F)F)(CC1)CC2 ZINC000377968788 1022173738 /nfs/dbraw/zinc/17/37/38/1022173738.db2.gz XUXPSUAAMFOBDE-UHFFFAOYSA-N -1 3 345.336 4.050 20 0 EIADHM COc1ccc2oc(C)c(C(=O)Nc3ccc(Cl)cc3[O-])c2c1 ZINC000754497128 1022183259 /nfs/dbraw/zinc/18/32/59/1022183259.db2.gz KIPGOYIPDQIKBJ-UHFFFAOYSA-N -1 3 331.755 4.361 20 0 EIADHM CC(C)C1(C)CCN(CCOc2ccc(C(=O)[O-])cc2Cl)CC1 ZINC000580561079 1022214572 /nfs/dbraw/zinc/21/45/72/1022214572.db2.gz KFUXKSNYHCTBSN-UHFFFAOYSA-N -1 3 339.863 4.175 20 0 EIADHM CC(C)[C@@H](Cc1ccc(F)cc1)NC(=O)c1cc([O-])ccc1Cl ZINC000431864051 1022761391 /nfs/dbraw/zinc/76/13/91/1022761391.db2.gz VBMBNMAXWQJGSL-QGZVFWFLSA-N -1 3 335.806 4.182 20 0 EIADHM CCc1cccc(C(=O)N2CC[C@H](c3cccc(Cl)c3)C2)c1[O-] ZINC000581002487 1022799666 /nfs/dbraw/zinc/79/96/66/1022799666.db2.gz DFQFLLCVRPZJFM-HNNXBMFYSA-N -1 3 329.827 4.238 20 0 EIADHM CCc1cccc2cc(CN[C@@H]3C[C@H](C(=O)[O-])c4ccccc43)oc21 ZINC000656566368 1023226414 /nfs/dbraw/zinc/22/64/14/1023226414.db2.gz IZYKMRJFDPXQPK-RBUKOAKNSA-N -1 3 335.403 4.398 20 0 EIADHM CC1(C)[C@H](CCC(=O)[O-])C[C@@H]1NCc1csc(Cl)c1Cl ZINC000656568016 1023229399 /nfs/dbraw/zinc/22/93/99/1023229399.db2.gz ODZZYIVKDMPGQP-ZJUUUORDSA-N -1 3 336.284 4.424 20 0 EIADHM Cc1cc(F)c(CN[C@H]2C[C@@H](CCC(=O)[O-])C2(C)C)c(Cl)c1 ZINC000656568034 1023229910 /nfs/dbraw/zinc/22/99/10/1023229910.db2.gz PFEXQYUFBRTANA-ABAIWWIYSA-N -1 3 327.827 4.157 20 0 EIADHM CC1(C)[C@H](CCC(=O)[O-])C[C@@H]1NCc1cc(Cl)sc1Cl ZINC000656567966 1023231888 /nfs/dbraw/zinc/23/18/88/1023231888.db2.gz KAFBNPSFOVWDET-ZJUUUORDSA-N -1 3 336.284 4.424 20 0 EIADHM CC1(C)[C@H](CCC(=O)[O-])C[C@@H]1NCc1ncc(-c2ccccc2)s1 ZINC000656567967 1023233159 /nfs/dbraw/zinc/23/31/59/1023233159.db2.gz KAZQNFHSRJCBIN-ZBFHGGJFSA-N -1 3 344.480 4.179 20 0 EIADHM O=C(c1ccccc1[O-])N1CC[C@H](Cc2ccc(C(F)F)cc2)C1 ZINC000364101110 1023294691 /nfs/dbraw/zinc/29/46/91/1023294691.db2.gz PMBDMRZGQMUDEN-CQSZACIVSA-N -1 3 331.362 4.035 20 0 EIADHM CC(C)C[C@H](N)c1noc(-c2cc(Oc3ccccc3)ccc2[O-])n1 ZINC000414619867 1023297775 /nfs/dbraw/zinc/29/77/75/1023297775.db2.gz KUGPRIFDRJHMBJ-INIZCTEOSA-N -1 3 339.395 4.280 20 0 EIADHM O=C([O-])c1cccc(CN2CCC(F)(c3cccc(Cl)c3)CC2)c1 ZINC000414642383 1023308315 /nfs/dbraw/zinc/30/83/15/1023308315.db2.gz VTQDSNVRTGYHGF-UHFFFAOYSA-N -1 3 347.817 4.499 20 0 EIADHM COC(=O)c1ccc(C(=O)Nc2ccccc2SC2CCCC2)[n-]1 ZINC000431949738 1023328682 /nfs/dbraw/zinc/32/86/82/1023328682.db2.gz JXESVKLRYBWZTA-UHFFFAOYSA-N -1 3 344.436 4.088 20 0 EIADHM Cc1cccc(C[C@@H](CNCc2c(F)cc(C)cc2Cl)C(=O)[O-])c1 ZINC000417571931 1023357048 /nfs/dbraw/zinc/35/70/48/1023357048.db2.gz UGFJRWRSDKDCOV-HNNXBMFYSA-N -1 3 349.833 4.129 20 0 EIADHM O=C([O-])CCN(Cc1cccc(F)c1F)C[C@@H]1CCCCC1(F)F ZINC000581553605 1023358298 /nfs/dbraw/zinc/35/82/98/1023358298.db2.gz XLZHYAQVAGGPJG-ZDUSSCGKSA-N -1 3 347.352 4.067 20 0 EIADHM CC(C)c1ccc([C@@H](CC(=O)[O-])NCc2cnn(C(C)(C)C)c2)cc1 ZINC000417573501 1023358435 /nfs/dbraw/zinc/35/84/35/1023358435.db2.gz QFRSFAYBJFPISE-GOSISDBHSA-N -1 3 343.471 4.067 20 0 EIADHM CC(C)=CCSC[C@@H](NCc1cc2ccccc2s1)C(=O)[O-] ZINC000417630722 1023381010 /nfs/dbraw/zinc/38/10/10/1023381010.db2.gz UZIUXFCEQFQQRP-OAHLLOKOSA-N -1 3 335.494 4.144 20 0 EIADHM CN(Cc1ccc(Cl)s1)C(=O)CCCc1ccc([O-])c(F)c1 ZINC000468563892 1023423279 /nfs/dbraw/zinc/42/32/79/1023423279.db2.gz HIYSUNKCQCNPCB-UHFFFAOYSA-N -1 3 341.835 4.228 20 0 EIADHM COc1cccc(-c2nc(CSc3ccc(Cl)cc3)no2)c1[O-] ZINC000390355543 1023475234 /nfs/dbraw/zinc/47/52/34/1023475234.db2.gz MZMHVYNDPQJXFX-UHFFFAOYSA-N -1 3 348.811 4.397 20 0 EIADHM O=C([O-])[C@H](c1cc(Cl)cc(Cl)c1)N1CCC[C@H](CCF)C1 ZINC000656763102 1023503608 /nfs/dbraw/zinc/50/36/08/1023503608.db2.gz LBRUJEXJEDEFEF-YGRLFVJLSA-N -1 3 334.218 4.191 20 0 EIADHM O=C([O-])[C@@H](c1cc(Cl)cc(Cl)c1)N1CCC[C@H](CCF)C1 ZINC000656763101 1023504087 /nfs/dbraw/zinc/50/40/87/1023504087.db2.gz LBRUJEXJEDEFEF-QMTHXVAHSA-N -1 3 334.218 4.191 20 0 EIADHM CC[C@H](C)Oc1ccc([N-]S(=O)(=O)c2ccc(F)cc2C)cc1 ZINC000511710397 1023835641 /nfs/dbraw/zinc/83/56/41/1023835641.db2.gz PBOPWIDQIKJLKC-ZDUSSCGKSA-N -1 3 337.416 4.112 20 0 EIADHM CC[C@@H](C)Oc1ccc([N-]S(=O)(=O)c2ccc(F)cc2C)cc1 ZINC000511710396 1023835824 /nfs/dbraw/zinc/83/58/24/1023835824.db2.gz PBOPWIDQIKJLKC-CYBMUJFWSA-N -1 3 337.416 4.112 20 0 EIADHM CCCc1ccc(S(=O)(=O)[N-]c2ccc(COC(C)C)cc2)cc1 ZINC000511699861 1023837470 /nfs/dbraw/zinc/83/74/70/1023837470.db2.gz VRCYYBAAZJCQCZ-UHFFFAOYSA-N -1 3 347.480 4.365 20 0 EIADHM O=C(Oc1cccc(OCC(F)(F)F)c1)c1cccc(Cl)c1[O-] ZINC001125977467 1023962641 /nfs/dbraw/zinc/96/26/41/1023962641.db2.gz OLGCGNMJHSRLOF-UHFFFAOYSA-N -1 3 346.688 4.206 20 0 EIADHM O=c1[n-]c(CN2CCC(C3CCC3)CC2)nc2c3ccccc3oc21 ZINC000661374984 1024075205 /nfs/dbraw/zinc/07/52/05/1024075205.db2.gz RIMKFTSJQVAPKX-UHFFFAOYSA-N -1 3 337.423 4.094 20 0 EIADHM O=C(Nc1cccc([O-])c1F)c1ccc(Cl)c(Br)c1 ZINC000535658904 1024487872 /nfs/dbraw/zinc/48/78/72/1024487872.db2.gz RCFUXANRHDTVKV-UHFFFAOYSA-N -1 3 344.567 4.200 20 0 EIADHM CCC(CC)c1nnc([N-]C(=O)c2csc(-c3ccoc3)n2)s1 ZINC000341765645 1024642414 /nfs/dbraw/zinc/64/24/14/1024642414.db2.gz VOIGSSYHAPBULJ-UHFFFAOYSA-N -1 3 348.453 4.411 20 0 EIADHM C[C@H](c1ccc(C(=O)[O-])o1)N(C)Cc1ccc(C(F)(F)F)cc1 ZINC000652374009 1024768193 /nfs/dbraw/zinc/76/81/93/1024768193.db2.gz GPKDBZVBODYGRC-SNVBAGLBSA-N -1 3 327.302 4.190 20 0 EIADHM CC[C@]1(C)CCCN(Cc2cc(Br)ccc2C(=O)[O-])C1 ZINC000652416503 1024823815 /nfs/dbraw/zinc/82/38/15/1024823815.db2.gz KXXNRNRXZCHUPL-MRXNPFEDSA-N -1 3 340.261 4.159 20 0 EIADHM O=C([O-])c1sccc1CN1CC[C@H](C(F)(F)F)C2(CCC2)C1 ZINC000652447144 1024837498 /nfs/dbraw/zinc/83/74/98/1024837498.db2.gz RNUSSGKMGQVPNT-NSHDSACASA-N -1 3 333.375 4.001 20 0 EIADHM O=C([O-])[C@H](c1ccc(F)cc1)N1CCC(c2cccc(F)c2F)CC1 ZINC000652449725 1024838019 /nfs/dbraw/zinc/83/80/19/1024838019.db2.gz LEZQGLGRXMZQIR-SFHVURJKSA-N -1 3 349.352 4.109 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1cccc([C@@H]2CCCOC2)c1 ZINC000535756982 1024927724 /nfs/dbraw/zinc/92/77/24/1024927724.db2.gz PXXXAGLJGBGXEI-CQSZACIVSA-N -1 3 331.799 4.192 20 0 EIADHM O=C([O-])[C@H]1CN(CCSc2cccc(Cl)c2)Cc2ccccc21 ZINC000662221675 1024974220 /nfs/dbraw/zinc/97/42/20/1024974220.db2.gz BQJXAHKRRVJQGE-KRWDZBQOSA-N -1 3 347.867 4.116 20 0 EIADHM O=C([O-])C[C@@H](NCc1ccc(SC(F)F)cc1)c1ccsc1 ZINC000277011270 1024994501 /nfs/dbraw/zinc/99/45/01/1024994501.db2.gz MTSCGBSQHVMTIK-CYBMUJFWSA-N -1 3 343.420 4.368 20 0 EIADHM [O-]c1cccnc1CNCc1cnn(C2CCCC2)c1-c1ccccc1 ZINC000643293317 1025162201 /nfs/dbraw/zinc/16/22/01/1025162201.db2.gz HNHKJENPNUITFB-UHFFFAOYSA-N -1 3 348.450 4.056 20 0 EIADHM O=S(=O)([N-]c1cc(Cl)ccc1F)c1cc(F)cc(Cl)c1 ZINC000535893037 1025219582 /nfs/dbraw/zinc/21/95/82/1025219582.db2.gz XAPPKLZDIWLBEW-UHFFFAOYSA-N -1 3 338.162 4.072 20 0 EIADHM COc1ccc([O-])c(C(=O)Nc2cccc(Cl)c2OC(C)C)c1 ZINC000533872907 1025503060 /nfs/dbraw/zinc/50/30/60/1025503060.db2.gz QNSGRGHNVFESTM-UHFFFAOYSA-N -1 3 335.787 4.094 20 0 EIADHM CSc1ccc([O-])c(C(=O)N2CC[C@@H](C(F)(F)F)C(C)(C)C2)c1 ZINC000613923731 1025547837 /nfs/dbraw/zinc/54/78/37/1025547837.db2.gz OPIUOCIXXDWAJN-CYBMUJFWSA-N -1 3 347.402 4.165 20 0 EIADHM Cc1nc([N-]c2cc3c(cccc3F)o2)nc(C)c1Br ZINC001216291881 1025715922 /nfs/dbraw/zinc/71/59/22/1025715922.db2.gz QFOOHGAPCWDEIP-UHFFFAOYSA-N -1 3 336.164 4.485 20 0 EIADHM CC(C)c1ccc(C(=O)N[C@@H](c2ccccc2)[C@@H](O)C(C)C)c([O-])c1 ZINC001167866308 1026344584 /nfs/dbraw/zinc/34/45/84/1026344584.db2.gz NWPXYNQNQGDXHS-PMACEKPBSA-N -1 3 341.451 4.004 20 0 EIADHM Cc1ccc(C(=O)Nc2cc(NC(=O)C(C)(C)C)ccc2C)c([O-])c1 ZINC000112020996 1026356794 /nfs/dbraw/zinc/35/67/94/1026356794.db2.gz VQUDGVBJFHFGDD-UHFFFAOYSA-N -1 3 340.423 4.246 20 0 EIADHM C[C@H](CNCc1nc(C(=O)[O-])cs1)Cc1ccc(C(C)(C)C)cc1 ZINC000277528003 1026380984 /nfs/dbraw/zinc/38/09/84/1026380984.db2.gz YZAHWCGAACRPST-ZDUSSCGKSA-N -1 3 346.496 4.107 20 0 EIADHM CC(C)COc1ccc(CN[C@@H](CC(=O)[O-])c2ccsc2)cc1 ZINC000426684768 1026473343 /nfs/dbraw/zinc/47/33/43/1026473343.db2.gz BOUYUUKKKJFPAR-KRWDZBQOSA-N -1 3 333.453 4.089 20 0 EIADHM C[C@H](CCC[C@H](C)C(=O)[O-])NCc1csc(-c2cccs2)n1 ZINC000426705515 1026488602 /nfs/dbraw/zinc/48/86/02/1026488602.db2.gz XEEIHCCKOGPWSS-NWDGAFQWSA-N -1 3 338.498 4.241 20 0 EIADHM CC(C)Oc1cccc(CN[C@@H](C(=O)[O-])c2cccc(Cl)c2)c1 ZINC000426749411 1026536589 /nfs/dbraw/zinc/53/65/89/1026536589.db2.gz FTCWLDXBDYSXCW-QGZVFWFLSA-N -1 3 333.815 4.043 20 0 EIADHM COc1ccccc1[C@@H](NCc1ccc(-c2ccccc2)cc1)C(=O)[O-] ZINC000426774739 1026553762 /nfs/dbraw/zinc/55/37/62/1026553762.db2.gz PVFDYWRLZWQRAN-OAQYLSRUSA-N -1 3 347.414 4.278 20 0 EIADHM O=C([O-])[C@@H](NCc1cc(Cl)cc(C(F)(F)F)c1)c1ccsc1 ZINC000426785509 1026558543 /nfs/dbraw/zinc/55/85/43/1026558543.db2.gz XUHAIQOIQRZCFS-LBPRGKRZSA-N -1 3 349.761 4.336 20 0 EIADHM CC(C)COc1cccc(CN[C@@H](CC(=O)[O-])c2ccc(F)cc2)c1 ZINC000426783929 1026558941 /nfs/dbraw/zinc/55/89/41/1026558941.db2.gz LHXDZGAHGWDNHZ-IBGZPJMESA-N -1 3 345.414 4.166 20 0 EIADHM O=C([O-])C[C@@H](NCc1coc2ccccc12)c1cccc(Cl)c1 ZINC000426817796 1026577545 /nfs/dbraw/zinc/57/75/45/1026577545.db2.gz PZAXQDJDXXEIGW-MRXNPFEDSA-N -1 3 329.783 4.392 20 0 EIADHM O=C([O-])C[C@H](NCc1ccc(F)c(Cl)c1)c1cccc(Cl)c1 ZINC000426830122 1026586457 /nfs/dbraw/zinc/58/64/57/1026586457.db2.gz VJTLUCCULKIATF-HNNXBMFYSA-N -1 3 342.197 4.438 20 0 EIADHM COc1ccc([C@H]2CCCN2Cc2cccc([O-])c2Cl)c(OC)c1 ZINC000507027536 1026595081 /nfs/dbraw/zinc/59/50/81/1026595081.db2.gz VTIHRUHJXADKIN-MRXNPFEDSA-N -1 3 347.842 4.400 20 0 EIADHM O=C([O-])[C@H](NCc1cccc(Oc2ccccc2)c1)c1ccsc1 ZINC000426835050 1026595230 /nfs/dbraw/zinc/59/52/30/1026595230.db2.gz PSUKFWYEMFKXHM-GOSISDBHSA-N -1 3 339.416 4.456 20 0 EIADHM COc1ccc2c(c1)CCC[C@@H]2N(C)Cc1c(F)ccc([O-])c1F ZINC000507254232 1026716980 /nfs/dbraw/zinc/71/69/80/1026716980.db2.gz UEMBTNSZLITFGE-KRWDZBQOSA-N -1 3 333.378 4.188 20 0 EIADHM CC(C)[C@@H]1C[C@H](NC(=O)c2cc(=O)c3ccccc3[n-]2)c2ccccc21 ZINC000344983572 1026735961 /nfs/dbraw/zinc/73/59/61/1026735961.db2.gz QRJFLTHGIVHZLT-HKUYNNGSSA-N -1 3 346.430 4.143 20 0 EIADHM O=C(c1cc([O-])ccc1Cl)N1CCC[C@H]1CCc1ccccc1 ZINC000582516251 1026737718 /nfs/dbraw/zinc/73/77/18/1026737718.db2.gz BUIMUZXRJMYSNW-HNNXBMFYSA-N -1 3 329.827 4.283 20 0 EIADHM CS[C@H]1CCCCN([C@H](C(=O)[O-])c2cc(Cl)cc(Cl)c2)C1 ZINC000519602284 1026757284 /nfs/dbraw/zinc/75/72/84/1026757284.db2.gz HYPLBUJDOUYJPC-KBPBESRZSA-N -1 3 348.295 4.337 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2cccc(-c3ncco3)c2C)c(C)c1 ZINC000427296541 1026807667 /nfs/dbraw/zinc/80/76/67/1026807667.db2.gz ULUQILUFPHJWMN-UHFFFAOYSA-N -1 3 342.420 4.068 20 0 EIADHM O=C(CCc1c[nH]c2ccccc12)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000440984092 1027162001 /nfs/dbraw/zinc/16/20/01/1027162001.db2.gz CJNAGRTUKDNZKT-UHFFFAOYSA-N -1 3 348.324 4.464 20 0 EIADHM O=C(CCc1cc(F)ccc1F)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000440979078 1027173418 /nfs/dbraw/zinc/17/34/18/1027173418.db2.gz AROVWMQEPASGGD-UHFFFAOYSA-N -1 3 345.267 4.261 20 0 EIADHM O=C(Nc1ccc([O-])c(C(F)(F)F)c1)c1nccc2ccccc21 ZINC000440992590 1027176521 /nfs/dbraw/zinc/17/65/21/1027176521.db2.gz QWMJIUZHXUWDIC-UHFFFAOYSA-N -1 3 332.281 4.212 20 0 EIADHM O=C(CSc1ccccc1)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000440997031 1027178343 /nfs/dbraw/zinc/17/83/43/1027178343.db2.gz DEVZWLAMDKXTOW-UHFFFAOYSA-N -1 3 327.327 4.142 20 0 EIADHM O=C(Nc1ccc([O-])c(C(F)(F)F)c1)C1(c2ccccc2)CCC1 ZINC000440998490 1027179094 /nfs/dbraw/zinc/17/90/94/1027179094.db2.gz MZFDSCLPCLAZAI-UHFFFAOYSA-N -1 3 335.325 4.471 20 0 EIADHM CSc1ccccc1S(=O)(=O)[N-]c1cc(Cl)ccc1F ZINC000188290955 1027280783 /nfs/dbraw/zinc/28/07/83/1027280783.db2.gz GIHZIPOPKCPVFA-UHFFFAOYSA-N -1 3 331.821 4.002 20 0 EIADHM O=C(CCC1CCCCC1)[N-]OCc1coc(-c2ccccc2)n1 ZINC000303291720 1027530801 /nfs/dbraw/zinc/53/08/01/1027530801.db2.gz LCEYUJIBXXDZKZ-UHFFFAOYSA-N -1 3 328.412 4.250 20 0 EIADHM CC(C)c1ccc(-c2nc([C@@H](C)OCC(F)(F)F)no2)c([O-])c1 ZINC000896606104 1027700510 /nfs/dbraw/zinc/70/05/10/1027700510.db2.gz GSSLYVKYLAPHNC-SECBINFHSA-N -1 3 330.306 4.206 20 0 EIADHM COc1ccccc1[C@H](C)SCc1noc(-c2ccccc2[O-])n1 ZINC000079008000 1027783013 /nfs/dbraw/zinc/78/30/13/1027783013.db2.gz UXGMIGLEDADEEG-LBPRGKRZSA-N -1 3 342.420 4.445 20 0 EIADHM Cc1c(NC(=O)CCCc2ccc([O-])c(F)c2)cnn1C1CCCC1 ZINC000444452687 1027815955 /nfs/dbraw/zinc/81/59/55/1027815955.db2.gz BRZJNJHHIIIIEI-UHFFFAOYSA-N -1 3 345.418 4.113 20 0 EIADHM CCc1cccc(C(=O)Nc2ccc3[nH]c(C(F)F)nc3c2)c1[O-] ZINC000536328197 1027974663 /nfs/dbraw/zinc/97/46/63/1027974663.db2.gz IIHLUGCIIQCTSF-UHFFFAOYSA-N -1 3 331.322 4.021 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)c1ccc(OC2CCCCC2)cc1 ZINC000523424827 1028082291 /nfs/dbraw/zinc/08/22/91/1028082291.db2.gz QNZFWUMOAWWZDY-UHFFFAOYSA-N -1 3 343.398 4.173 20 0 EIADHM CN(Cc1ccccc1C(F)(F)F)C(=O)c1cc([O-])ccc1Cl ZINC000431525064 1028232691 /nfs/dbraw/zinc/23/26/91/1028232691.db2.gz OFGRAVYTNSDTNE-UHFFFAOYSA-N -1 3 343.732 4.337 20 0 EIADHM O=C(N[C@@H]1CC[C@H](c2ccccc2F)C1)c1cc([O-])ccc1Cl ZINC000511235795 1028307612 /nfs/dbraw/zinc/30/76/12/1028307612.db2.gz PFDBAUNEKPDPMJ-NWDGAFQWSA-N -1 3 333.790 4.251 20 0 EIADHM Cc1cc(F)cc2c(=O)c(C(=O)Nc3cccc(C(C)C)c3)c[n-]c12 ZINC000155129870 1028356023 /nfs/dbraw/zinc/35/60/23/1028356023.db2.gz IMKUVWBLABBPNP-UHFFFAOYSA-N -1 3 338.382 4.351 20 0 EIADHM C[C@H](CC(=O)[N-]OCCC(F)(F)F)c1cccc(C(F)(F)F)c1 ZINC000162894255 1028528374 /nfs/dbraw/zinc/52/83/74/1028528374.db2.gz ICFIQJKAVYIBSU-SECBINFHSA-N -1 3 343.267 4.199 20 0 EIADHM C[C@@H](CC(=O)[N-]OCCC(F)(F)F)c1cccc(C(F)(F)F)c1 ZINC000162894148 1028528514 /nfs/dbraw/zinc/52/85/14/1028528514.db2.gz ICFIQJKAVYIBSU-VIFPVBQESA-N -1 3 343.267 4.199 20 0 EIADHM C[C@@H](c1ccc2c(c1)CCC2)N(C)Cc1nc(=O)c2sccc2[n-]1 ZINC000445496898 1028663582 /nfs/dbraw/zinc/66/35/82/1028663582.db2.gz YNBUQOCYPZCMDI-LBPRGKRZSA-N -1 3 339.464 4.079 20 0 EIADHM CC(C)(C)[C@@H](NC(=O)NCc1ccc([O-])c(F)c1)c1ccccc1 ZINC000524142016 1028703702 /nfs/dbraw/zinc/70/37/02/1028703702.db2.gz AJBLNHMRCXEVGC-KRWDZBQOSA-N -1 3 330.403 4.118 20 0 EIADHM CC(=O)c1cccc(NC(=O)[C@H](c2ccc(F)cc2)C(C)C)c1[O-] ZINC000583442526 1028736630 /nfs/dbraw/zinc/73/66/30/1028736630.db2.gz GXBKURBTINYTTQ-KRWDZBQOSA-N -1 3 329.371 4.112 20 0 EIADHM CCCC[C@H](CC)CC(=O)Nc1ccc(-c2nc(C)cc(=O)[n-]2)cc1 ZINC000524209023 1028772728 /nfs/dbraw/zinc/77/27/28/1028772728.db2.gz VYGPFSYGLBUELW-HNNXBMFYSA-N -1 3 341.455 4.290 20 0 EIADHM Cc1ccc([O-])c(-c2nc(-c3cc(Cl)c(F)c(Cl)c3)no2)n1 ZINC001213699829 1028819211 /nfs/dbraw/zinc/81/92/11/1028819211.db2.gz YRMMVDKNUXYWHG-UHFFFAOYSA-N -1 3 340.141 4.259 20 0 EIADHM CN(Cc1nc2c3ccccc3oc2c(=O)[n-]1)[C@H]1CCc2ccccc21 ZINC000347181919 1028904654 /nfs/dbraw/zinc/90/46/54/1028904654.db2.gz VXJQOIPUKZDGOX-INIZCTEOSA-N -1 3 345.402 4.201 20 0 EIADHM CCN(CCOc1ccccc1C)[C@H](C)c1cc(C(=O)[O-])c(C)o1 ZINC000583705180 1029063694 /nfs/dbraw/zinc/06/36/94/1029063694.db2.gz JNYOJMWMIPTBKX-CQSZACIVSA-N -1 3 331.412 4.057 20 0 EIADHM COc1ccc([C@@H]2CCCN2C(=O)c2cc(SC)ccc2[O-])cc1 ZINC000665582968 1029163805 /nfs/dbraw/zinc/16/38/05/1029163805.db2.gz WWQOMHNIDVZKCL-KRWDZBQOSA-N -1 3 343.448 4.100 20 0 EIADHM CC(C)c1ccc(-c2nc([C@H]3CCOC4(CCC4)C3)no2)c([O-])c1 ZINC000897111364 1029428477 /nfs/dbraw/zinc/42/84/77/1029428477.db2.gz WWVCBOHIJKSNNJ-AWEZNQCLSA-N -1 3 328.412 4.382 20 0 EIADHM Cc1ccc([O-])c(C(=O)Nc2ccc(OC(F)F)c(Cl)c2)c1 ZINC000216576863 1029520950 /nfs/dbraw/zinc/52/09/50/1029520950.db2.gz PSUPIALPIDHOMC-UHFFFAOYSA-N -1 3 327.714 4.208 20 0 EIADHM Cc1cnc2c(cccc2S(=O)(=O)[N-]c2cccc(C)c2Cl)c1 ZINC000525310951 1029568307 /nfs/dbraw/zinc/56/83/07/1029568307.db2.gz JMJMHNNGBIIGFA-UHFFFAOYSA-N -1 3 346.839 4.306 20 0 EIADHM Cc1nc([C@H](C)N[C@@H](C)[C@@H](C)C(=O)[O-])oc1-c1ccc(Cl)cc1 ZINC000565101718 1029581172 /nfs/dbraw/zinc/58/11/72/1029581172.db2.gz UTALKRPCBCQYHQ-SCVCMEIPSA-N -1 3 336.819 4.063 20 0 EIADHM Cc1nc([C@H](C)N[C@@H](C)[C@H](C)C(=O)[O-])oc1-c1ccc(Cl)cc1 ZINC000565101717 1029582355 /nfs/dbraw/zinc/58/23/55/1029582355.db2.gz UTALKRPCBCQYHQ-NHCYSSNCSA-N -1 3 336.819 4.063 20 0 EIADHM CCc1ccc([O-])c(C(=O)Nc2cccc(-c3nc(C)c(C)o3)c2)c1 ZINC000584164351 1029654211 /nfs/dbraw/zinc/65/42/11/1029654211.db2.gz QCOHHBFREDPNON-UHFFFAOYSA-N -1 3 336.391 4.479 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N(C)CCC3CCCCC3)nc2)n1 ZINC000301163103 1029678837 /nfs/dbraw/zinc/67/88/37/1029678837.db2.gz GCJWNPKDWCSNLO-UHFFFAOYSA-N -1 3 340.471 4.213 20 0 EIADHM C[C@@H](C1CC1)N(Cc1csc(-c2ccc(C(=O)[O-])cc2)n1)C1CC1 ZINC000584237329 1029687986 /nfs/dbraw/zinc/68/79/86/1029687986.db2.gz USZSFUVDTMKMHQ-LBPRGKRZSA-N -1 3 342.464 4.271 20 0 EIADHM CC(C)Oc1ccc([N-]S(=O)(=O)c2ccc(C(C)C)cc2)cc1 ZINC000033873610 1029735018 /nfs/dbraw/zinc/73/50/18/1029735018.db2.gz PJWWQKBMOIRDOS-UHFFFAOYSA-N -1 3 333.453 4.398 20 0 EIADHM CCc1nc2c(s1)[C@@H](N(C)C(=O)c1cccc(CC)c1[O-])CCC2 ZINC000092605630 1029945551 /nfs/dbraw/zinc/94/55/51/1029945551.db2.gz PSTPEHGURUSOOG-HNNXBMFYSA-N -1 3 344.480 4.123 20 0 EIADHM Cc1c(Cl)cccc1[N-]S(=O)(=O)c1ccc(OC(C)C)cc1 ZINC000096659460 1030019370 /nfs/dbraw/zinc/01/93/70/1030019370.db2.gz RWSIFEZEALOFON-UHFFFAOYSA-N -1 3 339.844 4.236 20 0 EIADHM C[C@@H](Cc1cncc2ccccc21)C(=O)Nc1cc(Cl)ccc1[O-] ZINC000487530022 1030089031 /nfs/dbraw/zinc/08/90/31/1030089031.db2.gz BMCIZNQIJQYWJW-LBPRGKRZSA-N -1 3 340.810 4.411 20 0 EIADHM C[C@@H](c1cc(Cl)ccc1Cl)N1CCC(c2n[n-]c(=O)o2)CC1 ZINC000450917169 1030107763 /nfs/dbraw/zinc/10/77/63/1030107763.db2.gz CLLJTKLTVKEXEG-VIFPVBQESA-N -1 3 342.226 4.023 20 0 EIADHM CC(C)(C)c1nc(CN[C@@H](CCC(=O)[O-])Cc2ccccc2)cs1 ZINC000262690133 1030125155 /nfs/dbraw/zinc/12/51/55/1030125155.db2.gz FVHFOLOCIFEINL-HNNXBMFYSA-N -1 3 346.496 4.006 20 0 EIADHM COc1cccc([C@@H](C)CCCC(=O)NCc2ccc([O-])c(F)c2)c1 ZINC000447553273 1030134143 /nfs/dbraw/zinc/13/41/43/1030134143.db2.gz QKFCABXGADCJDS-AWEZNQCLSA-N -1 3 345.414 4.130 20 0 EIADHM C[C@H]1CC(C(=O)[O-])C[C@H](C)N1CCc1cc(Cl)ccc1Cl ZINC000530172822 1030193388 /nfs/dbraw/zinc/19/33/88/1030193388.db2.gz AVWZUTHZDIJDCQ-QWRGUYRKSA-N -1 3 330.255 4.110 20 0 EIADHM C[C@@H]1CC(C(=O)[O-])C[C@@H](C)N1Cc1cc(-c2ccccc2Cl)on1 ZINC000530173083 1030194486 /nfs/dbraw/zinc/19/44/86/1030194486.db2.gz CDJNMVBGMWHBGR-VXGBXAGGSA-N -1 3 348.830 4.069 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)NCc1ccc2ccccc2c1 ZINC000468390729 1030214979 /nfs/dbraw/zinc/21/49/79/1030214979.db2.gz ZUDZTEAVMIGUQN-UHFFFAOYSA-N -1 3 337.394 4.324 20 0 EIADHM [O-]c1cccnc1CNC1(c2cc(C(F)(F)F)ccc2Cl)CC1 ZINC000685429263 1030314139 /nfs/dbraw/zinc/31/41/39/1030314139.db2.gz VUZTXOQZPJLHNQ-UHFFFAOYSA-N -1 3 342.748 4.238 20 0 EIADHM CC(C)[C@H]1CN(C(=O)NCc2ccc([O-])c(F)c2)c2ccccc21 ZINC000447766259 1030323618 /nfs/dbraw/zinc/32/36/18/1030323618.db2.gz GJWBIRCPAKTWIJ-OAHLLOKOSA-N -1 3 328.387 4.001 20 0 EIADHM Cc1ccc(-c2cc(C(=O)[N-]c3ccncc3C(=O)C(C)C)on2)cc1 ZINC000187457023 1030361705 /nfs/dbraw/zinc/36/17/05/1030361705.db2.gz JTKZDXYVHAIGOQ-UHFFFAOYSA-N -1 3 349.390 4.136 20 0 EIADHM CCc1cccc(C(=O)N2CC[C@H](c3ccc(Cl)cc3)C2)c1[O-] ZINC000530715784 1030668331 /nfs/dbraw/zinc/66/83/31/1030668331.db2.gz ASTBICMTCZHXSA-HNNXBMFYSA-N -1 3 329.827 4.238 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1ccc(N2CCCCC2)cc1 ZINC000530842434 1030765392 /nfs/dbraw/zinc/76/53/92/1030765392.db2.gz XPAQWOOJOKOOLZ-UHFFFAOYSA-N -1 3 330.815 4.288 20 0 EIADHM CC(C)(CC(F)(F)F)C(=O)Nc1ccc(Br)cc1[O-] ZINC000666329899 1030845971 /nfs/dbraw/zinc/84/59/71/1030845971.db2.gz ZEAVTPHBYFBTMU-UHFFFAOYSA-N -1 3 340.139 4.072 20 0 EIADHM CSc1ccc([O-])c(C(=O)N2CCCCC[C@H]2c2ccncc2)c1 ZINC000666417412 1030892857 /nfs/dbraw/zinc/89/28/57/1030892857.db2.gz GHYTWHVPMKNQRH-KRWDZBQOSA-N -1 3 342.464 4.267 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)NCC[C@@H]1CCc2ccccc21 ZINC000452320703 1030944029 /nfs/dbraw/zinc/94/40/29/1030944029.db2.gz WPGBPYQUXYDOGI-KRWDZBQOSA-N -1 3 341.426 4.090 20 0 EIADHM Cc1ccc(F)c(CN2CCC(c3ccccc3C(=O)[O-])CC2)c1 ZINC000666585937 1031049550 /nfs/dbraw/zinc/04/95/50/1031049550.db2.gz KJQAQPZOEQKQFI-UHFFFAOYSA-N -1 3 327.399 4.212 20 0 EIADHM Cc1nnc([N-]C(=O)c2sc(C3CC3)nc2-c2ccccc2)s1 ZINC000532447548 1031075750 /nfs/dbraw/zinc/07/57/50/1031075750.db2.gz IIYLTNOVZLGPIF-UHFFFAOYSA-N -1 3 342.449 4.100 20 0 EIADHM CC(C)CN(Cc1ccc(C(=O)[O-])cc1Br)C(C)C ZINC000226725449 1031104738 /nfs/dbraw/zinc/10/47/38/1031104738.db2.gz HEKNKODLFKKNMT-UHFFFAOYSA-N -1 3 328.250 4.014 20 0 EIADHM Cc1cccc([N-]S(=O)(=O)c2ccc(OC3CCCC3)cc2)c1C ZINC000096659247 1031194254 /nfs/dbraw/zinc/19/42/54/1031194254.db2.gz DSIYVHYLDQCVAW-UHFFFAOYSA-N -1 3 345.464 4.426 20 0 EIADHM CSc1nc(=O)[n-]c(C)c1C(=O)Nc1ccc(CCC(C)C)cc1 ZINC000531785717 1031600858 /nfs/dbraw/zinc/60/08/58/1031600858.db2.gz YTEOPAGRBOWKBV-UHFFFAOYSA-N -1 3 345.468 4.053 20 0 EIADHM C[C@H](c1cccc(Br)c1)[S@](=O)c1ccc([O-])cc1 ZINC000129809048 1031816810 /nfs/dbraw/zinc/81/68/10/1031816810.db2.gz JADDSIKKSNIGPW-MLCYQJTMSA-N -1 3 325.227 4.024 20 0 EIADHM CSc1ccc([O-])c(C(=O)N2CCC[C@@H]2Cc2cccc(F)c2)c1 ZINC000666693718 1031865742 /nfs/dbraw/zinc/86/57/42/1031865742.db2.gz YBEFLSDYJTZLDC-OAHLLOKOSA-N -1 3 345.439 4.101 20 0 EIADHM CC(C)Cn1cc(C(=O)Nc2cc(Cl)ccc2[O-])c(C(F)F)n1 ZINC000449818195 1032040464 /nfs/dbraw/zinc/04/04/64/1032040464.db2.gz DGLZNGOIMABWJG-UHFFFAOYSA-N -1 3 343.761 4.088 20 0 EIADHM C[C@@H](NCc1cccc([O-])c1Cl)c1ccc(NC(=O)C2CC2)cc1 ZINC000645146035 1033829813 /nfs/dbraw/zinc/82/98/13/1033829813.db2.gz LQSQOCWAXIQTRZ-GFCCVEGCSA-N -1 3 344.842 4.245 20 0 EIADHM COc1cccc(C(=O)Nc2nc(-c3ccccc3)c(C)s2)c1[O-] ZINC000614227361 1033856113 /nfs/dbraw/zinc/85/61/13/1033856113.db2.gz VBIDWTWNGAOJJI-UHFFFAOYSA-N -1 3 340.404 4.085 20 0 EIADHM CCCOc1cccc(F)c1Nc1cc(=O)n(-c2ccccc2)[n-]1 ZINC001211786031 1033907938 /nfs/dbraw/zinc/90/79/38/1033907938.db2.gz QEQMFEOBSCOQIX-UHFFFAOYSA-N -1 3 327.359 4.249 20 0 EIADHM Cc1cccc(CN(C)Cc2nc3c4ccccc4oc3c(=O)[n-]2)c1C ZINC000428744951 1034287359 /nfs/dbraw/zinc/28/73/59/1034287359.db2.gz OLRORBPDWVSNLW-UHFFFAOYSA-N -1 3 347.418 4.330 20 0 EIADHM O=c1cc(CSCc2csc(-c3ccco3)n2)nc(C2CC2)[n-]1 ZINC000419372440 1034532883 /nfs/dbraw/zinc/53/28/83/1034532883.db2.gz KWGUINFMRWOLAQ-UHFFFAOYSA-N -1 3 345.449 4.210 20 0 EIADHM Cc1ccc2oc([N-][C@H](c3nccn3C)c3ccc(F)cc3)nc2c1 ZINC000513639608 1035072586 /nfs/dbraw/zinc/07/25/86/1035072586.db2.gz DNJUOCLJXGWMMS-KRWDZBQOSA-N -1 3 336.370 4.210 20 0 EIADHM O=C(Nc1ccccc1-c1cccs1)c1cc(F)cc2n[n-]nc21 ZINC000501562165 1035467635 /nfs/dbraw/zinc/46/76/35/1035467635.db2.gz QNJVJXBOTRRLLS-UHFFFAOYSA-N -1 3 338.367 4.078 20 0 EIADHM O=C(Nc1ccc(Cl)cc1[O-])c1cnc2c(F)ccc(F)c2c1 ZINC000490651257 1035596312 /nfs/dbraw/zinc/59/63/12/1035596312.db2.gz SBYRLHXLCYNJQA-UHFFFAOYSA-N -1 3 334.709 4.124 20 0 EIADHM Cc1cc2cc[nH]c2cc1[N-]S(=O)(=O)c1c(C)cc(F)cc1C ZINC000485395132 1035863895 /nfs/dbraw/zinc/86/38/95/1035863895.db2.gz LNXGESCWECJFQB-UHFFFAOYSA-N -1 3 332.400 4.033 20 0 EIADHM [O-]c1c(Cl)cc(CN2C[C@@H]3CCCC[C@H]3C2)cc1Br ZINC001231745631 1036053129 /nfs/dbraw/zinc/05/31/29/1036053129.db2.gz GLTRMMMICDVBJR-RYUDHWBXSA-N -1 3 344.680 4.430 20 0 EIADHM CCCCOc1ccc(C(=O)N2CC=C(c3ccccc3)C2)c([O-])c1 ZINC000436991546 1036179005 /nfs/dbraw/zinc/17/90/05/1036179005.db2.gz YTZIRZBOHGGJFQ-UHFFFAOYSA-N -1 3 337.419 4.111 20 0 EIADHM O=C([O-])[C@@H](c1ccccc1F)N1CC[C@@H](C(F)(F)F)C2(CCC2)C1 ZINC000571811391 1036260699 /nfs/dbraw/zinc/26/06/99/1036260699.db2.gz UUHMQWPKSQKIOZ-ZIAGYGMSSA-N -1 3 345.336 4.006 20 0 EIADHM Cc1ccc(C(=O)CCCC(=O)Nc2ccc(Cl)cc2[O-])cc1 ZINC000502524335 1036290533 /nfs/dbraw/zinc/29/05/33/1036290533.db2.gz ZWYQUSSGCQASEN-UHFFFAOYSA-N -1 3 331.799 4.346 20 0 EIADHM O=C(N[C@H]1C[C@H](c2cccc(F)c2)C1)c1cc([O-])c2ccccc2c1 ZINC000572296872 1036474257 /nfs/dbraw/zinc/47/42/57/1036474257.db2.gz WYIDNWICDISITH-RZDIXWSQSA-N -1 3 335.378 4.361 20 0 EIADHM O=C([O-])c1ccc(CN2CCC[C@@H]2Cc2ccccc2Cl)c(F)c1 ZINC000572413772 1036492871 /nfs/dbraw/zinc/49/28/71/1036492871.db2.gz SKLGGFNNMHRXHI-MRXNPFEDSA-N -1 3 347.817 4.384 20 0 EIADHM Fc1ccc(-c2csc([N-]c3ncnc4ccncc43)n2)cc1F ZINC000502743500 1036607257 /nfs/dbraw/zinc/60/72/57/1036607257.db2.gz FZXZAFSGAHLYII-UHFFFAOYSA-N -1 3 341.346 4.170 20 0 EIADHM c1sc([N-]c2ncnc3ncccc23)nc1-c1ccc2c(c1)CCC2 ZINC000502741789 1036607783 /nfs/dbraw/zinc/60/77/83/1036607783.db2.gz QHZGWNMIFKNFLP-UHFFFAOYSA-N -1 3 345.431 4.381 20 0 EIADHM CCOc1cc(CNc2ccc3c(c2)CCOC3)cc(Cl)c1[O-] ZINC000668609201 1036649358 /nfs/dbraw/zinc/64/93/58/1036649358.db2.gz PUQFXCODPVJOPO-UHFFFAOYSA-N -1 3 333.815 4.129 20 0 EIADHM [O-]c1ccc(Br)cc1/C=N/CCCOC1CCCCC1 ZINC000061242202 1036962890 /nfs/dbraw/zinc/96/28/90/1036962890.db2.gz JGHAEEOSJXOJAJ-LDADJPATSA-N -1 3 340.261 4.313 20 0 EIADHM O=C(Cc1c[nH]c2cc(Cl)ccc12)Nc1cc(Cl)ccc1[O-] ZINC000590104770 1036978351 /nfs/dbraw/zinc/97/83/51/1036978351.db2.gz ZMEFCJCLJHIGLT-UHFFFAOYSA-N -1 3 335.190 4.362 20 0 EIADHM O=C([N-]c1ccccc1SC(F)(F)F)c1cc(C2CC2)on1 ZINC000171007449 1037018896 /nfs/dbraw/zinc/01/88/96/1037018896.db2.gz RTKWMEAMVMLQJN-UHFFFAOYSA-N -1 3 328.315 4.416 20 0 EIADHM C[C@H](CC1CCCC1)C(=O)Nc1ccc(Br)cc1[O-] ZINC000603858585 1037053922 /nfs/dbraw/zinc/05/39/22/1037053922.db2.gz LYUJEHJFYCCXIC-SNVBAGLBSA-N -1 3 326.234 4.310 20 0 EIADHM COC(=O)c1oc(C(=O)[N-]c2ccccc2SC(C)C)cc1C ZINC000599680306 1037130982 /nfs/dbraw/zinc/13/09/82/1037130982.db2.gz KGQCYDWEMDFMJZ-UHFFFAOYSA-N -1 3 333.409 4.127 20 0 EIADHM CC1(C)CCC([S@](=O)Cc2cc(=O)[n-]c(-c3ccccc3)n2)CC1 ZINC000591247764 1037339940 /nfs/dbraw/zinc/33/99/40/1037339940.db2.gz PVFSQFHOOJTTAC-XMMPIXPASA-N -1 3 344.480 4.067 20 0 EIADHM O=C([N-][C@H](c1nccs1)c1ccccc1)C(F)(F)c1ccccc1 ZINC000171495598 1037437682 /nfs/dbraw/zinc/43/76/82/1037437682.db2.gz QOEDDCVCMTULKB-HNNXBMFYSA-N -1 3 344.386 4.141 20 0 EIADHM CCc1csc([C@@H](C)NC(=O)c2cc3sccc3c([O-])c2)n1 ZINC000910735450 1037479893 /nfs/dbraw/zinc/47/98/93/1037479893.db2.gz SHNRZSGEXJTSEP-SECBINFHSA-N -1 3 332.450 4.117 20 0 EIADHM O=c1[n-]c(CN2CCCC[C@@H]2c2ccco2)nc2c3ccccc3oc21 ZINC000604760278 1037530543 /nfs/dbraw/zinc/53/05/43/1037530543.db2.gz ACQQYWXIMJEOHF-CQSZACIVSA-N -1 3 349.390 4.402 20 0 EIADHM CCc1ccc([O-])c(C(=O)Nc2ccc(-c3nc(C)c(C)o3)cc2)c1 ZINC000604901247 1037568196 /nfs/dbraw/zinc/56/81/96/1037568196.db2.gz RVMNIVRUSNEYKS-UHFFFAOYSA-N -1 3 336.391 4.479 20 0 EIADHM CCc1ccc([O-])c(C(=O)N2C[C@H](c3ccc(F)cc3)C[C@H]2C)c1 ZINC000605896434 1037871136 /nfs/dbraw/zinc/87/11/36/1037871136.db2.gz DCHCONOZPLIJSU-CZUORRHYSA-N -1 3 327.399 4.112 20 0 EIADHM Cc1cccc(C2=CCN(Cc3ccc(F)cc3C(=O)[O-])CC2)c1 ZINC000574458751 1038251640 /nfs/dbraw/zinc/25/16/40/1038251640.db2.gz TXODQIGEKAEFKF-UHFFFAOYSA-N -1 3 325.383 4.122 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2ccc(COC3CCCC3)cc2)cc1 ZINC000606827977 1038267985 /nfs/dbraw/zinc/26/79/85/1038267985.db2.gz GAYSWIDFXXGITG-UHFFFAOYSA-N -1 3 345.464 4.255 20 0 EIADHM Cc1nccn1-c1ccc(C/N=C/c2cc(Cl)ccc2[O-])cc1F ZINC000063427645 1038327981 /nfs/dbraw/zinc/32/79/81/1038327981.db2.gz UWQDWUKKZSURNT-SRZZPIQSSA-N -1 3 343.789 4.298 20 0 EIADHM CC[C@H](Cc1ccc(C)cc1)N(CC)C(=O)c1ccc(C)cc1[O-] ZINC000607878707 1038355864 /nfs/dbraw/zinc/35/58/64/1038355864.db2.gz YWGFWYDVZNCOFW-GOSISDBHSA-N -1 3 325.452 4.492 20 0 EIADHM CSCc1ccc([N-]S(=O)(=O)c2ccc(C(C)C)cc2)cc1 ZINC000608955802 1038990433 /nfs/dbraw/zinc/99/04/33/1038990433.db2.gz OFNASMYKVZUZQS-UHFFFAOYSA-N -1 3 335.494 4.474 20 0 EIADHM Cc1cc(C)c(S(=O)(=O)[N-]c2ccc(-c3cnco3)cc2)c(C)c1 ZINC000119775829 1039002962 /nfs/dbraw/zinc/00/29/62/1039002962.db2.gz CSAMBZPFNBQAJQ-UHFFFAOYSA-N -1 3 342.420 4.068 20 0 EIADHM CCc1noc(C)c1[N-]C(=O)c1ccc(COc2ccc(F)cc2)o1 ZINC000120845342 1039231875 /nfs/dbraw/zinc/23/18/75/1039231875.db2.gz PMLZXGUMIMFQRY-UHFFFAOYSA-N -1 3 344.342 4.109 20 0 EIADHM Cc1oc(-c2ccccc2)nc1C(=O)Nc1c([O-])cccc1Cl ZINC000552432729 1039511477 /nfs/dbraw/zinc/51/14/77/1039511477.db2.gz YQYKNOKTUDNTKA-UHFFFAOYSA-N -1 3 328.755 4.261 20 0 EIADHM CC(C)COc1ccc(CC(=O)Nc2c([O-])cccc2Cl)cc1 ZINC000552435367 1039512123 /nfs/dbraw/zinc/51/21/23/1039512123.db2.gz CRRAZFMYFSOCIV-UHFFFAOYSA-N -1 3 333.815 4.262 20 0 EIADHM CCCCCN(C(=O)c1cc(NC(C)=O)ccc1[O-])[C@@H](C)CCC ZINC000121995005 1039552184 /nfs/dbraw/zinc/55/21/84/1039552184.db2.gz PKGYYNZXXZFLRH-AWEZNQCLSA-N -1 3 334.460 4.172 20 0 EIADHM C/C=C/c1ccc(OCC(=O)Nc2ccc(Cl)cc2[O-])c(OC)c1 ZINC000534709893 1039720794 /nfs/dbraw/zinc/72/07/94/1039720794.db2.gz VLPQJYMBBMNKMT-ONEGZZNKSA-N -1 3 347.798 4.105 20 0 EIADHM CC1(C)C[C@H](c2ccccc2)N(C(=O)Cc2ccc([O-])c(F)c2)C1 ZINC000425123450 1039780451 /nfs/dbraw/zinc/78/04/51/1039780451.db2.gz SHPRYJKGOCRTLX-QGZVFWFLSA-N -1 3 327.399 4.074 20 0 EIADHM CC(C)(C)c1ccc(OCC(=O)Nc2c([O-])cccc2Cl)cc1 ZINC000552781587 1039817652 /nfs/dbraw/zinc/81/76/52/1039817652.db2.gz MWCUDFYDFJRWJJ-UHFFFAOYSA-N -1 3 333.815 4.361 20 0 EIADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)[C@H](CC)CC(F)F)c2)n1 ZINC000457469863 1040037109 /nfs/dbraw/zinc/03/71/09/1040037109.db2.gz VRTYVUKDMZYRQW-LLVKDONJSA-N -1 3 349.381 4.032 20 0 EIADHM CC1C[C@H]2CC[C@@H](C1)N2Cc1csc(-c2ccc(C(=O)[O-])cc2)n1 ZINC000514617677 1040059096 /nfs/dbraw/zinc/05/90/96/1040059096.db2.gz WVXQDRJGRISLRB-MYFMFCSTSA-N -1 3 342.464 4.271 20 0 EIADHM [O-]c1cccc(CN[C@@H](c2ccccc2)C2CC2)c1Br ZINC000314958359 1040198091 /nfs/dbraw/zinc/19/80/91/1040198091.db2.gz DIQQCGCIPDCIIE-KRWDZBQOSA-N -1 3 332.241 4.396 20 0 EIADHM CCCc1cc(=O)[n-]c(C(=Cc2ccc(OC)c(OCC)c2)CC)n1 ZINC000435338814 1040294420 /nfs/dbraw/zinc/29/44/20/1040294420.db2.gz JYLASTWFIHJNDY-RVDMUPIBSA-N -1 3 342.439 4.080 20 0 EIADHM O=C(O[C@@H](c1ncccn1)C1CCCC1)c1cc2ccsc2[n-]1 ZINC000761395576 1040481762 /nfs/dbraw/zinc/48/17/62/1040481762.db2.gz PJCJFITUWGYHRI-CQSZACIVSA-N -1 3 327.409 4.108 20 0 EIADHM COc1ccccc1C[C@H](NC(=O)c1cc([O-])ccc1Cl)C(C)C ZINC000551701097 1040514439 /nfs/dbraw/zinc/51/44/39/1040514439.db2.gz IFUAUQSUEJFETM-KRWDZBQOSA-N -1 3 347.842 4.051 20 0 EIADHM O=C(CO[C@@H]1CCCc2ccccc21)Nc1cc(Cl)ccc1[O-] ZINC000435760538 1040602292 /nfs/dbraw/zinc/60/22/92/1040602292.db2.gz KTOIYIULUFEWOP-QGZVFWFLSA-N -1 3 331.799 4.078 20 0 EIADHM [O-]c1cc(F)cc(CN(CCC(F)(F)F)Cc2ccccc2)c1 ZINC000483402790 1040837463 /nfs/dbraw/zinc/83/74/63/1040837463.db2.gz HDTMXJWXJROALL-UHFFFAOYSA-N -1 3 327.321 4.486 20 0 EIADHM O=C(CCc1cncc2ccccc21)Nc1ccc(Cl)cc1[O-] ZINC000462774978 1040911448 /nfs/dbraw/zinc/91/14/48/1040911448.db2.gz HIKMSULNNDQUAS-UHFFFAOYSA-N -1 3 326.783 4.165 20 0 EIADHM CC(C)(C)c1ccccc1S(=O)(=O)[N-]c1cccc(F)c1F ZINC000460821336 1040959437 /nfs/dbraw/zinc/95/94/37/1040959437.db2.gz AFNOMZIDLVOVTG-UHFFFAOYSA-N -1 3 325.380 4.063 20 0 EIADHM CCc1cc(=O)[n-]c(CN[C@@H](CCc2ccccc2)c2ccccc2)n1 ZINC000538181082 1041135548 /nfs/dbraw/zinc/13/55/48/1041135548.db2.gz ZULHWGOEQDCGGK-FQEVSTJZSA-N -1 3 347.462 4.208 20 0 EIADHM CCc1cc(=O)[n-]c(CN[C@H](c2ccc(Cl)cc2)[C@@H](C)CC)n1 ZINC000538214630 1041170796 /nfs/dbraw/zinc/17/07/96/1041170796.db2.gz UGMCSMNLINVPEZ-SGTLLEGYSA-N -1 3 333.863 4.275 20 0 EIADHM CC[C@@H](C)[C@H](C)N(Cc1coc(-c2ccc(C(=O)[O-])cc2)n1)C1CC1 ZINC000567359167 1041245333 /nfs/dbraw/zinc/24/53/33/1041245333.db2.gz MEOSWMYEMVIALV-KGLIPLIRSA-N -1 3 342.439 4.439 20 0 EIADHM CC[C@@H](C)[C@@H](C)N(Cc1coc(-c2ccc(C(=O)[O-])cc2)n1)C1CC1 ZINC000567359169 1041245469 /nfs/dbraw/zinc/24/54/69/1041245469.db2.gz MEOSWMYEMVIALV-ZIAGYGMSSA-N -1 3 342.439 4.439 20 0 EIADHM CC(C)c1ccc([C@@H](CC(=O)[O-])NCc2cc3cccnc3o2)cc1 ZINC000904001945 1041246244 /nfs/dbraw/zinc/24/62/44/1041246244.db2.gz KMDKWPZMGAGCML-GOSISDBHSA-N -1 3 338.407 4.257 20 0 EIADHM Cc1cccc(S(=O)(=O)[N-]c2cc(F)ccc2Cl)c1Cl ZINC000538298529 1041250952 /nfs/dbraw/zinc/25/09/52/1041250952.db2.gz OEJKKBRZDJQDOR-UHFFFAOYSA-N -1 3 334.199 4.242 20 0 EIADHM O=C(Nc1ccc([O-])c(C(F)(F)F)c1)[C@@H]1C[C@@H]1c1ccc(F)cc1 ZINC000540202963 1041260319 /nfs/dbraw/zinc/26/03/19/1041260319.db2.gz SOTHJEYPHRNURK-CHWSQXEVSA-N -1 3 339.288 4.292 20 0 EIADHM O=C(c1ccccc1[O-])N1CCC(F)(c2ccc(Cl)cc2)CC1 ZINC000436496949 1041281405 /nfs/dbraw/zinc/28/14/05/1041281405.db2.gz RHHNBFPIVLEYOU-UHFFFAOYSA-N -1 3 333.790 4.147 20 0 EIADHM Cc1ccc(C(=O)Nc2cccc(OCC(F)(F)F)c2C)c([O-])c1 ZINC000436512973 1041296958 /nfs/dbraw/zinc/29/69/58/1041296958.db2.gz LPSOYSLUQYBWEP-UHFFFAOYSA-N -1 3 339.313 4.202 20 0 EIADHM CC(=O)c1ccc(C(=O)N2CCC[C@H]2c2ccc(Cl)cc2)cc1[O-] ZINC000436526720 1041310866 /nfs/dbraw/zinc/31/08/66/1041310866.db2.gz BJRUMQQLPHMIKN-KRWDZBQOSA-N -1 3 343.810 4.226 20 0 EIADHM Cc1ccc(C(=O)Nc2ccccc2-c2nc3ccccc3[nH]2)c([O-])c1 ZINC000436553591 1041329043 /nfs/dbraw/zinc/32/90/43/1041329043.db2.gz DEVIZBNPHRYLAW-UHFFFAOYSA-N -1 3 343.386 4.496 20 0 EIADHM CCOc1ccc(CN(C(=O)c2ccc(C)cc2[O-])C(C)C)cc1 ZINC000436538688 1041330064 /nfs/dbraw/zinc/33/00/64/1041330064.db2.gz IVQNICUZHJBBFU-UHFFFAOYSA-N -1 3 327.424 4.150 20 0 EIADHM CCCN(C(=O)c1ccc(OC)cc1[O-])[C@@H](C)c1ccccc1OC ZINC000436541133 1041336072 /nfs/dbraw/zinc/33/60/72/1041336072.db2.gz SVSWTUZZWYJWPS-AWEZNQCLSA-N -1 3 343.423 4.023 20 0 EIADHM CCOc1cc(-c2nc3c(cccc3C)[nH]2)cc(Br)c1[O-] ZINC000436558938 1041340902 /nfs/dbraw/zinc/34/09/02/1041340902.db2.gz RTNWWWCLWVEXHM-UHFFFAOYSA-N -1 3 347.212 4.405 20 0 EIADHM CCSc1ccc([C@H](C)NC(=O)c2ccc(OC)cc2[O-])cc1 ZINC000436563576 1041344432 /nfs/dbraw/zinc/34/44/32/1041344432.db2.gz NKQPPEZLVINMLW-LBPRGKRZSA-N -1 3 331.437 4.004 20 0 EIADHM CC(C)c1ccc(C(=O)N2C[C@@H](c3ccccc3)OC[C@@H]2C)c([O-])c1 ZINC000436569303 1041348641 /nfs/dbraw/zinc/34/86/41/1041348641.db2.gz CIVOQBGDOYEUQX-YWZLYKJASA-N -1 3 339.435 4.118 20 0 EIADHM Cc1ccc(C(=O)N(C)[C@@H](Cc2ccc(F)cc2)C(C)C)c([O-])c1 ZINC000436572013 1041349622 /nfs/dbraw/zinc/34/96/22/1041349622.db2.gz DUQFWFZQIFYPKI-SFHVURJKSA-N -1 3 329.415 4.179 20 0 EIADHM COc1ccccc1C[C@@H](C)N(C)C(=O)c1ccc(C(C)C)cc1[O-] ZINC000436569660 1041349808 /nfs/dbraw/zinc/34/98/08/1041349808.db2.gz HJTPBZHRHTUEKL-OAHLLOKOSA-N -1 3 341.451 4.227 20 0 EIADHM CCOc1cc(-c2nc3ccccc3n2C)cc(Br)c1[O-] ZINC000436655825 1041398070 /nfs/dbraw/zinc/39/80/70/1041398070.db2.gz KAJUZHCWYBYTIY-UHFFFAOYSA-N -1 3 347.212 4.107 20 0 EIADHM CC(C)c1ccc(C(=O)N[C@@H]2CCO[C@H](c3ccccc3)C2)c([O-])c1 ZINC000436660011 1041413763 /nfs/dbraw/zinc/41/37/63/1041413763.db2.gz RCLQVDAMTYALEO-XLIONFOSSA-N -1 3 339.435 4.166 20 0 EIADHM COc1cc(-c2nc(-c3ccc(C(C)C)cc3)no2)cc(OC)c1[O-] ZINC000436691502 1041425098 /nfs/dbraw/zinc/42/50/98/1041425098.db2.gz SUSSDICFEISPRD-UHFFFAOYSA-N -1 3 340.379 4.250 20 0 EIADHM CCc1ccc(-c2nc(-c3cccc(Br)c3)no2)c([O-])c1 ZINC000904294189 1041431115 /nfs/dbraw/zinc/43/11/15/1041431115.db2.gz GBGJNVGOTOWSER-UHFFFAOYSA-N -1 3 345.196 4.434 20 0 EIADHM Cc1[nH]nc(-c2ccccc2)c1NC(=O)c1ccc2c(c1[O-])CCCC2 ZINC000436702169 1041433897 /nfs/dbraw/zinc/43/38/97/1041433897.db2.gz CBSCQZIVNFYWCW-UHFFFAOYSA-N -1 3 347.418 4.222 20 0 EIADHM CC(C)c1ccc(C(=O)N[C@@H](c2ccccc2)[C@@H]2CCOC2)c([O-])c1 ZINC000436762285 1041459954 /nfs/dbraw/zinc/45/99/54/1041459954.db2.gz BVQAHWPLDGNNLC-XLIONFOSSA-N -1 3 339.435 4.023 20 0 EIADHM Cc1ccc(CN(C)C(=O)c2cc(Oc3ccccc3)ccc2[O-])o1 ZINC000436753739 1041464956 /nfs/dbraw/zinc/46/49/56/1041464956.db2.gz GDFIIBBOKVFWDD-UHFFFAOYSA-N -1 3 337.375 4.358 20 0 EIADHM Cc1nn(-c2ccccc2)c(C)c1NC(=O)c1ccc(C)c(C)c1[O-] ZINC000436752307 1041465171 /nfs/dbraw/zinc/46/51/71/1041465171.db2.gz APBSVTRZSGERNK-UHFFFAOYSA-N -1 3 335.407 4.064 20 0 EIADHM CCc1ccc(C(=O)Nc2cc(NC(=O)C(C)C)ccc2C)c([O-])c1 ZINC000436817711 1041486934 /nfs/dbraw/zinc/48/69/34/1041486934.db2.gz SNMQPZBAFYAYIW-UHFFFAOYSA-N -1 3 340.423 4.110 20 0 EIADHM Cc1ccc(C(=O)N[C@H](C)c2ccc(-c3ccncc3)cc2)c([O-])c1 ZINC000436829168 1041495537 /nfs/dbraw/zinc/49/55/37/1041495537.db2.gz AMWBCYIXFFNMLB-OAHLLOKOSA-N -1 3 332.403 4.254 20 0 EIADHM CCc1ccc(-c2nc(-c3ccc(OC(F)F)cc3)no2)c([O-])c1 ZINC000436838010 1041502382 /nfs/dbraw/zinc/50/23/82/1041502382.db2.gz LVLRQSLBFYLNFW-UHFFFAOYSA-N -1 3 332.306 4.273 20 0 EIADHM O=C(c1ccccc1[O-])N1CC[C@H](Sc2cccc(Cl)c2)C1 ZINC000436846781 1041514984 /nfs/dbraw/zinc/51/49/84/1041514984.db2.gz YHZBYGDAVWJYEU-AWEZNQCLSA-N -1 3 333.840 4.052 20 0 EIADHM Cn1ccc(-c2noc(-c3cc(OCc4ccccc4)ccc3[O-])n2)c1 ZINC000436889772 1041543577 /nfs/dbraw/zinc/54/35/77/1041543577.db2.gz ZMZUCPHEQFUVGI-UHFFFAOYSA-N -1 3 347.374 4.027 20 0 EIADHM [O-]c1cc2ccccc2cc1-c1nc(COc2ccc(F)cc2)no1 ZINC000436895677 1041551044 /nfs/dbraw/zinc/55/10/44/1041551044.db2.gz YFWZHQGJXWFKRX-UHFFFAOYSA-N -1 3 336.322 4.314 20 0 EIADHM O=C(c1cc(CCc2ccccc2)ccc1[O-])N1CCCC2(CC2)C1 ZINC000436920823 1041559410 /nfs/dbraw/zinc/55/94/10/1041559410.db2.gz ATAVKGGFWUMOIC-UHFFFAOYSA-N -1 3 335.447 4.194 20 0 EIADHM [O-]c1cc2ccccc2cc1-c1nc(Cc2c[nH]c3ncccc23)no1 ZINC000436939446 1041566995 /nfs/dbraw/zinc/56/69/95/1041566995.db2.gz ODDMKKPMVBIIHC-UHFFFAOYSA-N -1 3 342.358 4.063 20 0 EIADHM COc1cccc(-c2nc(-c3ccc4nc(C)sc4c3)no2)c1[O-] ZINC000436944398 1041568956 /nfs/dbraw/zinc/56/89/56/1041568956.db2.gz PWSJSEJPRPILJW-UHFFFAOYSA-N -1 3 339.376 4.036 20 0 EIADHM CO[C@@H](c1noc(-c2ccc(C(C)C)cc2[O-])n1)c1ccc(F)cc1 ZINC000436954154 1041574957 /nfs/dbraw/zinc/57/49/57/1041574957.db2.gz UQUKHAIZXLHAFL-QGZVFWFLSA-N -1 3 342.370 4.441 20 0 EIADHM CCCCOc1ccc(C(=O)N[C@@H](CC)c2c(C)noc2C)c([O-])c1 ZINC000436979795 1041581284 /nfs/dbraw/zinc/58/12/84/1041581284.db2.gz BRHBMZGNRZXHOR-INIZCTEOSA-N -1 3 346.427 4.057 20 0 EIADHM CC[C@H](C)n1nc(C(=O)Nc2ccc([O-])c(C(F)(F)F)c2)cc1C ZINC000437004782 1041588782 /nfs/dbraw/zinc/58/87/82/1041588782.db2.gz NFQASXRHVWJMGP-VIFPVBQESA-N -1 3 341.333 4.139 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1ccc([C@@H]2CCCOC2)cc1 ZINC000505963458 1041635744 /nfs/dbraw/zinc/63/57/44/1041635744.db2.gz AFUYCFQCIGMZCW-CQSZACIVSA-N -1 3 331.799 4.192 20 0 EIADHM CCCc1c(C(=O)Nc2cc(F)ccc2[O-])cnn1C1CCCC1 ZINC000541455914 1041953070 /nfs/dbraw/zinc/95/30/70/1041953070.db2.gz UOQDEAWPIWYXOF-UHFFFAOYSA-N -1 3 331.391 4.048 20 0 EIADHM Cc1cccc(C(=O)Nc2ccc(Oc3cccnc3)c(C)c2)c1[O-] ZINC000302986850 1042224074 /nfs/dbraw/zinc/22/40/74/1042224074.db2.gz IRUHFDPITVGPET-UHFFFAOYSA-N -1 3 334.375 4.449 20 0 EIADHM C[C@@H]1CO[C@H](c2cccc(Cl)c2)CN1Cc1cc([O-])cc(F)c1 ZINC000438545710 1042232317 /nfs/dbraw/zinc/23/23/17/1042232317.db2.gz KKVKUFRPQVZTJD-XIKOKIGWSA-N -1 3 335.806 4.147 20 0 EIADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)CC(C)(C)CC)c2)n1 ZINC000465039064 1042296880 /nfs/dbraw/zinc/29/68/80/1042296880.db2.gz WRTGYMTYQQCWEF-UHFFFAOYSA-N -1 3 327.428 4.176 20 0 EIADHM Cc1c(-c2ccccc2)sc2[n-]c(-c3cncs3)nc(=O)c12 ZINC000426124953 1042326807 /nfs/dbraw/zinc/32/68/07/1042326807.db2.gz XKZRGQQDTNPNSH-UHFFFAOYSA-N -1 3 325.418 4.496 20 0 EIADHM O=C(Nc1cc(F)ccc1OCC1CC1)c1cc([O-])ccc1Cl ZINC000506671725 1042757689 /nfs/dbraw/zinc/75/76/89/1042757689.db2.gz YWECXPYNMIEGTM-UHFFFAOYSA-N -1 3 335.762 4.226 20 0 EIADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)[C@@H](C)C(CC)CC)c2)n1 ZINC000536411170 1042840673 /nfs/dbraw/zinc/84/06/73/1042840673.db2.gz OLMQJQIMIFMQSG-ZDUSSCGKSA-N -1 3 341.455 4.422 20 0 EIADHM Cc1nc(CSc2nnc([N-]c3ccccc3F)s2)cs1 ZINC000003469280 1042860224 /nfs/dbraw/zinc/86/02/24/1042860224.db2.gz WANZJUQGUZVPJF-UHFFFAOYSA-N -1 3 338.458 4.478 20 0 EIADHM Cc1cc(F)c(CNCC[C@H](Cc2ccccc2)C(=O)[O-])c(Cl)c1 ZINC000417576728 1042890190 /nfs/dbraw/zinc/89/01/90/1042890190.db2.gz ZYOKEWCXEXCNBV-OAHLLOKOSA-N -1 3 349.833 4.211 20 0 EIADHM CCCCOc1ccccc1CN[C@@H]1C[C@H](C(=O)[O-])c2ccccc21 ZINC000417628646 1042915634 /nfs/dbraw/zinc/91/56/34/1042915634.db2.gz PPJFWSBOGPMKKR-RBUKOAKNSA-N -1 3 339.435 4.268 20 0 EIADHM O=C(N=c1cc(-c2ccccc2)[n-][nH]1)c1cc(Cl)sc1Cl ZINC000520631978 1042956699 /nfs/dbraw/zinc/95/66/99/1042956699.db2.gz KEGSPVPUKIVFJL-UHFFFAOYSA-N -1 3 338.219 4.119 20 0 EIADHM Cc1cc(C)c(S(=O)(=O)[N-]c2cccc(COC(C)C)c2)c(C)c1 ZINC000063849418 1043055967 /nfs/dbraw/zinc/05/59/67/1043055967.db2.gz SKDCICAPKVGESA-UHFFFAOYSA-N -1 3 347.480 4.338 20 0 EIADHM COc1ccccc1[C@@H](NCc1cc([O-])cc(F)c1)c1ccccc1 ZINC000185526028 1043194202 /nfs/dbraw/zinc/19/42/02/1043194202.db2.gz DNDCRFUYFSDCLI-NRFANRHFSA-N -1 3 337.394 4.419 20 0 EIADHM Cc1cc(N2CCSCC2)ccc1NCc1cc([O-])cc(F)c1 ZINC000185592400 1043200652 /nfs/dbraw/zinc/20/06/52/1043200652.db2.gz UMKMLUKHFFQBMT-UHFFFAOYSA-N -1 3 332.444 4.005 20 0 EIADHM Cc1ccc(C[C@H](C)NC(=O)c2cc([O-])c3ccccc3c2)s1 ZINC000526901097 1043244038 /nfs/dbraw/zinc/24/40/38/1043244038.db2.gz QELFBFSLJRQDPW-LBPRGKRZSA-N -1 3 325.433 4.276 20 0 EIADHM COc1cccc(Cl)c1CNC(=O)c1cc([O-])c2ccccc2c1 ZINC000526929786 1043244920 /nfs/dbraw/zinc/24/49/20/1043244920.db2.gz MLWMXSMTSUMJRE-UHFFFAOYSA-N -1 3 341.794 4.137 20 0 EIADHM COc1ccc(CCCN(C)C(=O)c2cc([O-])c3ccccc3c2)cc1 ZINC000527447789 1043260691 /nfs/dbraw/zinc/26/06/91/1043260691.db2.gz MZBWMZVDMCKOJD-UHFFFAOYSA-N -1 3 349.430 4.259 20 0 EIADHM C[C@@H](c1ccccc1Cl)N(C)C(=O)NCc1ccc([O-])c(F)c1 ZINC000163720157 1043261007 /nfs/dbraw/zinc/26/10/07/1043261007.db2.gz LZTUCNHJMPVJCU-NSHDSACASA-N -1 3 336.794 4.087 20 0 EIADHM CCn1c2ccc(F)cc2nc1NC(=O)c1cc([O-])c2ccccc2c1 ZINC000527463892 1043262467 /nfs/dbraw/zinc/26/24/67/1043262467.db2.gz TZBNJIOTBUUQCA-UHFFFAOYSA-N -1 3 349.365 4.306 20 0 EIADHM Cc1csc([C@H](C)[N-]C(=O)C(F)(F)c2cccc(Cl)c2)n1 ZINC000727670405 1043264465 /nfs/dbraw/zinc/26/44/65/1043264465.db2.gz VSZYGOJUJJPRIO-VIFPVBQESA-N -1 3 330.787 4.074 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)C1(Sc2ccccc2)CCCC1 ZINC000427958807 1043275657 /nfs/dbraw/zinc/27/56/57/1043275657.db2.gz KOFLMJZHZKQTJC-UHFFFAOYSA-N -1 3 345.439 4.253 20 0 EIADHM CCC[C@@H](CCc1ccccc1)NC(=O)NCc1ccc([O-])c(F)c1 ZINC000465984801 1043292539 /nfs/dbraw/zinc/29/25/39/1043292539.db2.gz FBUQWGXEWKXQFA-KRWDZBQOSA-N -1 3 344.430 4.132 20 0 EIADHM Cc1ccc([C@@H](C)C(=O)Nc2c(C)c(Br)ccc2[O-])o1 ZINC001117776920 1043293348 /nfs/dbraw/zinc/29/33/48/1043293348.db2.gz SFHAUIWDOVITOC-SNVBAGLBSA-N -1 3 338.201 4.107 20 0 EIADHM COc1ccc(C(=O)N(CCc2ccccc2)C2CCCC2)c([O-])c1 ZINC000220118629 1043293884 /nfs/dbraw/zinc/29/38/84/1043293884.db2.gz JNYUIUGYXOPAKJ-UHFFFAOYSA-N -1 3 339.435 4.028 20 0 EIADHM Cc1[nH]c(S[C@H](C)c2nc(C)cc(=O)[n-]2)nc1-c1ccccc1 ZINC000187154153 1043330574 /nfs/dbraw/zinc/33/05/74/1043330574.db2.gz PCLHKPDMZILXMT-GFCCVEGCSA-N -1 3 326.425 4.042 20 0 EIADHM C[C@@H](CCC(C)(C)C)C(=O)NCc1ccc([O-])c(Br)c1 ZINC000543580157 1043373390 /nfs/dbraw/zinc/37/33/90/1043373390.db2.gz LRKXCHWHQBNKHQ-NSHDSACASA-N -1 3 342.277 4.233 20 0 EIADHM [O-]c1cccc(O[C@@H]2Cc3ccc(Br)cc3C2)c1Cl ZINC001226712720 1043383933 /nfs/dbraw/zinc/38/39/33/1043383933.db2.gz USAWMMSUSSJBIF-GFCCVEGCSA-N -1 3 339.616 4.354 20 0 EIADHM Cc1ccc(CN(C(=O)NCc2ccc([O-])c(F)c2)C2CC2)cc1C ZINC000077839235 1043397091 /nfs/dbraw/zinc/39/70/91/1043397091.db2.gz FBACZNZOQQROAJ-UHFFFAOYSA-N -1 3 342.414 4.022 20 0 EIADHM COc1ccc(C(=O)N[C@H](C)c2csc3ccccc32)c([O-])c1 ZINC000729960556 1043418332 /nfs/dbraw/zinc/41/83/32/1043418332.db2.gz NCOOCTSWQYMIPY-LLVKDONJSA-N -1 3 327.405 4.107 20 0 EIADHM CC[C@@H](C)Sc1nc2c(cnn2-c2cccc(Cl)c2)c(=O)[n-]1 ZINC000009521186 1043441785 /nfs/dbraw/zinc/44/17/85/1043441785.db2.gz OTXWBASQERBVHH-SECBINFHSA-N -1 3 334.832 4.065 20 0 EIADHM Cc1cc(Nc2cc(F)cc(F)c2[O-])n(Cc2ccccc2F)n1 ZINC001212481761 1043456264 /nfs/dbraw/zinc/45/62/64/1043456264.db2.gz IDKYYNGEGWJUIA-UHFFFAOYSA-N -1 3 333.313 4.106 20 0 EIADHM CSc1ccncc1[N-]C(=O)c1ccc(-c2ccccc2F)o1 ZINC000674257443 1043507066 /nfs/dbraw/zinc/50/70/66/1043507066.db2.gz YSKCPJLRCBDXND-UHFFFAOYSA-N -1 3 328.368 4.455 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2cc(Cl)cc(F)c2F)cc1C ZINC000442213879 1043567372 /nfs/dbraw/zinc/56/73/72/1043567372.db2.gz LYYCZTUTUIPEAQ-UHFFFAOYSA-N -1 3 331.771 4.036 20 0 EIADHM CCn1cc(C(=O)N=c2cc(-c3ccccc3C)[n-][nH]2)c2ccccc21 ZINC000522065482 1044207232 /nfs/dbraw/zinc/20/72/32/1044207232.db2.gz NMTUZALJVIKMOE-UHFFFAOYSA-N -1 3 344.418 4.034 20 0 EIADHM Cc1cccc(-c2nn(-c3cccc([O-])c3F)c3ccc(N)cc23)c1 ZINC001212554455 1044301409 /nfs/dbraw/zinc/30/14/09/1044301409.db2.gz UXNZJPYSNKOHSM-UHFFFAOYSA-N -1 3 333.366 4.428 20 0 EIADHM [O-]c1ccc(-c2nc(-c3cccc(Oc4ccccc4)c3)no2)nc1 ZINC001212557783 1044306064 /nfs/dbraw/zinc/30/60/64/1044306064.db2.gz AFVVFBABPBHXHK-UHFFFAOYSA-N -1 3 331.331 4.297 20 0 EIADHM [O-]c1ccc(-c2nc(-c3ccc(OCc4ccccc4)cc3)no2)nc1 ZINC001212558166 1044307257 /nfs/dbraw/zinc/30/72/57/1044307257.db2.gz UZHFCIAORIGBRP-UHFFFAOYSA-N -1 3 345.358 4.083 20 0 EIADHM [O-]c1ccc(-c2nc(-c3ccc(C(F)(F)F)cc3Cl)no2)nc1 ZINC001212558270 1044308878 /nfs/dbraw/zinc/30/88/78/1044308878.db2.gz ZSXMRTSZNPMNTR-UHFFFAOYSA-N -1 3 341.676 4.176 20 0 EIADHM Cc1nc(Br)ccc1[N-]c1nc(C(C)(C)C)ns1 ZINC001212561161 1044326231 /nfs/dbraw/zinc/32/62/31/1044326231.db2.gz BUWWSNVTSKFNCV-UHFFFAOYSA-N -1 3 327.251 4.045 20 0 EIADHM O=C(Cc1cccc2ccccc21)[N-]OCc1ccc(F)cc1Cl ZINC000733895263 1044404288 /nfs/dbraw/zinc/40/42/88/1044404288.db2.gz OHKDFMAPJXEBDW-UHFFFAOYSA-N -1 3 343.785 4.423 20 0 EIADHM C[C@@H](c1ccncc1)N(C)C(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000094067877 1044504197 /nfs/dbraw/zinc/50/41/97/1044504197.db2.gz YBNMGTXXQAMRJN-INIZCTEOSA-N -1 3 346.430 4.211 20 0 EIADHM Cc1ccc(C(=O)N(Cc2ccccn2)Cc2ccccc2C)c([O-])c1 ZINC000094106320 1044529100 /nfs/dbraw/zinc/52/91/00/1044529100.db2.gz JGLFAYLYFZUFOT-UHFFFAOYSA-N -1 3 346.430 4.247 20 0 EIADHM O=C([N-]c1cc(F)ccc1F)c1c(F)cc(Br)cc1F ZINC000094715776 1044613634 /nfs/dbraw/zinc/61/36/34/1044613634.db2.gz LSDNNBVETQRZFH-UHFFFAOYSA-N -1 3 348.093 4.258 20 0 EIADHM CN(CCOC(C)(C)C)C(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000676068563 1044634971 /nfs/dbraw/zinc/63/49/71/1044634971.db2.gz QUCUPIMSQCYASH-UHFFFAOYSA-N -1 3 343.423 4.072 20 0 EIADHM O=C([N-]c1nc(-c2ccc(F)cc2)ns1)c1cc2occc2s1 ZINC000736019539 1044896211 /nfs/dbraw/zinc/89/62/11/1044896211.db2.gz SXZVZFKEGMBCER-UHFFFAOYSA-N -1 3 345.380 4.404 20 0 EIADHM Fc1ccccc1[N-]c1nnc(SCC(F)(F)C(F)F)s1 ZINC000736434953 1044934924 /nfs/dbraw/zinc/93/49/24/1044934924.db2.gz ZBCCBUXPSVJVEM-UHFFFAOYSA-N -1 3 341.330 4.413 20 0 EIADHM CSc1cccc(S(=O)(=O)[N-]c2cc(Cl)ccc2F)c1 ZINC000509103005 1045128676 /nfs/dbraw/zinc/12/86/76/1045128676.db2.gz KNXKHPXICWQRQB-UHFFFAOYSA-N -1 3 331.821 4.002 20 0 EIADHM COc1ccc([O-])c(C(=O)N2CCCc3cc(C(C)C)ccc32)c1 ZINC000915165479 1045155597 /nfs/dbraw/zinc/15/55/97/1045155597.db2.gz CVLYYNDTMHQJCB-UHFFFAOYSA-N -1 3 325.408 4.117 20 0 EIADHM O=C([N-]C1(c2cccc(F)c2)CC1)C(F)(F)c1cccc(Cl)c1 ZINC000739632281 1045160488 /nfs/dbraw/zinc/16/04/88/1045160488.db2.gz KEMSTDFBOGYMOG-UHFFFAOYSA-N -1 3 339.744 4.376 20 0 EIADHM O=C(Nc1ccc(Br)cc1[O-])c1cc(Cl)c(Cl)[nH]1 ZINC000915198525 1045174136 /nfs/dbraw/zinc/17/41/36/1045174136.db2.gz LMNSEDKKKZOWFX-UHFFFAOYSA-N -1 3 349.999 4.042 20 0 EIADHM O=C([N-]c1cc(Cl)nc(Cl)c1)c1c(F)c(F)cc(F)c1F ZINC000189878278 1045178882 /nfs/dbraw/zinc/17/88/82/1045178882.db2.gz JQPZGPZIZWZYSG-UHFFFAOYSA-N -1 3 339.075 4.197 20 0 EIADHM CC(=O)c1ccc(Cl)c([N-]C(=O)c2c(C)noc2C(F)(F)F)c1 ZINC000762343671 1045198652 /nfs/dbraw/zinc/19/86/52/1045198652.db2.gz RQFTYHSKJFCBBK-UHFFFAOYSA-N -1 3 346.692 4.110 20 0 EIADHM COc1ccccc1C/C(C)=C\C(=O)Nc1cc(Cl)ccc1[O-] ZINC000762797767 1045353412 /nfs/dbraw/zinc/35/34/12/1045353412.db2.gz CUGHTZZUALHJDP-BENRWUELSA-N -1 3 331.799 4.182 20 0 EIADHM O=C(Nc1cccc(Br)c1)c1cc([O-])ccc1Cl ZINC000236558540 1045359535 /nfs/dbraw/zinc/35/95/35/1045359535.db2.gz CXURGZICFIBWNQ-UHFFFAOYSA-N -1 3 326.577 4.060 20 0 EIADHM O=C([O-])CC[C@H]1CCCCN1CCOc1c(Cl)cccc1Cl ZINC000315902123 1045412240 /nfs/dbraw/zinc/41/22/40/1045412240.db2.gz MDXMGMSZMUIPOH-GFCCVEGCSA-N -1 3 346.254 4.092 20 0 EIADHM C[C@H]1CN(Cc2c(C(=O)[O-])sc3cccc(F)c32)C[C@H](C)S1 ZINC000387078569 1045416238 /nfs/dbraw/zinc/41/62/38/1045416238.db2.gz OXCQBCRBXQMIMB-UWVGGRQHSA-N -1 3 339.457 4.064 20 0 EIADHM CSc1ccc([O-])c(C(=O)N2CCC(c3ccsc3)CC2)c1 ZINC000613652200 1045536493 /nfs/dbraw/zinc/53/64/93/1045536493.db2.gz IEOXPFQHWGVCGK-UHFFFAOYSA-N -1 3 333.478 4.195 20 0 EIADHM O=C(C[C@@H](Cc1ccccc1)c1ccccc1)[N-]OCc1cccnc1 ZINC000746936645 1045551818 /nfs/dbraw/zinc/55/18/18/1045551818.db2.gz BLAMPFNWVHVOKU-OAQYLSRUSA-N -1 3 346.430 4.046 20 0 EIADHM CCOc1ccc([N-]S(=O)(=O)c2cc(Cl)ccc2C)c(C)c1 ZINC000614867725 1045565355 /nfs/dbraw/zinc/56/53/55/1045565355.db2.gz OLQIUBBUGNGLNK-UHFFFAOYSA-N -1 3 339.844 4.156 20 0 EIADHM O=C(Nc1ccc(Cl)cc1[O-])c1cccc(Br)c1 ZINC000533616749 1045638839 /nfs/dbraw/zinc/63/88/39/1045638839.db2.gz WEPOUHQANQMFGP-UHFFFAOYSA-N -1 3 326.577 4.060 20 0 EIADHM O=C(CCSc1ccccc1F)Nc1ccc(Cl)cc1[O-] ZINC000533618770 1045641523 /nfs/dbraw/zinc/64/15/23/1045641523.db2.gz HJIDASSIOJMVST-UHFFFAOYSA-N -1 3 325.792 4.306 20 0 EIADHM O=C(Nc1ccc(Cl)cc1[O-])c1ccc2[nH]c(C(F)F)nc2c1 ZINC000533618791 1045643314 /nfs/dbraw/zinc/64/33/14/1045643314.db2.gz IEKGYGVBHSCHAX-UHFFFAOYSA-N -1 3 337.713 4.112 20 0 EIADHM CCOc1ccc(-c2cc(Nc3ccc([O-])c(F)c3F)on2)cc1 ZINC001211997768 1045697612 /nfs/dbraw/zinc/69/76/12/1045697612.db2.gz KMCVFUQDEBPWBJ-UHFFFAOYSA-N -1 3 332.306 4.468 20 0 EIADHM Cc1csc(C(C)(C)NC(=O)c2cc3sccc3c([O-])c2)n1 ZINC000791366190 1045730430 /nfs/dbraw/zinc/73/04/30/1045730430.db2.gz IHLNEGCRAWZPAA-UHFFFAOYSA-N -1 3 332.450 4.037 20 0 EIADHM CCCOc1ccc([N-]S(=O)(=O)c2ccc(C)cc2)cc1Cl ZINC000614866997 1045778439 /nfs/dbraw/zinc/77/84/39/1045778439.db2.gz ODGAZMSCOVCNHV-UHFFFAOYSA-N -1 3 339.844 4.238 20 0 EIADHM O=C(Nc1cccnc1)c1cccc(Nc2ccc([O-])c(F)c2F)c1 ZINC001212011039 1045832035 /nfs/dbraw/zinc/83/20/35/1045832035.db2.gz NWNKTMIHMIXBKV-UHFFFAOYSA-N -1 3 341.317 4.061 20 0 EIADHM CCOC(=O)c1cc(F)c(C)c(Nc2ccc([O-])c(F)c2F)c1 ZINC001212013905 1045835664 /nfs/dbraw/zinc/83/56/64/1045835664.db2.gz PDSJGKKAPUQATL-UHFFFAOYSA-N -1 3 325.286 4.038 20 0 EIADHM COC(=O)c1ccc(Nc2ccc([O-])c(F)c2F)cc1C(F)(F)F ZINC001212016568 1045840432 /nfs/dbraw/zinc/84/04/32/1045840432.db2.gz WOCASAOOMWSXCW-UHFFFAOYSA-N -1 3 347.239 4.219 20 0 EIADHM O=C(NCCSCc1ccccc1)c1cc([O-])c2ccccc2c1 ZINC000792030682 1045853380 /nfs/dbraw/zinc/85/33/80/1045853380.db2.gz QCMHNCKAFLCHLA-UHFFFAOYSA-N -1 3 337.444 4.209 20 0 EIADHM O=C([N-]Cc1ccccc1C(F)(F)F)C(F)(F)c1ccccc1 ZINC000916046189 1045887035 /nfs/dbraw/zinc/88/70/35/1045887035.db2.gz VPDCCOHXFDULLL-UHFFFAOYSA-N -1 3 329.268 4.114 20 0 EIADHM C[C@@H](Sc1nc2ccccc2s1)C(=O)Nc1cccc([O-])c1F ZINC000153846608 1045907277 /nfs/dbraw/zinc/90/72/77/1045907277.db2.gz VMYYIJRJDUCBPE-SECBINFHSA-N -1 3 348.424 4.260 20 0 EIADHM C[C@@H](NCc1cc([N+](=O)[O-])ccc1[O-])c1ccc(Cl)cc1Cl ZINC000237466997 1046184326 /nfs/dbraw/zinc/18/43/26/1046184326.db2.gz BWTCVIAOAGIQRZ-SECBINFHSA-N -1 3 341.194 4.458 20 0 EIADHM Cc1cccc(NC2CCN(Cc3cccc([O-])c3Cl)CC2)c1 ZINC000508720296 1046377400 /nfs/dbraw/zinc/37/74/00/1046377400.db2.gz RCUPYQMTXGPKST-UHFFFAOYSA-N -1 3 330.859 4.431 20 0 EIADHM CC(C)(Cc1ccc(C(F)(F)F)cc1)C(=O)[N-]OC/C=C\Cl ZINC000794304739 1046397848 /nfs/dbraw/zinc/39/78/48/1046397848.db2.gz IYSGZJWKNGXPAF-BAQGIRSFSA-N -1 3 335.753 4.074 20 0 EIADHM O=C(CCc1ccccc1F)[N-]OCc1ccc(C(F)(F)F)cc1 ZINC000746529253 1046583528 /nfs/dbraw/zinc/58/35/28/1046583528.db2.gz MJUHOGMMHWSSKC-UHFFFAOYSA-N -1 3 341.304 4.025 20 0 EIADHM CC(C)c1csc(CNCc2cccc([O-])c2Br)n1 ZINC000459439704 1046683523 /nfs/dbraw/zinc/68/35/23/1046683523.db2.gz WHQLRENDNTUKBU-UHFFFAOYSA-N -1 3 341.274 4.024 20 0 EIADHM O=C(OCc1coc(-c2cccc(Cl)c2)n1)c1cc2occc2[n-]1 ZINC000786029483 1046797228 /nfs/dbraw/zinc/79/72/28/1046797228.db2.gz DMLZTZRGWJMZQS-UHFFFAOYSA-N -1 3 342.738 4.426 20 0 EIADHM CC(C)[C@H](SCc1ccccc1)C(=O)Nc1cccc([O-])c1F ZINC000128387616 1046847321 /nfs/dbraw/zinc/84/73/21/1046847321.db2.gz OAALMNUNKBRYTO-KRWDZBQOSA-N -1 3 333.428 4.428 20 0 EIADHM C[C@@H](Cc1ccccc1Cl)NC(=O)CCCc1ccc([O-])c(F)c1 ZINC000786776889 1046870006 /nfs/dbraw/zinc/87/00/06/1046870006.db2.gz FUQLQFGREHBPPL-ZDUSSCGKSA-N -1 3 349.833 4.255 20 0 EIADHM Cc1ccccc1-c1cc(=NC(=O)[C@H]2CCSc3ccccc32)[nH][n-]1 ZINC000537120447 1046948143 /nfs/dbraw/zinc/94/81/43/1046948143.db2.gz OOFZJMKFBKDMLZ-INIZCTEOSA-N -1 3 349.459 4.025 20 0 EIADHM Cc1ccc(C(C)C)cc1O[C@@H](C)C(=O)Nc1cccc([O-])c1F ZINC000128574291 1046958084 /nfs/dbraw/zinc/95/80/84/1046958084.db2.gz YPVHVWWSTPHCKF-ZDUSSCGKSA-N -1 3 331.387 4.369 20 0 EIADHM CSc1cccc([C@@H]([N-]C(=O)C(F)F)c2ccc(F)c(F)c2)c1 ZINC000787397498 1047005607 /nfs/dbraw/zinc/00/56/07/1047005607.db2.gz TWOVKWYEBNDAGE-CQSZACIVSA-N -1 3 343.345 4.157 20 0 EIADHM O=C(N[C@H]1CCCOc2ccccc21)c1cc2sccc2c([O-])c1 ZINC000788297280 1047149988 /nfs/dbraw/zinc/14/99/88/1047149988.db2.gz UQAWRNBUCOLNKT-HNNXBMFYSA-N -1 3 339.416 4.251 20 0 EIADHM Cc1csc([C@H](NC(=O)c2cc3sccc3c([O-])c2)C2CC2)n1 ZINC000788308062 1047154750 /nfs/dbraw/zinc/15/47/50/1047154750.db2.gz SZMPITOAHRCPLE-OAHLLOKOSA-N -1 3 344.461 4.253 20 0 EIADHM COC(=O)c1cnc(SCc2cccc(SC(F)(F)F)c2)[n-]1 ZINC000788504245 1047207459 /nfs/dbraw/zinc/20/74/59/1047207459.db2.gz CWJKKPQZGDSVCR-UHFFFAOYSA-N -1 3 348.371 4.101 20 0 EIADHM O=C(Nc1cccc([O-])c1F)[C@@H](Oc1ccccc1)c1ccccc1 ZINC000129093341 1047295286 /nfs/dbraw/zinc/29/52/86/1047295286.db2.gz UWZJUZKKMYNHRF-IBGZPJMESA-N -1 3 337.350 4.290 20 0 EIADHM C[C@H](Oc1cccc(C(C)(C)C)c1)C(=O)Nc1cccc([O-])c1F ZINC000129306547 1047348516 /nfs/dbraw/zinc/34/85/16/1047348516.db2.gz JYLAUHPMQKJJDR-LBPRGKRZSA-N -1 3 331.387 4.235 20 0 EIADHM CCCOc1ccc(C(=O)Nc2cc(Cl)ccc2[O-])cc1OCC ZINC000069693431 1047449203 /nfs/dbraw/zinc/44/92/03/1047449203.db2.gz OTMGHBKFRSBPSA-UHFFFAOYSA-N -1 3 349.814 4.485 20 0 EIADHM CCCCOc1ccc(C(=O)Nc2cc(Cl)ccc2[O-])cc1OC ZINC000069693162 1047449296 /nfs/dbraw/zinc/44/92/96/1047449296.db2.gz ZUUHKKJMFMNTIS-UHFFFAOYSA-N -1 3 349.814 4.485 20 0 EIADHM COc1ccc(C(=O)Nc2ccc(Cl)cc2[O-])c(OC(C)C)c1 ZINC000476338583 1047472630 /nfs/dbraw/zinc/47/26/30/1047472630.db2.gz YYSIONUPPYFWGO-UHFFFAOYSA-N -1 3 335.787 4.094 20 0 EIADHM O=C(Nc1cnn(C2CCC2)c1)N([O-])Cc1cccc2ccccc21 ZINC000898035577 1047534259 /nfs/dbraw/zinc/53/42/59/1047534259.db2.gz VPXDXDDDMXBLKD-UHFFFAOYSA-N -1 3 336.395 4.185 20 0 EIADHM Cc1ccoc1C(=O)[N-]c1c2ccccc2oc1C(=O)c1ccco1 ZINC000070709521 1047655744 /nfs/dbraw/zinc/65/57/44/1047655744.db2.gz OSWSYYINAXRXML-UHFFFAOYSA-N -1 3 335.315 4.411 20 0 EIADHM CCCOc1ccc(CN[C@@H](C(=O)[O-])c2cccc(Cl)c2)cc1 ZINC000556671939 1047865790 /nfs/dbraw/zinc/86/57/90/1047865790.db2.gz RAEKZLAALKHWRF-QGZVFWFLSA-N -1 3 333.815 4.044 20 0 EIADHM O=C([N-]c1c2nsnc2ccc1Cl)c1sccc1Cl ZINC000808453951 1047918667 /nfs/dbraw/zinc/91/86/67/1047918667.db2.gz BMJRCLHBQWKPCJ-UHFFFAOYSA-N -1 3 330.221 4.312 20 0 EIADHM Cc1ccc(N[C@@H](C)c2ccccc2C(F)(F)F)cc1-c1nnn[n-]1 ZINC001170741079 1047962647 /nfs/dbraw/zinc/96/26/47/1047962647.db2.gz REBABHXGKKKISV-NSHDSACASA-N -1 3 347.344 4.367 20 0 EIADHM Cc1ccc(N[C@@H](C)c2ccccc2C(F)(F)F)cc1-c1nn[n-]n1 ZINC001170741079 1047962665 /nfs/dbraw/zinc/96/26/65/1047962665.db2.gz REBABHXGKKKISV-NSHDSACASA-N -1 3 347.344 4.367 20 0 EIADHM [O-]c1ccc(F)c(CNCc2ccc(OC3CCCCC3)nc2)c1F ZINC000556818640 1048039548 /nfs/dbraw/zinc/03/95/48/1048039548.db2.gz YRTAUXAXHVTJCG-UHFFFAOYSA-N -1 3 348.393 4.067 20 0 EIADHM CCCO[N-]C(=O)CCc1ncc(-c2ccc(Cl)cc2Cl)o1 ZINC000844080983 1048183243 /nfs/dbraw/zinc/18/32/43/1048183243.db2.gz QSAKAZFURMMIPG-UHFFFAOYSA-N -1 3 343.210 4.039 20 0 EIADHM Cc1ccc([C@H]2C[C@H](C)CCN2C(=O)NCc2ccc([O-])c(F)c2)o1 ZINC000074375290 1048485323 /nfs/dbraw/zinc/48/53/23/1048485323.db2.gz GFQJSQPZLGAADK-MLGOLLRUSA-N -1 3 346.402 4.116 20 0 EIADHM O=C([N-]c1nnc(C(F)F)s1)c1cc2c(cccc2F)s1 ZINC000920229412 1048587031 /nfs/dbraw/zinc/58/70/31/1048587031.db2.gz UAYAGWLHNVVLNQ-UHFFFAOYSA-N -1 3 329.328 4.082 20 0 EIADHM Cc1ccc(C(=O)NCC(c2ccccc2)c2ccccc2)c([O-])c1 ZINC001135283925 1048636834 /nfs/dbraw/zinc/63/68/34/1048636834.db2.gz VBOBGWZTWJDRLA-UHFFFAOYSA-N -1 3 331.415 4.263 20 0 EIADHM Cc1sc2[n-]c([C@@H](C)OC(=O)C[C@H](C)C3CC3)nc(=O)c2c1C ZINC000920728699 1048763872 /nfs/dbraw/zinc/76/38/72/1048763872.db2.gz QMETULUKFGMQGT-WCBMZHEXSA-N -1 3 334.441 4.054 20 0 EIADHM O=C(c1cc([O-])ccc1Cl)N1CCC[C@H]1c1ccc(F)c(F)c1 ZINC000810395979 1048772359 /nfs/dbraw/zinc/77/23/59/1048772359.db2.gz IHSREOQPCXIVNN-INIZCTEOSA-N -1 3 337.753 4.301 20 0 EIADHM [O-]c1cc(F)c(CN(CCCCCCO)Cc2ccccc2)cc1F ZINC001144663985 1048782387 /nfs/dbraw/zinc/78/23/87/1048782387.db2.gz QNRJXHMTUWXWQT-UHFFFAOYSA-N -1 3 349.421 4.225 20 0 EIADHM COc1cccc(C[C@@H]2CCCN(Cc3cc(F)c([O-])cc3F)C2)c1 ZINC001144659939 1048794807 /nfs/dbraw/zinc/79/48/07/1048794807.db2.gz RFEVVIOEWSUSPK-HNNXBMFYSA-N -1 3 347.405 4.134 20 0 EIADHM CCN(Cc1sccc1C(=O)[O-])Cc1ccc(C(F)(F)F)cc1 ZINC001144680649 1048801609 /nfs/dbraw/zinc/80/16/09/1048801609.db2.gz SHJTXAWMDYVTDJ-UHFFFAOYSA-N -1 3 343.370 4.487 20 0 EIADHM O=C([N-][C@H](c1ccco1)c1ccccc1)C(F)(F)c1ccc(F)cc1 ZINC000920842634 1048802507 /nfs/dbraw/zinc/80/25/07/1048802507.db2.gz IUMRSWLNFCHSNG-KRWDZBQOSA-N -1 3 345.320 4.416 20 0 EIADHM O=C(c1cc([O-])ccc1Cl)N1CCC(c2cccc(F)c2)CC1 ZINC000810481715 1048803180 /nfs/dbraw/zinc/80/31/80/1048803180.db2.gz WWQYXYHGRDKSIP-UHFFFAOYSA-N -1 3 333.790 4.205 20 0 EIADHM CC1(C)[C@@H]2OCCC[C@@H]2[C@@H]1OC(=O)c1cc2cc(Cl)sc2[n-]1 ZINC000810597243 1048826869 /nfs/dbraw/zinc/82/68/69/1048826869.db2.gz ZYTHVSVKKJDROE-BIMULSAOSA-N -1 3 339.844 4.243 20 0 EIADHM COc1ccc(NCc2c(F)ccc([O-])c2F)cc1Br ZINC000816523378 1048829637 /nfs/dbraw/zinc/82/96/37/1048829637.db2.gz NNVGLQMMVHIUNX-UHFFFAOYSA-N -1 3 344.155 4.054 20 0 EIADHM O=C([N-][C@@H]1CCc2cc(F)ccc21)C(F)(F)c1cccc(Cl)c1 ZINC000921007797 1048838001 /nfs/dbraw/zinc/83/80/01/1048838001.db2.gz YQXITHMXMCETAB-OAHLLOKOSA-N -1 3 339.744 4.375 20 0 EIADHM O=C([O-])c1cccc(-c2nc(CN3CCCCCCC3)cs2)c1 ZINC000846228607 1048843900 /nfs/dbraw/zinc/84/39/00/1048843900.db2.gz OTDMTRHJEAIVSF-UHFFFAOYSA-N -1 3 330.453 4.274 20 0 EIADHM C[C@@H](OC(=O)c1cc2cc(Cl)sc2[n-]1)c1nc(C2CC2)no1 ZINC000810675091 1048844302 /nfs/dbraw/zinc/84/43/02/1048844302.db2.gz LQCHHFLBKGYVNI-ZCFIWIBFSA-N -1 3 337.788 4.061 20 0 EIADHM C[C@]1(CCNC(=O)c2cc3sccc3c([O-])c2)C[C@]1(F)Cl ZINC000846401274 1048861281 /nfs/dbraw/zinc/86/12/81/1048861281.db2.gz SOOIIRLUSUNRRK-LSDHHAIUSA-N -1 3 327.808 4.041 20 0 EIADHM O=C([N-]c1nc(-c2ccc[nH]2)cs1)c1nc(Cl)sc1Cl ZINC000816832680 1048865444 /nfs/dbraw/zinc/86/54/44/1048865444.db2.gz JJGMAWULAZSFQV-UHFFFAOYSA-N -1 3 345.236 4.154 20 0 EIADHM O=C([N-]c1nc(-c2ccccc2)cs1)c1conc1C(F)(F)F ZINC000816832872 1048865514 /nfs/dbraw/zinc/86/55/14/1048865514.db2.gz PKIFBFJXWOJZRN-UHFFFAOYSA-N -1 3 339.298 4.069 20 0 EIADHM O=C(OCc1noc2c1CCCC2)c1cc2cc(Cl)sc2[n-]1 ZINC000810833279 1048877214 /nfs/dbraw/zinc/87/72/14/1048877214.db2.gz KTVDFJIRECHDLB-UHFFFAOYSA-N -1 3 336.800 4.107 20 0 EIADHM Cc1nc([N-]C(=O)c2sc3cc(C(C)C)ccc3c2Cl)nn1C ZINC000817019802 1048886303 /nfs/dbraw/zinc/88/63/03/1048886303.db2.gz WCHPSOCILFKXPD-UHFFFAOYSA-N -1 3 348.859 4.367 20 0 EIADHM Cc1ccc(-c2cc(C(=O)O[C@@H](C)c3ncc(C(C)(C)C)o3)n[n-]2)o1 ZINC000747690453 1049006189 /nfs/dbraw/zinc/00/61/89/1049006189.db2.gz LRYVVHCKTJFNRN-NSHDSACASA-N -1 3 343.383 4.182 20 0 EIADHM Cc1ccc(-c2cc(C(=O)O[C@@H](C)c3ncc(C(C)(C)C)o3)[n-]n2)o1 ZINC000747690453 1049006197 /nfs/dbraw/zinc/00/61/97/1049006197.db2.gz LRYVVHCKTJFNRN-NSHDSACASA-N -1 3 343.383 4.182 20 0 EIADHM CCc1ccc(C(=O)Nc2ccc(NC(=O)CC(C)C)cc2)c([O-])c1 ZINC001136033059 1049050570 /nfs/dbraw/zinc/05/05/70/1049050570.db2.gz AYNBWLWWDFMLJV-UHFFFAOYSA-N -1 3 340.423 4.192 20 0 EIADHM CO[C@@H](COC(=O)c1cc2cc(Cl)sc2[n-]1)c1ccccc1 ZINC000811393662 1049051999 /nfs/dbraw/zinc/05/19/99/1049051999.db2.gz PFALYPLDWCLTLL-ZDUSSCGKSA-N -1 3 335.812 4.427 20 0 EIADHM O=C(OCCCCCn1cccn1)c1cc2cc(Cl)sc2[n-]1 ZINC000811396730 1049053564 /nfs/dbraw/zinc/05/35/64/1049053564.db2.gz RSQVDRGLIZMCMS-UHFFFAOYSA-N -1 3 337.832 4.107 20 0 EIADHM CSCC[C@@H](C)NC(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC001147298037 1049120603 /nfs/dbraw/zinc/12/06/03/1049120603.db2.gz JOEJRTYUXCKJDU-CYBMUJFWSA-N -1 3 331.437 4.056 20 0 EIADHM O=C([O-])CC[C@@H]1CCCCN1Cc1cc2ccccc2nc1Cl ZINC000818329238 1049126773 /nfs/dbraw/zinc/12/67/73/1049126773.db2.gz RUJHDMVVTWFNNP-HNNXBMFYSA-N -1 3 332.831 4.108 20 0 EIADHM O=C(Nc1ccccc1N1CCCC1)c1cc2c(cc1[O-])CCCC2 ZINC001136132782 1049142999 /nfs/dbraw/zinc/14/29/99/1049142999.db2.gz BWCYYGSDQNPERC-UHFFFAOYSA-N -1 3 336.435 4.124 20 0 EIADHM O=C(NC[C@@H]1CCC[C@H]2C[C@H]21)c1cc(Cc2ccccc2)ccc1[O-] ZINC001147566005 1049188222 /nfs/dbraw/zinc/18/82/22/1049188222.db2.gz ZRQZNRLPKAXRNV-GBESFXJTSA-N -1 3 335.447 4.149 20 0 EIADHM Cc1sc2[n-]c([C@H](C)OC(=O)[C@@H]3CC34CCCC4)nc(=O)c2c1C ZINC000747733903 1049205572 /nfs/dbraw/zinc/20/55/72/1049205572.db2.gz XRBJLZRIVXNFRI-JQWIXIFHSA-N -1 3 346.452 4.198 20 0 EIADHM CCCCN(C(=O)c1nnc2ccccc2c1[O-])[C@H]1CCC[C@@H](C)C1 ZINC000818801926 1049206200 /nfs/dbraw/zinc/20/62/00/1049206200.db2.gz HTNHMYVTZMREEK-CABCVRRESA-N -1 3 341.455 4.156 20 0 EIADHM CC[C@@H](C)C[C@@H](C)NC(=O)c1c[n-]c(=NC(=O)OC(C)(C)C)s1 ZINC001147860979 1049228817 /nfs/dbraw/zinc/22/88/17/1049228817.db2.gz MSWVAGHJFXUBHK-GHMZBOCLSA-N -1 3 341.477 4.045 20 0 EIADHM Cc1ccc([C@@H]2CCC[C@@H]2N(C)C(=O)Cc2ccc([O-])c(F)c2)cc1 ZINC001147971446 1049243580 /nfs/dbraw/zinc/24/35/80/1049243580.db2.gz XXNHCWFTIKNDJN-HKUYNNGSSA-N -1 3 341.426 4.177 20 0 EIADHM CC1(C(=O)Nc2ccc(Br)cc2[O-])CCCCCC1 ZINC001136219502 1049323189 /nfs/dbraw/zinc/32/31/89/1049323189.db2.gz UVEKWKDAZVROBL-UHFFFAOYSA-N -1 3 326.234 4.454 20 0 EIADHM COc1cc(C)ccc1C(=O)[N-]c1c(SC)cc(C)nc1SC ZINC001148564751 1049334167 /nfs/dbraw/zinc/33/41/67/1049334167.db2.gz RRNPOOWOVIZBEG-UHFFFAOYSA-N -1 3 348.493 4.403 20 0 EIADHM CC1(C)CN(C(=O)c2cc(Oc3ccccc3)ccc2[O-])C1(C)C ZINC001148637376 1049352565 /nfs/dbraw/zinc/35/25/65/1049352565.db2.gz AWCKGNXCLGBXRM-UHFFFAOYSA-N -1 3 325.408 4.445 20 0 EIADHM CC(C)(NC(=O)c1cc([O-])ccc1Cl)c1nc2ccccc2s1 ZINC001149019212 1049411377 /nfs/dbraw/zinc/41/13/77/1049411377.db2.gz TWQUHEXTBYLBQD-UHFFFAOYSA-N -1 3 346.839 4.320 20 0 EIADHM O=C(CCC1CCCCC1)[N-]OCc1cncc(C(F)(F)F)c1 ZINC000812304789 1049418291 /nfs/dbraw/zinc/41/82/91/1049418291.db2.gz STWPSWCPELRZJD-UHFFFAOYSA-N -1 3 330.350 4.009 20 0 EIADHM O=S(=O)(/C=C/c1ccccc1Cl)[N-]c1cc2c(cn1)CCCC2 ZINC000812330218 1049430387 /nfs/dbraw/zinc/43/03/87/1049430387.db2.gz MJSPTIDMVUJSDB-MDZDMXLPSA-N -1 3 348.855 4.026 20 0 EIADHM CSc1ccc([O-])c(C(=O)N2CCC[C@@H]2c2ccccc2C)c1 ZINC001136327019 1049489028 /nfs/dbraw/zinc/48/90/28/1049489028.db2.gz USYOAEWLVGASNO-QGZVFWFLSA-N -1 3 327.449 4.400 20 0 EIADHM Cc1nc(NC(=O)c2cccc(C)c2[O-])sc1Cc1ccccc1 ZINC001136484252 1049676751 /nfs/dbraw/zinc/67/67/51/1049676751.db2.gz SCZXRJWRCPBWGX-UHFFFAOYSA-N -1 3 338.432 4.309 20 0 EIADHM CC(C)(C)Oc1c(F)cc([N-]C(=O)c2cc(Cl)no2)cc1F ZINC000821829474 1049697162 /nfs/dbraw/zinc/69/71/62/1049697162.db2.gz NDOZBDSHUQDYMY-UHFFFAOYSA-N -1 3 330.718 4.036 20 0 EIADHM CC(=O)c1ccc(C(=O)Nc2ccc(Oc3ccccc3)cn2)cc1[O-] ZINC001136644983 1049807913 /nfs/dbraw/zinc/80/79/13/1049807913.db2.gz QBVSHCVZGUTLOJ-UHFFFAOYSA-N -1 3 348.358 4.034 20 0 EIADHM CSCc1cccc(NC(=O)c2cc3c(cc2[O-])CCCC3)c1 ZINC001136669149 1049821948 /nfs/dbraw/zinc/82/19/48/1049821948.db2.gz QWKVQHXJJLVEHD-UHFFFAOYSA-N -1 3 327.449 4.386 20 0 EIADHM COc1ccc([C@@H](C)CCNC(=O)c2cc([O-])c3ccccc3c2)cc1 ZINC001136784561 1049879534 /nfs/dbraw/zinc/87/95/34/1049879534.db2.gz WZHNFNDYYWFUML-HNNXBMFYSA-N -1 3 349.430 4.478 20 0 EIADHM Cc1nc([C@@H](C)N2CCC[C@H](C(=O)[O-])C2)oc1-c1ccc(Cl)cc1 ZINC000263582062 1050090567 /nfs/dbraw/zinc/09/05/67/1050090567.db2.gz YAYBINXBGRKHAM-OCCSQVGLSA-N -1 3 348.830 4.161 20 0 EIADHM O=C(Nc1cc([O-])cc(Cl)c1)c1ccc(-n2cccn2)cc1Cl ZINC001185963857 1050203121 /nfs/dbraw/zinc/20/31/21/1050203121.db2.gz VSYPIQZXQKELQS-UHFFFAOYSA-N -1 3 348.189 4.137 20 0 EIADHM COc1ccccc1-c1ccccc1-c1noc(-c2cncc([O-])c2)n1 ZINC001212709553 1050332862 /nfs/dbraw/zinc/33/28/62/1050332862.db2.gz AJPPTLSPUXXSOO-UHFFFAOYSA-N -1 3 345.358 4.180 20 0 EIADHM Cc1c(F)c(F)ccc1NCc1cccc([O-])c1Br ZINC001178934906 1050586917 /nfs/dbraw/zinc/58/69/17/1050586917.db2.gz WCUSMZQBTYKVBF-UHFFFAOYSA-N -1 3 328.156 4.353 20 0 EIADHM CSc1ccc([O-])c(C(=O)N[C@H]2C[C@H](c3ccc(F)cc3F)C2)c1 ZINC001179002534 1050608395 /nfs/dbraw/zinc/60/83/95/1050608395.db2.gz CCHSNYKHNGULHO-UMSPYCQHSA-N -1 3 349.402 4.068 20 0 EIADHM Cc1ccc(Cl)c([N-]S(=O)(=O)c2cnc(Cl)c(C)c2)c1C ZINC000775146769 1050629726 /nfs/dbraw/zinc/62/97/26/1050629726.db2.gz QGEYNYAKNNEGJQ-UHFFFAOYSA-N -1 3 345.251 4.114 20 0 EIADHM COc1ccc(Nc2cc(Br)cc(F)c2[O-])cc1OC ZINC001173888021 1050639001 /nfs/dbraw/zinc/63/90/01/1050639001.db2.gz HNQHMBVGYQWUKY-UHFFFAOYSA-N -1 3 342.164 4.055 20 0 EIADHM Cc1ccc2sc(N[C@H]3CC[C@H](c4nccc(=O)[n-]4)CC3)nc2c1 ZINC001187871350 1050643781 /nfs/dbraw/zinc/64/37/81/1050643781.db2.gz LHZXCKFBWCLBAZ-JOCQHMNTSA-N -1 3 340.452 4.239 20 0 EIADHM Cc1ccc(NC(=O)Nc2ccc([O-])c(Br)c2)cc1F ZINC001187986230 1050663982 /nfs/dbraw/zinc/66/39/82/1050663982.db2.gz XNZNDGACGYNKBG-UHFFFAOYSA-N -1 3 339.164 4.246 20 0 EIADHM Cc1c2cc(F)ccc2oc1S(=O)(=O)[N-][C@H]1CCCCC1(C)C ZINC001188033355 1050686211 /nfs/dbraw/zinc/68/62/11/1050686211.db2.gz BWCKTTIDJFVOSX-HNNXBMFYSA-N -1 3 339.432 4.127 20 0 EIADHM COc1c(Cl)cc(Cl)cc1C(=O)Nc1ccc(F)c([O-])c1 ZINC001188146628 1050710368 /nfs/dbraw/zinc/71/03/68/1050710368.db2.gz OLQJATBGBRZZMC-UHFFFAOYSA-N -1 3 330.142 4.099 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]CC(C)(C)C2CCCCC2)c(F)c1F ZINC001188345673 1050749396 /nfs/dbraw/zinc/74/93/96/1050749396.db2.gz UQTPUPOLNFILKL-UHFFFAOYSA-N -1 3 345.455 4.158 20 0 EIADHM O=C(NCc1ccco1)c1ccc(Nc2cccc(Cl)c2[O-])cc1 ZINC001174156059 1050796378 /nfs/dbraw/zinc/79/63/78/1050796378.db2.gz AMNUJQYXEMCUAH-UHFFFAOYSA-N -1 3 342.782 4.312 20 0 EIADHM CSc1cc(C)nc(SC)c1NC(=O)c1c(C)cccc1[O-] ZINC001188638025 1050820013 /nfs/dbraw/zinc/82/00/13/1050820013.db2.gz GXZWCLBNWCJGNM-UHFFFAOYSA-N -1 3 334.466 4.100 20 0 EIADHM CSc1cc(C)nc(SC)c1[N-]C(=O)c1c(C)cccc1O ZINC001188638025 1050820014 /nfs/dbraw/zinc/82/00/14/1050820014.db2.gz GXZWCLBNWCJGNM-UHFFFAOYSA-N -1 3 334.466 4.100 20 0 EIADHM Cn1c2ccccc2nc1[C@@H]1CCCCN1Cc1ccc([O-])c(F)c1 ZINC001179970258 1050836012 /nfs/dbraw/zinc/83/60/12/1050836012.db2.gz VCPRZOVXKHXPNF-SFHVURJKSA-N -1 3 339.414 4.145 20 0 EIADHM CC(C)(C)c1nnc([N-]c2cccc(C(=O)Nc3ccccc3)c2)o1 ZINC001174205477 1050840813 /nfs/dbraw/zinc/84/08/13/1050840813.db2.gz RPKDLVKKUGPCJP-UHFFFAOYSA-N -1 3 336.395 4.363 20 0 EIADHM Cc1c(F)cccc1NC(=O)Nc1c([O-])cccc1Br ZINC001189052137 1050894682 /nfs/dbraw/zinc/89/46/82/1050894682.db2.gz QZNCYAGCCUYUKE-UHFFFAOYSA-N -1 3 339.164 4.246 20 0 EIADHM Cc1cc(Cl)cc(CN2CCC(C(=O)c3ccc([O-])cc3)CC2)c1 ZINC001180249136 1050933283 /nfs/dbraw/zinc/93/32/83/1050933283.db2.gz DSRGPMVTUVQMQE-UHFFFAOYSA-N -1 3 343.854 4.449 20 0 EIADHM COc1c(F)cc(NC(=O)c2cc3sccc3c([O-])c2)cc1F ZINC000773849651 1050946367 /nfs/dbraw/zinc/94/63/67/1050946367.db2.gz FIUVNPOJBBOSBE-UHFFFAOYSA-N -1 3 335.331 4.146 20 0 EIADHM Cc1ccc([O-])c(NC(=O)NC(c2ccccc2)c2ccccc2)n1 ZINC001189510102 1051002339 /nfs/dbraw/zinc/00/23/39/1051002339.db2.gz IMENTQQSOLXMIP-UHFFFAOYSA-N -1 3 333.391 4.007 20 0 EIADHM CC(C)(C)c1cccc([N-]S(=O)(=O)/C=C/c2ccc(F)cc2)c1O ZINC000775295671 1051044084 /nfs/dbraw/zinc/04/40/84/1051044084.db2.gz OSEPYRYRKQMJRT-VAWYXSNFSA-N -1 3 349.427 4.241 20 0 EIADHM Cc1cc(C)c(NC(=O)c2cccc(OC(F)(F)F)c2[O-])cc1C ZINC001189765959 1051057009 /nfs/dbraw/zinc/05/70/09/1051057009.db2.gz FWQYJGBTHLCRDF-UHFFFAOYSA-N -1 3 339.313 4.468 20 0 EIADHM O=S(=O)(Cc1ccc(F)cc1F)[N-]c1csc2ccccc12 ZINC001189782286 1051062308 /nfs/dbraw/zinc/06/23/08/1051062308.db2.gz PKGNSKZYKDAKCN-UHFFFAOYSA-N -1 3 339.388 4.121 20 0 EIADHM O=C(Nc1ccc(Br)cc1[O-])c1cc[nH]c1C1CCC1 ZINC000572576115 1051135065 /nfs/dbraw/zinc/13/50/65/1051135065.db2.gz ZZGRHHFWILWFDC-UHFFFAOYSA-N -1 3 335.201 4.003 20 0 EIADHM [O-]c1cccc(Nc2cncc(C(F)(F)F)c2)c1Br ZINC001174745610 1051176258 /nfs/dbraw/zinc/17/62/58/1051176258.db2.gz VDGTVACQPOXDSX-UHFFFAOYSA-N -1 3 333.107 4.312 20 0 EIADHM Cc1ccc(NS(=O)(=O)c2ccc(C3CC3)cc2)c(Cl)c1[O-] ZINC001190500438 1051196415 /nfs/dbraw/zinc/19/64/15/1051196415.db2.gz RHRYKNFVFJNJIT-UHFFFAOYSA-N -1 3 337.828 4.032 20 0 EIADHM CC(C)Cc1ccc([C@@H](C)NC(=O)c2ccc(=O)[n-]c2Cl)cc1 ZINC001190925704 1051301096 /nfs/dbraw/zinc/30/10/96/1051301096.db2.gz CVITWJSNFZLFLC-GFCCVEGCSA-N -1 3 332.831 4.130 20 0 EIADHM CC(C)Cc1ccc([C@H](C)NC(=O)c2ccc(=O)[n-]c2Cl)cc1 ZINC001190925705 1051302168 /nfs/dbraw/zinc/30/21/68/1051302168.db2.gz CVITWJSNFZLFLC-LBPRGKRZSA-N -1 3 332.831 4.130 20 0 EIADHM C[C@H](Oc1cccc(Cl)c1)C(=O)Nc1cc([O-])cc(Cl)c1 ZINC001181780704 1051307470 /nfs/dbraw/zinc/30/74/70/1051307470.db2.gz JZXLGLNHGPNWAX-VIFPVBQESA-N -1 3 326.179 4.105 20 0 EIADHM COc1cc(Br)c(Nc2c(F)cc([O-])cc2F)cc1C ZINC001175099501 1051345556 /nfs/dbraw/zinc/34/55/56/1051345556.db2.gz KDHMDPLTSWRPLT-UHFFFAOYSA-N -1 3 344.155 4.494 20 0 EIADHM [O-]c1cc(F)c(Nc2cc(Br)c(F)cc2F)c(F)c1 ZINC001175100271 1051347135 /nfs/dbraw/zinc/34/71/35/1051347135.db2.gz LHEIQWSXXSMEST-UHFFFAOYSA-N -1 3 336.082 4.455 20 0 EIADHM [O-]c1cc(F)c(Nc2c(F)cccc2OC[C@@H]2CCCO2)c(F)c1 ZINC001175102547 1051349987 /nfs/dbraw/zinc/34/99/87/1051349987.db2.gz OFESQVCLJUTHOK-NSHDSACASA-N -1 3 339.313 4.111 20 0 EIADHM COC(=O)c1ccc(NC(=O)Nc2ccc(C(C)(C)C)cc2)c([O-])c1 ZINC001191151974 1051364346 /nfs/dbraw/zinc/36/43/46/1051364346.db2.gz LPXPZRFGPZXZJY-UHFFFAOYSA-N -1 3 342.395 4.120 20 0 EIADHM CCCCCCOc1ccc([N-]S(=O)(=O)c2cccc(N)c2)cc1 ZINC001175190777 1051416328 /nfs/dbraw/zinc/41/63/28/1051416328.db2.gz TUKMLQOIPXDTSK-UHFFFAOYSA-N -1 3 348.468 4.029 20 0 EIADHM Cc1cccc(Oc2ccccc2NC([O-])=NO[C@H]2CCCCO2)c1 ZINC000775450568 1051426537 /nfs/dbraw/zinc/42/65/37/1051426537.db2.gz OUFFVOMQBCSJBE-SFHVURJKSA-N -1 3 342.395 4.367 20 0 EIADHM Cc1cccc(Oc2ccccc2NC(=O)[N-]O[C@H]2CCCCO2)c1 ZINC000775450568 1051426544 /nfs/dbraw/zinc/42/65/44/1051426544.db2.gz OUFFVOMQBCSJBE-SFHVURJKSA-N -1 3 342.395 4.367 20 0 EIADHM CC1(C)[C@H](C(F)(F)F)CCN1C(=O)c1cc2sccc2c([O-])c1 ZINC000774101493 1051454528 /nfs/dbraw/zinc/45/45/28/1051454528.db2.gz LTYHJCQWLKJJSH-CYBMUJFWSA-N -1 3 343.370 4.410 20 0 EIADHM Cc1cc(=O)[n-]c([C@@H](C)Sc2nnc(-c3ccc(Cl)cc3)o2)n1 ZINC000155877207 1051468831 /nfs/dbraw/zinc/46/88/31/1051468831.db2.gz KYZCVSMJZIFWHK-SECBINFHSA-N -1 3 348.815 4.047 20 0 EIADHM [O-]c1ccc(F)c(Nc2ccc(Cl)nc2Br)c1F ZINC001175262802 1051501466 /nfs/dbraw/zinc/50/14/66/1051501466.db2.gz LQPLPRLVOIOKSU-UHFFFAOYSA-N -1 3 335.535 4.225 20 0 EIADHM Cc1ccc(SCCC(=O)[N-]OCCCC(F)(F)F)cc1C ZINC001175284402 1051484114 /nfs/dbraw/zinc/48/41/14/1051484114.db2.gz JWTCMHNYDVQTKW-UHFFFAOYSA-N -1 3 335.391 4.176 20 0 EIADHM COC(=O)c1oc2cc(F)ccc2c1Nc1c(F)ccc([O-])c1F ZINC001175264575 1051500199 /nfs/dbraw/zinc/50/01/99/1051500199.db2.gz XQTMVAGVEHRINZ-UHFFFAOYSA-N -1 3 337.253 4.086 20 0 EIADHM [O-]c1ccc(F)c(Nc2cc(F)c(Br)c(F)c2)c1F ZINC001175266378 1051502577 /nfs/dbraw/zinc/50/25/77/1051502577.db2.gz ZAMHKMJMDAGDQI-UHFFFAOYSA-N -1 3 336.082 4.455 20 0 EIADHM COc1c(F)cc(Nc2c(F)ccc([O-])c2F)cc1Br ZINC001175269118 1051507860 /nfs/dbraw/zinc/50/78/60/1051507860.db2.gz CMGVTWLFOBJLSN-UHFFFAOYSA-N -1 3 348.118 4.324 20 0 EIADHM Fc1ccc(OC2CCCC2)c(Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC001175431755 1051588177 /nfs/dbraw/zinc/58/81/77/1051588177.db2.gz LZZISTBXPFDGGH-UHFFFAOYSA-N -1 3 339.374 4.071 20 0 EIADHM Cc1ccccc1C(C)(C)C(=O)Nc1cc(Br)ccc1[O-] ZINC001182463418 1051598136 /nfs/dbraw/zinc/59/81/36/1051598136.db2.gz KTZCFVHQOFNLNB-UHFFFAOYSA-N -1 3 348.240 4.379 20 0 EIADHM CC(C)(C)c1ccc(C(=O)N2CC[C@](CF)(C(F)(F)F)C2)c([O-])c1 ZINC001192313843 1051689847 /nfs/dbraw/zinc/68/98/47/1051689847.db2.gz IWJDQSQVYAZQIK-MRXNPFEDSA-N -1 3 347.352 4.054 20 0 EIADHM CSc1ccc(Nc2cc(Br)cc(F)c2[O-])cn1 ZINC001175658086 1051713209 /nfs/dbraw/zinc/71/32/09/1051713209.db2.gz OZAOPMNYYQPGSR-UHFFFAOYSA-N -1 3 329.194 4.154 20 0 EIADHM CCC(C)(C)[C@H](C)[N-]S(=O)(=O)c1c2ncsc2ccc1Cl ZINC001192450900 1051736667 /nfs/dbraw/zinc/73/66/67/1051736667.db2.gz YVOQMXWNVCRBBP-VIFPVBQESA-N -1 3 346.905 4.053 20 0 EIADHM CCN(CC)C(=O)c1ccc(F)c(Nc2cc([O-])c(F)cc2F)c1 ZINC001176069954 1051884494 /nfs/dbraw/zinc/88/44/94/1051884494.db2.gz RZIXLGAAHAGGSF-UHFFFAOYSA-N -1 3 338.329 4.035 20 0 EIADHM O=C(Nc1ccc(F)c([O-])c1)[C@@H](O)c1ccccc1C1CCCCC1 ZINC001183656098 1051885036 /nfs/dbraw/zinc/88/50/36/1051885036.db2.gz MJJRKSNYRNOGON-IBGZPJMESA-N -1 3 343.398 4.251 20 0 EIADHM CC[C@@H](C)Sc1ccc(NC([O-])=NO[C@@H]2CCCCO2)c(C)c1 ZINC000775581692 1051890175 /nfs/dbraw/zinc/89/01/75/1051890175.db2.gz INJUTYGRWDRXMS-CZUORRHYSA-N -1 3 338.473 4.465 20 0 EIADHM CC[C@@H](C)Sc1ccc(NC(=O)[N-]O[C@@H]2CCCCO2)c(C)c1 ZINC000775581692 1051890183 /nfs/dbraw/zinc/89/01/83/1051890183.db2.gz INJUTYGRWDRXMS-CZUORRHYSA-N -1 3 338.473 4.465 20 0 EIADHM C[C@H]1CN(C(=O)c2cc(CCc3ccccc3)ccc2[O-])C(C)(C)C1 ZINC001176113948 1051917519 /nfs/dbraw/zinc/91/75/19/1051917519.db2.gz FZTZPHGQDJMHSY-MRXNPFEDSA-N -1 3 337.463 4.438 20 0 EIADHM O=C([N-]OC1CCCC1)[C@@H]1CC=CC[C@@H]1c1nc2ccccc2s1 ZINC000775599086 1051927771 /nfs/dbraw/zinc/92/77/71/1051927771.db2.gz BVJFRQNFFZDMGW-CABCVRRESA-N -1 3 342.464 4.337 20 0 EIADHM CCCCOc1ccc(C(=O)NCC2C[C@H](C)C[C@@H](C)C2)c([O-])c1 ZINC001183953059 1051931997 /nfs/dbraw/zinc/93/19/97/1051931997.db2.gz YCXAQKDXGIBQFQ-HUUCEWRRSA-N -1 3 333.472 4.373 20 0 EIADHM CN(C)C(=O)c1ccc([N-]c2nc3cc(Cl)ccc3o2)c(F)c1 ZINC001176196868 1051942328 /nfs/dbraw/zinc/94/23/28/1051942328.db2.gz IDJDFBJRBOQYMH-UHFFFAOYSA-N -1 3 333.750 4.066 20 0 EIADHM CN(C)C(=O)c1cc(Nc2cccc(Cl)c2[O-])ccc1Cl ZINC001176154984 1051943646 /nfs/dbraw/zinc/94/36/46/1051943646.db2.gz JUIXZKKCJRTBHB-UHFFFAOYSA-N -1 3 325.195 4.144 20 0 EIADHM C[C@H]1C[C@@H](NC(=O)c2ccc([O-])cc2C(F)(F)F)c2ccccc21 ZINC001193758053 1051992629 /nfs/dbraw/zinc/99/26/29/1051992629.db2.gz JXJUQPGZJMOBFX-MGPLVRAMSA-N -1 3 335.325 4.389 20 0 EIADHM O=c1cc(Nc2ccc(O)cc2C(F)(F)F)[n-]n1-c1ccccc1 ZINC001176338485 1051996258 /nfs/dbraw/zinc/99/62/58/1051996258.db2.gz DZXWVKXTZDAUGX-UHFFFAOYSA-N -1 3 335.285 4.046 20 0 EIADHM [O-]c1c(F)cc(Nc2cccc3c2cnn3[C@@H]2CCCCO2)cc1F ZINC001176315370 1052020868 /nfs/dbraw/zinc/02/08/68/1052020868.db2.gz GRWJIYKEXAMJFH-KRWDZBQOSA-N -1 3 345.349 4.463 20 0 EIADHM [O-]c1cccc(Nc2c(F)cc(F)c(F)c2F)c1Br ZINC001176352169 1052033877 /nfs/dbraw/zinc/03/38/77/1052033877.db2.gz BUXZZHWFKLIVSV-UHFFFAOYSA-N -1 3 336.082 4.455 20 0 EIADHM C[C@@H](CCCC(F)(F)F)NC(=O)c1cc([O-])cc(C(F)(F)F)c1 ZINC000621973092 1052057738 /nfs/dbraw/zinc/05/77/38/1052057738.db2.gz BHKSZFQJQIHOCO-QMMMGPOBSA-N -1 3 343.267 4.262 20 0 EIADHM CCN(CC)C(=O)c1cc(Nc2cccc([O-])c2Cl)ccc1F ZINC001176517828 1052105212 /nfs/dbraw/zinc/10/52/12/1052105212.db2.gz OTAGEXIGRGAFPO-UHFFFAOYSA-N -1 3 336.794 4.410 20 0 EIADHM O=C([N-]c1cc(Cl)cc2ncoc21)c1ccc(C(F)(F)F)o1 ZINC001194418665 1052145097 /nfs/dbraw/zinc/14/50/97/1052145097.db2.gz XVESJUOZHDZHFK-UHFFFAOYSA-N -1 3 330.649 4.345 20 0 EIADHM CC(=O)c1cccc([O-])c1NC(=O)CC1(c2cccc(C)c2)CCC1 ZINC001185087376 1052162774 /nfs/dbraw/zinc/16/27/74/1052162774.db2.gz BSTJFCXZDNEAHX-UHFFFAOYSA-N -1 3 337.419 4.354 20 0 EIADHM Cc1cc([N-]S(=O)(=O)Cc2cc(F)cc(F)c2)c(F)cc1Cl ZINC001185137304 1052174803 /nfs/dbraw/zinc/17/48/03/1052174803.db2.gz ARMOEGFUZSYISX-UHFFFAOYSA-N -1 3 349.761 4.008 20 0 EIADHM Cc1cccc(C)c1S(=O)(=O)[N-]c1c(Cl)ccc2cccnc21 ZINC001194643812 1052185714 /nfs/dbraw/zinc/18/57/14/1052185714.db2.gz OAOGGEJDWKCHKJ-UHFFFAOYSA-N -1 3 346.839 4.306 20 0 EIADHM CCN(C(=O)c1cc([O-])cc(C(F)(F)F)c1)c1ccccc1OC ZINC000622334536 1052215102 /nfs/dbraw/zinc/21/51/02/1052215102.db2.gz QATOYAGAWCWVBJ-UHFFFAOYSA-N -1 3 339.313 4.086 20 0 EIADHM CC(C)(C)C[C@H]1CCCN1C(=O)c1cc([O-])cc(C(F)(F)F)c1 ZINC000622337237 1052215241 /nfs/dbraw/zinc/21/52/41/1052215241.db2.gz QSFLQZAENKSIGM-CYBMUJFWSA-N -1 3 329.362 4.452 20 0 EIADHM CCc1ccc(C(=O)N(C)[C@H](CC)Cc2ccc(C)cc2)c([O-])c1 ZINC000622397058 1052251781 /nfs/dbraw/zinc/25/17/81/1052251781.db2.gz ZZYGYDMHWZNHCG-GOSISDBHSA-N -1 3 325.452 4.356 20 0 EIADHM Cc1cc(S(=O)(=O)[N-]c2ccc(Cl)cc2F)ccc1Cl ZINC001185521084 1052255604 /nfs/dbraw/zinc/25/56/04/1052255604.db2.gz NAKZUPAIFSGWRI-UHFFFAOYSA-N -1 3 334.199 4.242 20 0 EIADHM C[C@H](NCc1ccccc1F)c1cc(Br)cc(F)c1[O-] ZINC000184855854 1052265957 /nfs/dbraw/zinc/26/59/57/1052265957.db2.gz HIUVLZIYVMOUFW-VIFPVBQESA-N -1 3 342.183 4.284 20 0 EIADHM CC(C)C[C@@H]1CCCCN1C(=O)c1cc([O-])cc(C(F)(F)F)c1 ZINC000622431470 1052267512 /nfs/dbraw/zinc/26/75/12/1052267512.db2.gz CHYMNFRDNRIOSL-AWEZNQCLSA-N -1 3 329.362 4.452 20 0 EIADHM CCc1ncsc1NC(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000622455298 1052273667 /nfs/dbraw/zinc/27/36/67/1052273667.db2.gz MUADSQQXZFZCNI-UHFFFAOYSA-N -1 3 338.432 4.254 20 0 EIADHM C[C@@H](NC(=O)NCc1ccc([O-])c(F)c1)c1cc2ccccc2s1 ZINC000172586042 1052506017 /nfs/dbraw/zinc/50/60/17/1052506017.db2.gz JHFBTFQDRFRMOE-LLVKDONJSA-N -1 3 344.411 4.306 20 0 EIADHM Cc1nn(C)c2sc(C(=O)[N-]c3c(F)cc(Cl)cc3F)cc12 ZINC000180360516 1052796681 /nfs/dbraw/zinc/79/66/81/1052796681.db2.gz ZNLDELWLIZWKKH-UHFFFAOYSA-N -1 3 341.770 4.127 20 0 EIADHM CCc1cc(=O)[n-]c(CN[C@H](C)c2ccc(SC(C)C)cc2)n1 ZINC000182099166 1052913864 /nfs/dbraw/zinc/91/38/64/1052913864.db2.gz OLSSPISBMGWKKQ-CYBMUJFWSA-N -1 3 331.485 4.096 20 0 EIADHM Cc1nc(C(=O)Nc2cc(Cl)ccc2[O-])c(-c2ccccc2)o1 ZINC000184012535 1052989623 /nfs/dbraw/zinc/98/96/23/1052989623.db2.gz IBQLHKNCKSJCGD-UHFFFAOYSA-N -1 3 328.755 4.261 20 0 EIADHM Cc1nn(-c2ccc(Cl)cc2)c(Cl)c1C=Cc1nccc(=O)[n-]1 ZINC000764433890 1053100786 /nfs/dbraw/zinc/10/07/86/1053100786.db2.gz GWEDZMIYLKHLBV-VOTSOKGWSA-N -1 3 347.205 4.154 20 0 EIADHM O=c1ccnc(C=Cc2ccc(-c3ccc(Br)cc3)o2)[n-]1 ZINC000764433170 1053101166 /nfs/dbraw/zinc/10/11/66/1053101166.db2.gz DHSNTPUOGRUDOM-VURMDHGXSA-N -1 3 343.180 4.375 20 0 EIADHM Cc1ccc(-n2cc(C=Cc3nccc(=O)[n-]3)c(C(C)(C)C)n2)cc1 ZINC000764436928 1053103869 /nfs/dbraw/zinc/10/38/69/1053103869.db2.gz XXYYGHPLSSVKJO-JXMROGBWSA-N -1 3 334.423 4.144 20 0 EIADHM COc1cc(C)c(S(=O)(=O)[N-]c2ccc3c(c2)N=NC3)c(C)c1C ZINC001194865936 1053133424 /nfs/dbraw/zinc/13/34/24/1053133424.db2.gz AAEWIMAHDYPSBX-UHFFFAOYSA-N -1 3 345.424 4.019 20 0 EIADHM CC(C)c1cccc(S(=O)(=O)[N-]c2cc(Cl)cnc2Cl)c1 ZINC001195117038 1053278319 /nfs/dbraw/zinc/27/83/19/1053278319.db2.gz WJPKEINJWLSLSS-UHFFFAOYSA-N -1 3 345.251 4.313 20 0 EIADHM CCc1nnc([N-]C(=O)c2c(Cl)ccc(Cl)c2Cl)s1 ZINC000005658757 1053323986 /nfs/dbraw/zinc/32/39/86/1053323986.db2.gz TXWLEYYQJPIPAH-UHFFFAOYSA-N -1 3 336.631 4.313 20 0 EIADHM Cc1cccc(Cl)c1S(=O)(=O)[N-]c1cccc(F)c1Cl ZINC001195308120 1053370160 /nfs/dbraw/zinc/37/01/60/1053370160.db2.gz HMXBMEHWOQJHKB-UHFFFAOYSA-N -1 3 334.199 4.242 20 0 EIADHM Cc1cc(Cl)c([N-]S(=O)(=O)c2c(C)cccc2Cl)cc1O ZINC001195317087 1053374365 /nfs/dbraw/zinc/37/43/65/1053374365.db2.gz NWEPRCMQFKQBOP-UHFFFAOYSA-N -1 3 346.235 4.117 20 0 EIADHM Cc1cc(=O)[n-]c(-c2cccc(OC(=O)C3CCC4(CC4)CC3)c2)n1 ZINC000850860448 1053375246 /nfs/dbraw/zinc/37/52/46/1053375246.db2.gz IFYBHNQIECNVEQ-UHFFFAOYSA-N -1 3 338.407 4.033 20 0 EIADHM O=S(=O)([N-]c1ccc(C2CCCCC2)cc1)c1ccc(O)cc1 ZINC001195755566 1053472767 /nfs/dbraw/zinc/47/27/67/1053472767.db2.gz TYVXKYFXXFKKFG-UHFFFAOYSA-N -1 3 331.437 4.241 20 0 EIADHM O=S(=O)(Nc1ccc(C2CCCCC2)cc1)c1ccc([O-])cc1 ZINC001195755566 1053472772 /nfs/dbraw/zinc/47/27/72/1053472772.db2.gz TYVXKYFXXFKKFG-UHFFFAOYSA-N -1 3 331.437 4.241 20 0 EIADHM CC(C)Cc1nnc([N-]C(=O)c2cc3cc(Cl)ccc3o2)s1 ZINC000019200632 1053715033 /nfs/dbraw/zinc/71/50/33/1053715033.db2.gz ZFVVROIONXLIPN-UHFFFAOYSA-N -1 3 335.816 4.389 20 0 EIADHM CC(=O)c1ccc(C(=O)[N-]c2nnc(C3CCCCC3)s2)c(F)c1 ZINC000776752932 1053836915 /nfs/dbraw/zinc/83/69/15/1053836915.db2.gz LVCUJEYYBJILJY-UHFFFAOYSA-N -1 3 347.415 4.180 20 0 EIADHM CC(C)Oc1c(Cl)cc(C(=O)Nc2ncccc2[O-])cc1Cl ZINC001197191674 1053849369 /nfs/dbraw/zinc/84/93/69/1053849369.db2.gz IMIFLUOKDPMXSG-UHFFFAOYSA-N -1 3 341.194 4.134 20 0 EIADHM CC(C)C(=O)Nc1cccc(OC(=O)c2cc(Cl)c(Cl)[n-]2)c1 ZINC000112931587 1053868888 /nfs/dbraw/zinc/86/88/88/1053868888.db2.gz BDKYSHKKPMKVBQ-UHFFFAOYSA-N -1 3 341.194 4.135 20 0 EIADHM CC(C)Oc1ncc(Cl)cc1Nc1cc(=O)n(-c2ccccc2)[n-]1 ZINC001203311331 1053920060 /nfs/dbraw/zinc/92/00/60/1053920060.db2.gz MEGYMNZBXWDMHL-UHFFFAOYSA-N -1 3 344.802 4.157 20 0 EIADHM C[C@@]1(C[N-]C(=O)C(F)(F)c2cc(Cl)ccc2Cl)CC1(F)F ZINC000855796208 1053976070 /nfs/dbraw/zinc/97/60/70/1053976070.db2.gz RDLWDJFTLVNKJJ-NSHDSACASA-N -1 3 344.135 4.247 20 0 EIADHM Cc1cccc(N)c1NC(=O)c1cc(OCc2ccccc2)ccc1[O-] ZINC001197723006 1053982410 /nfs/dbraw/zinc/98/24/10/1053982410.db2.gz IIHRXLXACSDVLT-UHFFFAOYSA-N -1 3 348.402 4.114 20 0 EIADHM CCCOc1ccc(S(=O)(=O)[N-]c2ccc(F)c(Cl)c2)cc1 ZINC000029046462 1053988144 /nfs/dbraw/zinc/98/81/44/1053988144.db2.gz CZSZQARANBFDJQ-UHFFFAOYSA-N -1 3 343.807 4.069 20 0 EIADHM [O-]c1cccc(F)c1NC(=S)Nc1ccccc1Br ZINC001197783616 1053995635 /nfs/dbraw/zinc/99/56/35/1053995635.db2.gz QZKDYHVTJZRUQG-UHFFFAOYSA-N -1 3 341.205 4.103 20 0 EIADHM O=C(c1cc2sccc2c([O-])c1)N1CCC[C@H]([C@@H]2CCCCO2)C1 ZINC000855954963 1054001736 /nfs/dbraw/zinc/00/17/36/1054001736.db2.gz NJZVZQRTYAWVDM-GUYCJALGSA-N -1 3 345.464 4.028 20 0 EIADHM CCc1cc2c(CSc3ncccc3Cl)cc(=O)oc2cc1[O-] ZINC000011033940 1054074725 /nfs/dbraw/zinc/07/47/25/1054074725.db2.gz YWLVFYDFFHSMKJ-UHFFFAOYSA-N -1 3 347.823 4.402 20 0 EIADHM C[C@H]([N-]S(=O)(=O)c1cc(Cl)sc1Cl)c1ccccc1 ZINC000032548412 1054104632 /nfs/dbraw/zinc/10/46/32/1054104632.db2.gz ODMHKYAXHUGTRA-QMMMGPOBSA-N -1 3 336.265 4.094 20 0 EIADHM Cc1cccc(C)c1NC(=S)Nc1nc2c(cccc2[O-])s1 ZINC001198322465 1054124857 /nfs/dbraw/zinc/12/48/57/1054124857.db2.gz RBRGKSCOIIVFNP-UHFFFAOYSA-N -1 3 329.450 4.428 20 0 EIADHM C[C@@H](CC(=O)[N-]OCCCC(F)(F)F)c1c[nH]c2ccccc21 ZINC000871215393 1054170525 /nfs/dbraw/zinc/17/05/25/1054170525.db2.gz AIJZVFNYMJXXQW-NSHDSACASA-N -1 3 328.334 4.052 20 0 EIADHM CN(C(=O)c1cc([O-])c2ccccc2c1)[C@H]1CCc2ccccc2C1 ZINC000472151866 1054216772 /nfs/dbraw/zinc/21/67/72/1054216772.db2.gz HBOSGIOKHCTVAB-IBGZPJMESA-N -1 3 331.415 4.175 20 0 EIADHM C[C@@H]1CN(C(=O)c2cc([O-])c3ccccc3c2)c2ccc(F)cc2O1 ZINC000472205432 1054246547 /nfs/dbraw/zinc/24/65/47/1054246547.db2.gz KCDSBSHXWJUMIZ-GFCCVEGCSA-N -1 3 337.350 4.112 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N1CCC[C@@H](Nc2ccccc2)C1 ZINC000472342989 1054287016 /nfs/dbraw/zinc/28/70/16/1054287016.db2.gz UDHHBGLLWPFLPE-LJQANCHMSA-N -1 3 346.430 4.262 20 0 EIADHM O=S(=O)([N-]c1ccc(Cl)cc1F)c1ccc2occc2c1 ZINC001198860793 1054287806 /nfs/dbraw/zinc/28/78/06/1054287806.db2.gz CRHSLGMFADAHKF-UHFFFAOYSA-N -1 3 325.748 4.026 20 0 EIADHM CON(Cc1ccc(Cl)cc1)C(=O)c1ccc(C(C)C)cc1[O-] ZINC000857511160 1054288941 /nfs/dbraw/zinc/28/89/41/1054288941.db2.gz YUCBBFSLDMMNSU-UHFFFAOYSA-N -1 3 333.815 4.373 20 0 EIADHM CSc1ccc([N-]S(=O)(=O)c2ccc3occc3c2)c(F)c1 ZINC001198871182 1054296236 /nfs/dbraw/zinc/29/62/36/1054296236.db2.gz YUXAIMBGIBDKCI-UHFFFAOYSA-N -1 3 337.397 4.095 20 0 EIADHM O=C(Nc1cccc(-c2ncco2)c1)c1cc([O-])c2ccccc2c1 ZINC000472433141 1054322449 /nfs/dbraw/zinc/32/24/49/1054322449.db2.gz RRWIUAARKSNJBH-UHFFFAOYSA-N -1 3 330.343 4.453 20 0 EIADHM CC(C)CC(=O)Nc1cccc(CN[C@@H](C)c2cccc([O-])c2F)c1 ZINC000872027620 1054344631 /nfs/dbraw/zinc/34/46/31/1054344631.db2.gz MGWFWSKXFQGJLL-AWEZNQCLSA-N -1 3 344.430 4.367 20 0 EIADHM CCOCCOc1cc(C)ccc1CN[C@@H](C)c1cccc([O-])c1F ZINC000872042754 1054355422 /nfs/dbraw/zinc/35/54/22/1054355422.db2.gz SDHFIVAXNIRHPJ-HNNXBMFYSA-N -1 3 347.430 4.106 20 0 EIADHM C[C@@H](Nc1cccc(N2CCCCC2=O)c1)c1cccc([O-])c1F ZINC000872054766 1054365834 /nfs/dbraw/zinc/36/58/34/1054365834.db2.gz ATTOLPURQQHXPS-CYBMUJFWSA-N -1 3 328.387 4.221 20 0 EIADHM Cc1ccc(C(=O)N2CCC(Oc3ccc(C)c(C)c3)CC2)c([O-])c1 ZINC000046398407 1054379943 /nfs/dbraw/zinc/37/99/43/1054379943.db2.gz CENNSKYLWDHAKT-UHFFFAOYSA-N -1 3 339.435 4.001 20 0 EIADHM CC[C@@H](N[C@H](C)c1cccc([O-])c1F)c1cccc(OC)c1OC ZINC000872092455 1054387640 /nfs/dbraw/zinc/38/76/40/1054387640.db2.gz NPFMRCCQLGYZRF-IUODEOHRSA-N -1 3 333.403 4.350 20 0 EIADHM O=C([O-])c1ccc(CN2CCC(c3cccc(F)c3)CC2)c(F)c1 ZINC000872165236 1054418234 /nfs/dbraw/zinc/41/82/34/1054418234.db2.gz CGSGLKYRAYAFTO-UHFFFAOYSA-N -1 3 331.362 4.043 20 0 EIADHM CCCC[C@@H](C)C(=O)Nc1cccc(-c2nc(CC)cc(=O)[n-]2)c1 ZINC000282182445 1054502261 /nfs/dbraw/zinc/50/22/61/1054502261.db2.gz ORNSXBCCVIOGCG-CYBMUJFWSA-N -1 3 327.428 4.176 20 0 EIADHM [O-]c1cccc2sc(NC(=S)Nc3ccc(F)cc3F)nc21 ZINC001200917796 1054575374 /nfs/dbraw/zinc/57/53/74/1054575374.db2.gz KVULNHYFKVWVRX-UHFFFAOYSA-N -1 3 337.376 4.089 20 0 EIADHM CCC[C@@H](CC)C(=O)Nc1cccc(-c2nc(CC)cc(=O)[n-]2)c1 ZINC000874072611 1054619181 /nfs/dbraw/zinc/61/91/81/1054619181.db2.gz TWVUZLPYPXHPQK-CYBMUJFWSA-N -1 3 327.428 4.176 20 0 EIADHM CSc1ccc(NC(=S)Nc2c([O-])cccc2C(C)=O)cc1 ZINC001201186689 1054709836 /nfs/dbraw/zinc/70/98/36/1054709836.db2.gz OHOREGJQJHURHZ-UHFFFAOYSA-N -1 3 332.450 4.126 20 0 EIADHM [O-]c1cc(Cl)c(Nc2cnn(Cc3ccccn3)c2)cc1Cl ZINC001201419673 1054792873 /nfs/dbraw/zinc/79/28/73/1054792873.db2.gz MRMGAEDGPWVVFM-UHFFFAOYSA-N -1 3 335.194 4.082 20 0 EIADHM Cc1nc(-c2ccc(C)cc2C)sc1C(=O)Nc1ncccc1[O-] ZINC000063809061 1054835733 /nfs/dbraw/zinc/83/57/33/1054835733.db2.gz VJVNONLRTFXUFX-UHFFFAOYSA-N -1 3 339.420 4.088 20 0 EIADHM O=c1[nH]c2ccccc2cc1Nc1cccc([O-])c1Br ZINC001201760898 1054900583 /nfs/dbraw/zinc/90/05/83/1054900583.db2.gz JTYWKGQBUAXFKD-UHFFFAOYSA-N -1 3 331.169 4.152 20 0 EIADHM O=C(Nc1cc(=O)[n-]c(C2CC2)n1)Nc1ccc(Cl)cc1Cl ZINC001202072138 1055012051 /nfs/dbraw/zinc/01/20/51/1055012051.db2.gz FNJYABNEDNTYOG-UHFFFAOYSA-N -1 3 339.182 4.010 20 0 EIADHM O=C(Nc1ccc(Cl)cc1Cl)Nc1ncc([O-])cc1Cl ZINC001202073927 1055035739 /nfs/dbraw/zinc/03/57/39/1055035739.db2.gz RGEKVCAETGGOJR-UHFFFAOYSA-N -1 3 332.574 4.391 20 0 EIADHM COc1ccccc1NC(=O)[N-]c1cc(-c2ccc(F)c(F)c2)no1 ZINC001202113135 1055055846 /nfs/dbraw/zinc/05/58/46/1055055846.db2.gz GRBZAFLINXNEGR-UHFFFAOYSA-N -1 3 345.305 4.272 20 0 EIADHM O=C(Nc1ccc(Cl)cc1)Nc1c([O-])cccc1Br ZINC001202375593 1055154842 /nfs/dbraw/zinc/15/48/42/1055154842.db2.gz CEHOBRCAHVRENY-UHFFFAOYSA-N -1 3 341.592 4.452 20 0 EIADHM C[C@H]1CCN(Cc2nnc(-c3ccccc3[O-])o2)[C@@H](c2ccco2)C1 ZINC000878151858 1055195723 /nfs/dbraw/zinc/19/57/23/1055195723.db2.gz DOFZQVCPRYDKIA-DZGCQCFKSA-N -1 3 339.395 4.008 20 0 EIADHM CC(C)Cc1nnc([N-]C(=O)c2sccc2SC(F)F)s1 ZINC000107102130 1055208446 /nfs/dbraw/zinc/20/84/46/1055208446.db2.gz FHGPSTCWOZDYOA-UHFFFAOYSA-N -1 3 349.453 4.365 20 0 EIADHM CCc1cc2c(CSc3ccccc3F)cc(=O)oc2cc1[O-] ZINC000006404684 1055252810 /nfs/dbraw/zinc/25/28/10/1055252810.db2.gz IFRZEUUBVBXVFG-UHFFFAOYSA-N -1 3 330.380 4.492 20 0 EIADHM COCCOc1ccc(N[C@@H](C)c2ccc(F)cc2[O-])cc1Cl ZINC000186286070 1055323540 /nfs/dbraw/zinc/32/35/40/1055323540.db2.gz ABXALSUDIIRDON-NSHDSACASA-N -1 3 339.794 4.383 20 0 EIADHM CC[C@@](C)([N-]C(=O)C(F)(F)c1ccccc1F)c1nc(C)cs1 ZINC000765830496 1055809492 /nfs/dbraw/zinc/80/94/92/1055809492.db2.gz DEQXEOBINWYKHR-OAHLLOKOSA-N -1 3 342.386 4.124 20 0 EIADHM Cc1ccc(Cl)c(O[C@@H](C)C(=O)Nc2cc(Cl)ccc2[O-])c1 ZINC000111210351 1056772394 /nfs/dbraw/zinc/77/23/94/1056772394.db2.gz OLWJCCPFOJOBJK-JTQLQIEISA-N -1 3 340.206 4.413 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1cccn1Cc1ccccc1 ZINC000111211158 1056774493 /nfs/dbraw/zinc/77/44/93/1056774493.db2.gz LPRLYEWGQZGMBE-UHFFFAOYSA-N -1 3 326.783 4.148 20 0 EIADHM Cc1cc(CO[N-]C(=O)CCCc2ccccc2)c2ccccc2n1 ZINC000742356375 1058569831 /nfs/dbraw/zinc/56/98/31/1058569831.db2.gz NJNROLJIJIIBKN-UHFFFAOYSA-N -1 3 334.419 4.114 20 0 EIADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)C=C(C)C(C)(C)C)c2)n1 ZINC000742548292 1058669701 /nfs/dbraw/zinc/66/97/01/1058669701.db2.gz CCMKBWLQWCNBKE-RAXLEYEMSA-N -1 3 339.439 4.343 20 0 EIADHM Cc1cc(=O)[n-]c(-c2cccc(OC(=O)C[C@H](C)CC(C)C)c2)n1 ZINC000744217732 1059334598 /nfs/dbraw/zinc/33/45/98/1059334598.db2.gz OLPLGVSQTLSNQU-CYBMUJFWSA-N -1 3 328.412 4.135 20 0 EIADHM C[C@H](OC(=O)c1cc2ccsc2[n-]1)c1nc(-c2ccccc2)no1 ZINC000744542176 1059573394 /nfs/dbraw/zinc/57/33/94/1059573394.db2.gz KVZYYQKJVDTXKJ-JTQLQIEISA-N -1 3 339.376 4.197 20 0 EIADHM C[C@H]1CCC[C@@H](OCCCCCC(=O)[N-]OCc2ccccc2)C1 ZINC000766329482 1059821142 /nfs/dbraw/zinc/82/11/42/1059821142.db2.gz MVNKYJJQCWHXQS-PKOBYXMFSA-N -1 3 333.472 4.390 20 0 EIADHM CCc1ccc(O)c([N-]S(=O)(=O)/C=C\c2ccc(Cl)cc2)c1 ZINC000746368348 1060252138 /nfs/dbraw/zinc/25/21/38/1060252138.db2.gz VEVDGFAHMZXRRK-KTKRTIGZSA-N -1 3 337.828 4.021 20 0 EIADHM O=C(N[C@H]1C[C@H](Sc2ccccc2)C1)c1cc([O-])ccc1Cl ZINC001169269595 1060752381 /nfs/dbraw/zinc/75/23/81/1060752381.db2.gz VXJUXMJYZALKPF-YEORSEQZSA-N -1 3 333.840 4.099 20 0 EIADHM COc1cc(Br)c(C)nc1Nc1ccc(Cl)c([O-])c1 ZINC001212591241 1060856663 /nfs/dbraw/zinc/85/66/63/1060856663.db2.gz CAVXIESOXSCEFQ-UHFFFAOYSA-N -1 3 343.608 4.264 20 0 EIADHM CCOC(=O)c1sc(Nc2ccc(Cl)c([O-])c2)nc1C1CC1 ZINC001212591424 1060857805 /nfs/dbraw/zinc/85/78/05/1060857805.db2.gz MDUKRYQXJRYFIP-UHFFFAOYSA-N -1 3 338.816 4.300 20 0 EIADHM COC(=O)c1sc2ccncc2c1Nc1ccc(Cl)c([O-])c1 ZINC001212591600 1060858600 /nfs/dbraw/zinc/85/86/00/1060858600.db2.gz VBIIFITYDIQYFB-UHFFFAOYSA-N -1 3 334.784 4.186 20 0 EIADHM [O-]c1cc(Nc2ccccc2I)ccc1Cl ZINC001212592187 1060881355 /nfs/dbraw/zinc/88/13/55/1060881355.db2.gz COQYNDDYZHYGDT-UHFFFAOYSA-N -1 3 345.567 4.394 20 0 EIADHM COCCCOc1ccc(Nc2ccc(Cl)c([O-])c2)cc1F ZINC001212592619 1060891169 /nfs/dbraw/zinc/89/11/69/1060891169.db2.gz YYRREIDHVAIQNO-UHFFFAOYSA-N -1 3 325.767 4.344 20 0 EIADHM [O-]c1cc(Nc2ccc(N3CCOCC3)c(Cl)c2)ccc1Cl ZINC001212592489 1060891212 /nfs/dbraw/zinc/89/12/12/1060891212.db2.gz SMTCFDCHYYHHCX-UHFFFAOYSA-N -1 3 339.222 4.279 20 0 EIADHM [O-]c1cc(Nc2cc(F)ccc2OC[C@H]2CCCO2)ccc1Cl ZINC001212592514 1060891483 /nfs/dbraw/zinc/89/14/83/1060891483.db2.gz UICWCRPQJVHLGC-CYBMUJFWSA-N -1 3 337.778 4.486 20 0 EIADHM O=C(Nc1cccnc1)c1cccc(Nc2ccc(Cl)c([O-])c2)c1 ZINC001212593574 1060898444 /nfs/dbraw/zinc/89/84/44/1060898444.db2.gz YHHKVTJBAPASJE-UHFFFAOYSA-N -1 3 339.782 4.437 20 0 EIADHM [O-]c1cccnc1CNc1ccc(-c2ccc3ccccc3c2)nn1 ZINC001169732414 1060933828 /nfs/dbraw/zinc/93/38/28/1060933828.db2.gz WPRVZPQYGBJNGJ-UHFFFAOYSA-N -1 3 328.375 4.010 20 0 EIADHM [O-]c1cccnc1CNc1nnc(-c2cccs2)c2ccccc21 ZINC001169733959 1060936282 /nfs/dbraw/zinc/93/62/82/1060936282.db2.gz RSAMNRSDTJUHSY-UHFFFAOYSA-N -1 3 334.404 4.071 20 0 EIADHM CC(C)[C@H]1CN(Cc2nnc(-c3ccccc3[O-])o2)c2ccccc21 ZINC001169907806 1061030248 /nfs/dbraw/zinc/03/02/48/1061030248.db2.gz KTGWYRFJLRBIIO-MRXNPFEDSA-N -1 3 335.407 4.202 20 0 EIADHM O=c1[n-]c(CN2CCC[C@H]2C2CCCC2)nc2c3ccccc3oc21 ZINC000055927797 214349144 /nfs/dbraw/zinc/34/91/44/214349144.db2.gz GCINRYOYZMWGEI-HNNXBMFYSA-N -1 3 337.423 4.236 20 0 EIADHM CC[C@@H](C)c1ccc(S(=O)(=O)[N-]c2ccc(F)cc2F)cc1 ZINC000014254694 211724510 /nfs/dbraw/zinc/72/45/10/211724510.db2.gz BUWJGWBMKAJGDF-LLVKDONJSA-N -1 3 325.380 4.279 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1cccc(OCC(F)(F)F)c1 ZINC000532901116 1032392289 /nfs/dbraw/zinc/39/22/89/1032392289.db2.gz VJXUACZKCKNKBH-UHFFFAOYSA-N -1 3 345.704 4.239 20 0 EIADHM CC(C)c1ccc2c(c1)[C@@H](NC(=O)c1cc(=O)c3ccccc3[n-]1)CC2 ZINC000428523962 1032411673 /nfs/dbraw/zinc/41/16/73/1032411673.db2.gz HXEBEAFPOVLHLK-IBGZPJMESA-N -1 3 346.430 4.069 20 0 EIADHM CSc1cc(O)ccc1[N-]C(=O)c1ncoc1-c1ccccc1 ZINC000683138689 1018893065 /nfs/dbraw/zinc/89/30/65/1018893065.db2.gz ZPXSVHZFGVDSAJ-UHFFFAOYSA-N -1 3 326.377 4.021 20 0 EIADHM C[C@H](CCC[C@H](C)C(=O)[O-])NCc1c(Cl)cccc1OC(F)F ZINC000683170302 1019084302 /nfs/dbraw/zinc/08/43/02/1019084302.db2.gz JDVXVQBTXLLWMR-WDEREUQCSA-N -1 3 349.805 4.311 20 0 EIADHM O=C([O-])c1cccc(CNCc2ccc(Cl)c(C(F)(F)F)c2)c1 ZINC000683176945 1019116904 /nfs/dbraw/zinc/11/69/04/1019116904.db2.gz YMKGJAWLURTYHE-UHFFFAOYSA-N -1 3 343.732 4.347 20 0 EIADHM CC(C)[C@@H]1CCc2nc([N-]C(=O)c3ocnc3C(F)F)sc2C1 ZINC000890592777 1019473463 /nfs/dbraw/zinc/47/34/63/1019473463.db2.gz FGFJRQIIIICFPF-MRVPVSSYSA-N -1 3 341.383 4.082 20 0 EIADHM O=C(N[C@@H]1CC[C@H](c2ccc(F)cc2)C1)c1cc([O-])ccc1Cl ZINC000510154989 1020030133 /nfs/dbraw/zinc/03/01/33/1020030133.db2.gz SSQUHONJEKDJCA-GXTWGEPZSA-N -1 3 333.790 4.251 20 0 EIADHM CC1(C)C[C@H](NC(=O)c2cc([O-])ccc2Cl)c2cc(F)ccc2O1 ZINC000652820052 1020567588 /nfs/dbraw/zinc/56/75/88/1020567588.db2.gz RTUPPWLSWMVSGS-HNNXBMFYSA-N -1 3 349.789 4.217 20 0 EIADHM CCOc1ccc(F)c([N-]C(=O)c2cc3nc(C)ccc3o2)c1F ZINC000340423761 1021001030 /nfs/dbraw/zinc/00/10/30/1021001030.db2.gz APHUCSGYJCVJSE-UHFFFAOYSA-N -1 3 332.306 4.065 20 0 EIADHM C[C@@H]1CCN(Cc2cc(Br)ccc2C(=O)[O-])CC1(C)C ZINC000579967338 1021035359 /nfs/dbraw/zinc/03/53/59/1021035359.db2.gz DNVXQOZHVOEZMP-LLVKDONJSA-N -1 3 340.261 4.015 20 0 EIADHM O=C(CCCOc1ccc(F)cc1F)Nc1cc(Cl)ccc1[O-] ZINC000063583071 1021430895 /nfs/dbraw/zinc/43/08/95/1021430895.db2.gz JPUYYWMGUNUQDY-UHFFFAOYSA-N -1 3 341.741 4.122 20 0 EIADHM Cc1ccc2c(Cl)c(C(=O)[N-]c3ncn(C(C)C)n3)sc2c1 ZINC000650281193 1021897425 /nfs/dbraw/zinc/89/74/25/1021897425.db2.gz ZXDNXCQONAERNI-UHFFFAOYSA-N -1 3 334.832 4.288 20 0 EIADHM Cc1noc(-c2ccccc2)c1[N-]C(=O)c1coc(Br)c1 ZINC000122729876 1022003968 /nfs/dbraw/zinc/00/39/68/1022003968.db2.gz AVEADWIHVHBJJQ-UHFFFAOYSA-N -1 3 347.168 4.258 20 0 EIADHM CSc1ccc([O-])c(C(=O)N2CC[C@H](c3cccc(C)c3)C2)c1 ZINC000613458144 1022065265 /nfs/dbraw/zinc/06/52/65/1022065265.db2.gz GNUDLPNISOUCEU-HNNXBMFYSA-N -1 3 327.449 4.052 20 0 EIADHM O=C([O-])[C@@H](NCc1ccc(F)c(Cl)c1)c1ccc(Cl)cc1 ZINC000756333232 1022076435 /nfs/dbraw/zinc/07/64/35/1022076435.db2.gz PJUQCXPCEBVPCI-AWEZNQCLSA-N -1 3 328.170 4.048 20 0 EIADHM CSc1ccc(Cl)cc1[N-]C(=O)c1cc(C(F)(F)F)ncn1 ZINC001125474999 1022524630 /nfs/dbraw/zinc/52/46/30/1022524630.db2.gz IQLYXCORIQPVIN-UHFFFAOYSA-N -1 3 347.749 4.123 20 0 EIADHM CC(F)(F)c1ccccc1[N-]S(=O)(=O)[C@@H]1C[C@H]1c1ccccc1 ZINC000414384101 1022820463 /nfs/dbraw/zinc/82/04/63/1022820463.db2.gz ORLXZMDYMUVXPC-XJKSGUPXSA-N -1 3 337.391 4.096 20 0 EIADHM O=C(Cc1ccc(Cl)s1)Nc1ccc(Br)cc1[O-] ZINC000549097273 1023035693 /nfs/dbraw/zinc/03/56/93/1023035693.db2.gz JOGVOEOASUKTQR-UHFFFAOYSA-N -1 3 346.633 4.051 20 0 EIADHM COc1cc(Nc2cccc([O-])c2Br)cc(C)c1F ZINC001215705065 1023038302 /nfs/dbraw/zinc/03/83/02/1023038302.db2.gz PGYWDBRGCVWJHN-UHFFFAOYSA-N -1 3 326.165 4.354 20 0 EIADHM O=C(Nc1c([O-])cccc1Cl)c1cccc(Br)c1 ZINC000581385967 1023082370 /nfs/dbraw/zinc/08/23/70/1023082370.db2.gz ACTGWNSGTSZFCM-UHFFFAOYSA-N -1 3 326.577 4.060 20 0 EIADHM CCCOc1ccccc1NC(=O)CCCc1ccc([O-])c(F)c1 ZINC000468544619 1023220038 /nfs/dbraw/zinc/22/00/38/1023220038.db2.gz WHIQCQVMYBTRRD-UHFFFAOYSA-N -1 3 331.387 4.282 20 0 EIADHM COc1cc(C)ccc1-c1noc(C=C([O-])c2ccccc2Cl)n1 ZINC001211647354 1023223742 /nfs/dbraw/zinc/22/37/42/1023223742.db2.gz LJDORIPDQDHUMH-UHFFFAOYSA-N -1 3 342.782 4.132 20 0 EIADHM [O-]C(=Cc1nc(-c2ccc(Cl)cc2)no1)c1ccccc1Cl ZINC001211647453 1023225083 /nfs/dbraw/zinc/22/50/83/1023225083.db2.gz QBTOFDLNSBOBHG-UHFFFAOYSA-N -1 3 333.174 4.469 20 0 EIADHM CCc1cccc2cc(CN[C@@H]3C[C@@H](C(=O)[O-])c4ccccc43)oc21 ZINC000656566369 1023225350 /nfs/dbraw/zinc/22/53/50/1023225350.db2.gz IZYKMRJFDPXQPK-RTBURBONSA-N -1 3 335.403 4.398 20 0 EIADHM O=C(CCOc1ccccc1Cl)Nc1ccc(Cl)cc1[O-] ZINC000536221843 1023234860 /nfs/dbraw/zinc/23/48/60/1023234860.db2.gz YWHNGHNQVQLJMA-UHFFFAOYSA-N -1 3 326.179 4.107 20 0 EIADHM O=C(NC[C@@H]1CC[C@H]2C[C@H]2C1)c1cc(Oc2ccccc2)ccc1[O-] ZINC001167711915 1023256035 /nfs/dbraw/zinc/25/60/35/1023256035.db2.gz VHMWEOMLKQPQIP-OWCLPIDISA-N -1 3 337.419 4.351 20 0 EIADHM C[C@@H](c1ncc(-c2ccc(Cl)cc2)o1)N1CC[C@H](C(=O)[O-])[C@H](C)C1 ZINC000659801021 1023283027 /nfs/dbraw/zinc/28/30/27/1023283027.db2.gz FVDQBMROCQMWRP-XUJVJEKNSA-N -1 3 348.830 4.099 20 0 EIADHM CC[C@@H]1CCC[C@H](C)N1Cc1ccc(C(=O)[O-])cc1Br ZINC000659802934 1023283869 /nfs/dbraw/zinc/28/38/69/1023283869.db2.gz AEEHJESNGSJERW-SMDDNHRTSA-N -1 3 340.261 4.300 20 0 EIADHM C[C@H]1CCN(CCSc2cc(Cl)ccc2Cl)C[C@H]1C(=O)[O-] ZINC000584779976 1023311883 /nfs/dbraw/zinc/31/18/83/1023311883.db2.gz ZISHGQYQBOTYBS-CMPLNLGQSA-N -1 3 348.295 4.128 20 0 EIADHM Cc1nn(C(C)C)cc1CN[C@@H](CC(=O)[O-])c1ccc(C(C)C)cc1 ZINC000417572789 1023357336 /nfs/dbraw/zinc/35/73/36/1023357336.db2.gz PHEPQGWVLLFEPJ-IBGZPJMESA-N -1 3 343.471 4.201 20 0 EIADHM COc1cccc2c(CN[C@H](CC(=O)[O-])c3ccc(C)o3)cccc12 ZINC000417576240 1023361472 /nfs/dbraw/zinc/36/14/72/1023361472.db2.gz UOKSPAAJWZTIRF-QGZVFWFLSA-N -1 3 339.391 4.055 20 0 EIADHM O=C([O-])CC[C@H](NCc1cnc(C2CCCC2)s1)c1ccccc1 ZINC000417592615 1023368443 /nfs/dbraw/zinc/36/84/43/1023368443.db2.gz FHDHMXWNCIZKGN-KRWDZBQOSA-N -1 3 344.480 4.496 20 0 EIADHM CC(C)(C)c1ccc(-c2ccc(CNCCSCC(=O)[O-])o2)cc1 ZINC000417621919 1023377305 /nfs/dbraw/zinc/37/73/05/1023377305.db2.gz NMTLRGPTVQPUKS-UHFFFAOYSA-N -1 3 347.480 4.152 20 0 EIADHM O=C([O-])C[C@H](CCNCc1c(Cl)cccc1Cl)C(F)(F)F ZINC000417662089 1023396146 /nfs/dbraw/zinc/39/61/46/1023396146.db2.gz UECLQQOLKBQTSX-QMMMGPOBSA-N -1 3 344.160 4.126 20 0 EIADHM O=C([O-])[C@@H](c1ccc(Cl)cc1Cl)N1CCC[C@@H](CCF)C1 ZINC000656763042 1023506277 /nfs/dbraw/zinc/50/62/77/1023506277.db2.gz KPRIARQMEXZQBT-IINYFYTJSA-N -1 3 334.218 4.191 20 0 EIADHM O=C([O-])[C@@H]1CCN(Cc2csc(C3CCCC3)n2)[C@H]2CCCC[C@@H]12 ZINC000656767367 1023506893 /nfs/dbraw/zinc/50/68/93/1023506893.db2.gz UXDIXJOHNNXXCB-BBWFWOEESA-N -1 3 348.512 4.266 20 0 EIADHM CCOc1ccc(NC(=O)c2cc([O-])ccc2Cl)c2ncccc12 ZINC000500301517 1023670271 /nfs/dbraw/zinc/67/02/71/1023670271.db2.gz GASRDSJSBRBZNN-UHFFFAOYSA-N -1 3 342.782 4.245 20 0 EIADHM O=C(CCCc1csc2ccccc12)[N-]OCCC(F)(F)F ZINC000162792572 1023835850 /nfs/dbraw/zinc/83/58/50/1023835850.db2.gz JZLROGDKTYYCDH-UHFFFAOYSA-N -1 3 331.359 4.224 20 0 EIADHM CC1(C)CN(Cc2nc3c4ccccc4oc3c(=O)[n-]2)CC(C)(C)C1 ZINC000466935556 1024030873 /nfs/dbraw/zinc/03/08/73/1024030873.db2.gz VUEYDRFXSPWVCN-UHFFFAOYSA-N -1 3 339.439 4.340 20 0 EIADHM O=C([O-])[C@H](NCc1cccc(OCc2ccccc2)c1)c1ccccc1 ZINC000388554084 1024235327 /nfs/dbraw/zinc/23/53/27/1024235327.db2.gz WZUSPERQJFPBAV-OAQYLSRUSA-N -1 3 347.414 4.181 20 0 EIADHM C[C@H](CC(=O)[N-]OCc1ccc(F)cc1)c1c[nH]c2ccccc21 ZINC000785272639 1024273223 /nfs/dbraw/zinc/27/32/23/1024273223.db2.gz NHQXNMDMVHFUPP-CYBMUJFWSA-N -1 3 326.371 4.049 20 0 EIADHM O=[S@](Cc1coc(-c2ccc(Cl)cc2)n1)c1ccc([O-])cc1 ZINC000341746859 1024573941 /nfs/dbraw/zinc/57/39/41/1024573941.db2.gz ZDVHJCFLZHWNNA-JOCHJYFZSA-N -1 3 333.796 4.008 20 0 EIADHM O=C([N-]c1cc(Cl)cc(F)c1F)c1csc(C(F)(F)F)n1 ZINC000341781838 1024657466 /nfs/dbraw/zinc/65/74/66/1024657466.db2.gz ZCHCRQDUAFMUJE-UHFFFAOYSA-N -1 3 342.676 4.346 20 0 EIADHM CCn1c2ccc(C(=O)[O-])cc2nc1CN(C1CC1)C1CCCCC1 ZINC000652401439 1024809801 /nfs/dbraw/zinc/80/98/01/1024809801.db2.gz FFMHONKORBTMQY-UHFFFAOYSA-N -1 3 341.455 4.052 20 0 EIADHM O=C([O-])CCCCCN(Cc1c(F)cccc1F)C1CCCC1 ZINC000652409847 1024818094 /nfs/dbraw/zinc/81/80/94/1024818094.db2.gz QRHGHHYCQCQRCX-UHFFFAOYSA-N -1 3 325.399 4.354 20 0 EIADHM O=C([O-])c1cccc2c1CN(CCCc1ccccc1Cl)CC2 ZINC000652487809 1024853281 /nfs/dbraw/zinc/85/32/81/1024853281.db2.gz SMWJTWFCHIRXRW-UHFFFAOYSA-N -1 3 329.827 4.029 20 0 EIADHM Cc1oc(CN2CCCC[C@@H]2Cc2ccccc2F)cc1C(=O)[O-] ZINC000652507764 1024859308 /nfs/dbraw/zinc/85/93/08/1024859308.db2.gz MQORAGDCGSEQJV-OAHLLOKOSA-N -1 3 331.387 4.023 20 0 EIADHM Cc1oc(CN2CCCC[C@H]2Cc2ccccc2F)cc1C(=O)[O-] ZINC000652507763 1024859363 /nfs/dbraw/zinc/85/93/63/1024859363.db2.gz MQORAGDCGSEQJV-HNNXBMFYSA-N -1 3 331.387 4.023 20 0 EIADHM CC[C@@H](c1ccc(Cl)cc1)N1CCC(n2cc(C(=O)[O-])cn2)CC1 ZINC000652505965 1024859810 /nfs/dbraw/zinc/85/98/10/1024859810.db2.gz YUHLOXJUDKMEJN-KRWDZBQOSA-N -1 3 347.846 4.023 20 0 EIADHM Cc1cc(=O)[n-]c([C@H](C)N[C@H](c2ccc(Cl)cc2)[C@H]2C[C@H]2C)n1 ZINC000248731330 1024875725 /nfs/dbraw/zinc/87/57/25/1024875725.db2.gz JMANHWZRNPDDGO-VSQNCQAESA-N -1 3 331.847 4.192 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1cccc([C@H]2CCCOC2)c1 ZINC000535756980 1024928143 /nfs/dbraw/zinc/92/81/43/1024928143.db2.gz PXXXAGLJGBGXEI-AWEZNQCLSA-N -1 3 331.799 4.192 20 0 EIADHM O=C([O-])CC[C@@H](CNCc1c(Cl)oc2ccccc21)C(F)(F)F ZINC000663262986 1024967942 /nfs/dbraw/zinc/96/79/42/1024967942.db2.gz WXBRSOMSJBSMIE-VIFPVBQESA-N -1 3 349.736 4.219 20 0 EIADHM COc1cc(N=Cc2cc(Cl)ccc2[O-])c(OC)cc1Cl ZINC000254876926 1025005133 /nfs/dbraw/zinc/00/51/33/1025005133.db2.gz RCQOXPDGDOZNLS-UHFFFAOYSA-N -1 3 326.179 4.467 20 0 EIADHM CCC(=O)c1ccc(NC(=O)CCCc2ccc([O-])c(F)c2)cc1 ZINC000628695006 1025054002 /nfs/dbraw/zinc/05/40/02/1025054002.db2.gz YERNOSRHXHVFIX-UHFFFAOYSA-N -1 3 329.371 4.085 20 0 EIADHM Cc1ccc([O-])c(CN(C)[C@@H](c2ccc(Cl)cc2)C(F)(F)F)n1 ZINC000535852168 1025110893 /nfs/dbraw/zinc/11/08/93/1025110893.db2.gz JYAHMSFDOKFEGZ-HNNXBMFYSA-N -1 3 344.764 4.484 20 0 EIADHM CCc1noc(C)c1[N-]C(=O)c1csc(-c2ccc(F)c(F)c2)n1 ZINC000181188310 1025123184 /nfs/dbraw/zinc/12/31/84/1025123184.db2.gz OEXIFWUNVFKIJB-UHFFFAOYSA-N -1 3 349.362 4.199 20 0 EIADHM Cc1cccc(C(=O)N=c2cc(-c3ccccc3C)[n-][nH]2)c1Cl ZINC000535880828 1025188777 /nfs/dbraw/zinc/18/87/77/1025188777.db2.gz WYZNYMOBEXCSEA-UHFFFAOYSA-N -1 3 325.799 4.021 20 0 EIADHM C[C@@H](NCc1cc(C(=O)[O-])cs1)c1cccc(C(F)(F)F)c1 ZINC000317069515 1025435535 /nfs/dbraw/zinc/43/55/35/1025435535.db2.gz MXMFIRUQLRQTGX-SECBINFHSA-N -1 3 329.343 4.316 20 0 EIADHM CCc1ccc([O-])c(C(=O)Nc2ccc(OCc3ccncc3)cc2)c1 ZINC000519163741 1025559013 /nfs/dbraw/zinc/55/90/13/1025559013.db2.gz KKFMKPZJSPMQDE-UHFFFAOYSA-N -1 3 348.402 4.181 20 0 EIADHM [O-]c1cc(F)cc(CNc2ccccc2OCc2cscn2)c1 ZINC000472061256 1025572665 /nfs/dbraw/zinc/57/26/65/1025572665.db2.gz BAULNTGUQFRCTE-UHFFFAOYSA-N -1 3 330.384 4.179 20 0 EIADHM Cc1c(NCc2cc([O-])cc(F)c2)cccc1OCC(F)(F)F ZINC000472072469 1025631839 /nfs/dbraw/zinc/63/18/39/1025631839.db2.gz FEHYCJPLZPTTBQ-UHFFFAOYSA-N -1 3 329.293 4.393 20 0 EIADHM Cc1ccccc1S(=O)(=O)[N-]c1ccc(CCC(F)(F)F)cc1 ZINC000440277404 1025798151 /nfs/dbraw/zinc/79/81/51/1025798151.db2.gz PGLHNZVMOOFVNN-UHFFFAOYSA-N -1 3 343.370 4.291 20 0 EIADHM C[C@@H]1[C@H](C)SCCN1Cc1c(C(=O)[O-])sc2cccc(F)c21 ZINC000317238058 1025843600 /nfs/dbraw/zinc/84/36/00/1025843600.db2.gz VXAKGLRJEZMYJT-ZJUUUORDSA-N -1 3 339.457 4.064 20 0 EIADHM Cc1cc([C@@H](C)N2CCC(OCc3ccccc3)CC2)oc1C(=O)[O-] ZINC000582067811 1026072633 /nfs/dbraw/zinc/07/26/33/1026072633.db2.gz KWZQWQZRQZOUKY-OAHLLOKOSA-N -1 3 343.423 4.028 20 0 EIADHM O=C(CCC(=O)c1ccc2c(c1)CCC2)Nc1cc(Cl)ccc1[O-] ZINC000111210505 1026096638 /nfs/dbraw/zinc/09/66/38/1026096638.db2.gz KJIQBULMSGZKPU-UHFFFAOYSA-N -1 3 343.810 4.136 20 0 EIADHM CC(C)c1cc(C(=O)Nc2cc(Cl)ccc2[O-])nn1C(C)(C)C ZINC000111210274 1026097204 /nfs/dbraw/zinc/09/72/04/1026097204.db2.gz AJUYZYMITYNBDM-UHFFFAOYSA-N -1 3 335.835 4.373 20 0 EIADHM Cc1ccc(C(=O)Nc2c(-c3cccs3)nc3ccccn32)c([O-])c1 ZINC000519560010 1026258736 /nfs/dbraw/zinc/25/87/36/1026258736.db2.gz FUPCCXYDRVDLDA-UHFFFAOYSA-N -1 3 349.415 4.329 20 0 EIADHM O=C(N[C@H]1C[C@H](c2ccc(Cl)cc2)C1)c1cc([O-])ccc1Cl ZINC000511089541 1026303659 /nfs/dbraw/zinc/30/36/59/1026303659.db2.gz KZDKATJQXQAJKY-AULYBMBSSA-N -1 3 336.218 4.375 20 0 EIADHM O=C(Nc1ccnn1-c1cccc(Cl)c1)c1cc([O-])ccc1Cl ZINC000550261674 1026442803 /nfs/dbraw/zinc/44/28/03/1026442803.db2.gz UIIBRBBXVZZCHO-UHFFFAOYSA-N -1 3 348.189 4.137 20 0 EIADHM CCCOc1cccc(CN[C@@H](C(=O)[O-])c2cccc(Cl)c2)c1 ZINC000426731703 1026512677 /nfs/dbraw/zinc/51/26/77/1026512677.db2.gz FXRZNAVKRDYOPW-QGZVFWFLSA-N -1 3 333.815 4.044 20 0 EIADHM O=C([O-])C[C@@H](NCc1ccc(Cl)c(F)c1)c1cccc(Cl)c1 ZINC000426794358 1026567071 /nfs/dbraw/zinc/56/70/71/1026567071.db2.gz UFWGLSPZJBVWEJ-OAHLLOKOSA-N -1 3 342.197 4.438 20 0 EIADHM Cc1cc([C@@H](NCc2ccc(Cl)s2)C(=O)[O-])ccc1Cl ZINC000426828263 1026583250 /nfs/dbraw/zinc/58/32/50/1026583250.db2.gz KOMRISIAZIJCID-CYBMUJFWSA-N -1 3 330.236 4.279 20 0 EIADHM Cc1cc([C@@H](NCc2cc3c(cccc3F)[nH]2)C(=O)[O-])ccc1Cl ZINC000426828666 1026585262 /nfs/dbraw/zinc/58/52/62/1026585262.db2.gz LXZCOZBXPVXFJI-QGZVFWFLSA-N -1 3 346.789 4.184 20 0 EIADHM N#CC(=C([O-])C=Cc1ccsc1)c1nc2ccccc2n1C(F)F ZINC000051655597 1026593249 /nfs/dbraw/zinc/59/32/49/1026593249.db2.gz WLVGFAKNIOJZSC-BTDICHCPSA-N -1 3 343.358 4.383 20 0 EIADHM COC(=O)c1cnc(S[C@@H]2CCc3c2cc(Cl)cc3Cl)[n-]1 ZINC000432664068 1026687494 /nfs/dbraw/zinc/68/74/94/1026687494.db2.gz DHASPCBWMYGRPA-GFCCVEGCSA-N -1 3 343.235 4.283 20 0 EIADHM COC(=O)c1cnc(S[C@@H](C)c2ccc(Cl)c(Cl)c2)[n-]1 ZINC000432669900 1026697231 /nfs/dbraw/zinc/69/72/31/1026697231.db2.gz ZJLUWZAWLWVAGT-ZETCQYMHSA-N -1 3 331.224 4.356 20 0 EIADHM CC(=O)c1csc([N-]c2ncnc3scc(C(C)(C)C)c32)n1 ZINC000427188070 1026749146 /nfs/dbraw/zinc/74/91/46/1026749146.db2.gz WIGMTNLLPPOLRD-UHFFFAOYSA-N -1 3 332.454 4.392 20 0 EIADHM CN(Cc1ccc(F)c(Cl)c1)C(=O)c1cc([O-])ccc1Cl ZINC000507462596 1026809518 /nfs/dbraw/zinc/80/95/18/1026809518.db2.gz ZFFQVPFSCLBYTE-UHFFFAOYSA-N -1 3 328.170 4.110 20 0 EIADHM C[C@@H](c1ccc(Br)cc1)[S@](=O)c1ccc([O-])cc1 ZINC000427469423 1026861815 /nfs/dbraw/zinc/86/18/15/1026861815.db2.gz BDQYMLAQOXAMQV-YPMLDQLKSA-N -1 3 325.227 4.024 20 0 EIADHM Cc1ccc(CNC(=O)c2cc([O-])ccc2Cl)c(OC(C)(C)C)c1 ZINC000582680868 1026934616 /nfs/dbraw/zinc/93/46/16/1026934616.db2.gz AOEYRQGBKKGAJW-UHFFFAOYSA-N -1 3 347.842 4.461 20 0 EIADHM O=C(Cc1ccc(Cl)cc1)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000440978050 1027174112 /nfs/dbraw/zinc/17/41/12/1027174112.db2.gz FHICVWGRCOBHKV-UHFFFAOYSA-N -1 3 329.705 4.246 20 0 EIADHM CC(C)(C)c1nc([N-][C@H](c2cccc(F)c2)c2ccccn2)no1 ZINC000302145564 1027232899 /nfs/dbraw/zinc/23/28/99/1027232899.db2.gz HOIDVPMKLMTQOZ-OAHLLOKOSA-N -1 3 326.375 4.103 20 0 EIADHM CC(C)(C)OC(=O)NCc1cccc(NCc2ccc([O-])c(F)c2)c1 ZINC000310605276 1027389249 /nfs/dbraw/zinc/38/92/49/1027389249.db2.gz IOHWTCQTIFDQLN-UHFFFAOYSA-N -1 3 346.402 4.168 20 0 EIADHM CC(C)(C)OC(=O)NCc1ccccc1NCc1ccc([O-])c(F)c1 ZINC000310605498 1027390792 /nfs/dbraw/zinc/39/07/92/1027390792.db2.gz TVMJBXPTQAYMPF-UHFFFAOYSA-N -1 3 346.402 4.168 20 0 EIADHM Cc1cccc([C@H]2CCCCCN2C(=O)N=c2cc3ccccn3[n-]2)c1 ZINC000548772834 1027403302 /nfs/dbraw/zinc/40/33/02/1027403302.db2.gz XHUZNSXYIAJDNN-LJQANCHMSA-N -1 3 348.450 4.214 20 0 EIADHM Cc1ccc(F)cc1-c1nnc([N-]C(=O)c2cccc(F)c2F)s1 ZINC000469893726 1027458204 /nfs/dbraw/zinc/45/82/04/1027458204.db2.gz QBRVTYRDXPAKMC-UHFFFAOYSA-N -1 3 349.337 4.183 20 0 EIADHM O=C([O-])CC[C@@H]1CCCCN1Cc1coc(-c2ccc(Cl)cc2)n1 ZINC000392045878 1027462826 /nfs/dbraw/zinc/46/28/26/1027462826.db2.gz MRAQLTPISBMPMT-INIZCTEOSA-N -1 3 348.830 4.214 20 0 EIADHM C[C@@H](c1ccc(C(=O)[O-])o1)N(C)Cc1cccc(C(F)(F)F)c1 ZINC000520416422 1027541314 /nfs/dbraw/zinc/54/13/14/1027541314.db2.gz BTXWTMOGORVIIC-JTQLQIEISA-N -1 3 327.302 4.190 20 0 EIADHM COc1c(F)c(F)ccc1Nc1cccc([O-])c1Br ZINC001211900957 1027830450 /nfs/dbraw/zinc/83/04/50/1027830450.db2.gz SGQSCEMPAGJLQD-UHFFFAOYSA-N -1 3 330.128 4.185 20 0 EIADHM Cc1cc(C)cc(-c2nnc([N-]C(=O)c3ccoc3Cl)s2)c1 ZINC000192313021 1027926696 /nfs/dbraw/zinc/92/66/96/1027926696.db2.gz OTYGCTJLGSWORC-UHFFFAOYSA-N -1 3 333.800 4.321 20 0 EIADHM Cc1nc(C)c([C@@H](C)N(C)C(=O)c2ccc(C(C)C)cc2[O-])s1 ZINC000331229761 1027935743 /nfs/dbraw/zinc/93/57/43/1027935743.db2.gz GQTXWZNMETVWRL-GFCCVEGCSA-N -1 3 332.469 4.422 20 0 EIADHM Cc1cc(NC(=O)c2c(C)nc(C(C)(C)C)[n-]c2=O)cc(C)c1Cl ZINC000331273126 1027941828 /nfs/dbraw/zinc/94/18/28/1027941828.db2.gz MHQKIYJIGSZPPS-UHFFFAOYSA-N -1 3 347.846 4.311 20 0 EIADHM [O-]c1c(F)cc(Nc2ccc(F)c(F)c2Br)cc1F ZINC001213379239 1028212139 /nfs/dbraw/zinc/21/21/39/1028212139.db2.gz HXIVRRQXOWIXQP-UHFFFAOYSA-N -1 3 336.082 4.455 20 0 EIADHM O=S(=O)([N-]c1ccsc1Cl)c1ccccc1C(F)(F)F ZINC000189741760 1028212374 /nfs/dbraw/zinc/21/23/74/1028212374.db2.gz PBIHCNZYTVWGNK-UHFFFAOYSA-N -1 3 341.763 4.221 20 0 EIADHM CN(C(=O)NCc1ccc([O-])c(F)c1)[C@@H]1CCC[C@H]1c1ccccc1 ZINC000458426859 1028237940 /nfs/dbraw/zinc/23/79/40/1028237940.db2.gz UBGUFYSVYVDMLU-FUHWJXTLSA-N -1 3 342.414 4.009 20 0 EIADHM Cc1nn(C(C)C)cc1C=C(Cc1ccccc1)c1nccc(=O)[n-]1 ZINC000346674930 1028594940 /nfs/dbraw/zinc/59/49/40/1028594940.db2.gz WEEQFNVBXZPYRQ-ATVHPVEESA-N -1 3 334.423 4.051 20 0 EIADHM CC(C)(C)[C@H](NC(=O)NCc1ccc([O-])c(F)c1)c1ccccc1 ZINC000524142017 1028702677 /nfs/dbraw/zinc/70/26/77/1028702677.db2.gz AJBLNHMRCXEVGC-QGZVFWFLSA-N -1 3 330.403 4.118 20 0 EIADHM [O-]c1cc(F)cc(CNc2cccc3cncc(Br)c32)c1 ZINC000444011961 1028734211 /nfs/dbraw/zinc/73/42/11/1028734211.db2.gz QVCCZCIDTTVILO-UHFFFAOYSA-N -1 3 347.187 4.454 20 0 EIADHM O=C([N-]c1nnc(-c2ccccc2)s1)c1cc2cc(F)ccc2o1 ZINC000522739620 1028744264 /nfs/dbraw/zinc/74/42/64/1028744264.db2.gz GHUNMCKMIBMLBO-UHFFFAOYSA-N -1 3 339.351 4.343 20 0 EIADHM Cc1cc2cc(NC(=O)CCCc3ccc([O-])c(F)c3)ccc2[nH]1 ZINC000468318840 1028773489 /nfs/dbraw/zinc/77/34/89/1028773489.db2.gz IDDYPJCZIZXUPG-UHFFFAOYSA-N -1 3 326.371 4.282 20 0 EIADHM O=C([O-])c1ccc(CN2CCC(Cc3cccc(F)c3)CC2)cc1F ZINC000583576139 1028884687 /nfs/dbraw/zinc/88/46/87/1028884687.db2.gz FOONLFVSIWTBLI-UHFFFAOYSA-N -1 3 345.389 4.118 20 0 EIADHM Cc1ccc(C)c([C@@H]2CCCN2C(=O)NCc2ccc([O-])c(F)c2)c1 ZINC000475099242 1029245956 /nfs/dbraw/zinc/24/59/56/1029245956.db2.gz FGTCGFUXIMCWJB-SFHVURJKSA-N -1 3 342.414 4.195 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)Nc1ccc(Cl)cc1Cl ZINC000151295219 1029467479 /nfs/dbraw/zinc/46/74/79/1029467479.db2.gz RYCHBZYJRZWCQM-UHFFFAOYSA-N -1 3 329.158 4.160 20 0 EIADHM Cc1ccc(NCc2ccc([O-])c(F)c2)cc1NC(=O)C(C)(C)C ZINC000892372281 1029658580 /nfs/dbraw/zinc/65/85/80/1029658580.db2.gz DAPJREROMYZXMI-UHFFFAOYSA-N -1 3 330.403 4.436 20 0 EIADHM CC1(C)CN([C@H](C(=O)[O-])c2cccc(Cl)c2)CC[C@@H]1C(F)(F)F ZINC000584178025 1029661941 /nfs/dbraw/zinc/66/19/41/1029661941.db2.gz XQOJQGKWLMMIAK-STQMWFEESA-N -1 3 349.780 4.376 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@@H]3CC[C@H](C)C[C@H]3C)nc2)n1 ZINC000301248437 1029692964 /nfs/dbraw/zinc/69/29/64/1029692964.db2.gz IKGIEZTUDWAOEX-WOSRLPQWSA-N -1 3 326.444 4.043 20 0 EIADHM O=C(Nc1ccc([O-])c(C(F)(F)F)c1)c1ccoc1C(F)(F)F ZINC000584322434 1029735891 /nfs/dbraw/zinc/73/58/91/1029735891.db2.gz PUVQIISSWXGZIS-UHFFFAOYSA-N -1 3 339.191 4.275 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N3CCCC[C@H]3CC(C)C)nc2)n1 ZINC000301745038 1029802472 /nfs/dbraw/zinc/80/24/72/1029802472.db2.gz NRVIEGNUNPBHGN-KRWDZBQOSA-N -1 3 340.471 4.212 20 0 EIADHM COc1ccc(Cl)cc1S(=O)(=O)[N-]c1cc(C)ccc1Cl ZINC000447262918 1029950546 /nfs/dbraw/zinc/95/05/46/1029950546.db2.gz GZDFWIIXJVHKRD-UHFFFAOYSA-N -1 3 346.235 4.111 20 0 EIADHM C[C@@H]1CC(F)(F)CCN1C(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000530009476 1030029392 /nfs/dbraw/zinc/02/93/92/1030029392.db2.gz BSUZHPBQRKTQQX-CYBMUJFWSA-N -1 3 347.361 4.444 20 0 EIADHM CC(=O)c1cccc(NC(=O)c2ccccc2Cc2ccccc2)c1[O-] ZINC000147595757 1030101154 /nfs/dbraw/zinc/10/11/54/1030101154.db2.gz QLGUYNOBZVHWIC-UHFFFAOYSA-N -1 3 345.398 4.438 20 0 EIADHM C[C@H](c1cc(Cl)ccc1Cl)N1CCC(c2n[n-]c(=O)o2)CC1 ZINC000450917168 1030106502 /nfs/dbraw/zinc/10/65/02/1030106502.db2.gz CLLJTKLTVKEXEG-SECBINFHSA-N -1 3 342.226 4.023 20 0 EIADHM CC(C)Cc1nnc([N-]C(=O)c2occc2-c2ccccc2)s1 ZINC000198551111 1030123382 /nfs/dbraw/zinc/12/33/82/1030123382.db2.gz LXOQFLPXVQIJGJ-UHFFFAOYSA-N -1 3 327.409 4.249 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@H](C)c3cccc(C)c3)nc2)n1 ZINC000450944775 1030123870 /nfs/dbraw/zinc/12/38/70/1030123870.db2.gz JVVYPXHYUXUHLI-CQSZACIVSA-N -1 3 334.423 4.288 20 0 EIADHM COc1ccc([O-])c(-c2nc(CSc3ccc(Cl)cc3)no2)c1 ZINC000321200501 1030160805 /nfs/dbraw/zinc/16/08/05/1030160805.db2.gz HFESWYZHIUXWSV-UHFFFAOYSA-N -1 3 348.811 4.397 20 0 EIADHM C[C@@H]1CC[C@@H](C(=O)[O-])CN1CCSc1cc(Cl)ccc1Cl ZINC000396993440 1030191137 /nfs/dbraw/zinc/19/11/37/1030191137.db2.gz BIBNPWZKDGBBSH-GHMZBOCLSA-N -1 3 348.295 4.271 20 0 EIADHM C[C@@H]1CC(C(=O)[O-])C[C@@H](C)N1Cc1ncc(-c2cccc(Cl)c2)o1 ZINC000530174792 1030196836 /nfs/dbraw/zinc/19/68/36/1030196836.db2.gz BCVQMKDSYDZZNB-VXGBXAGGSA-N -1 3 348.830 4.069 20 0 EIADHM Cc1ccc(-c2ccc(C)c(NC(=O)c3cccc4n[n-]nc43)c2)o1 ZINC000526025280 1030225240 /nfs/dbraw/zinc/22/52/40/1030225240.db2.gz GKBHZAJOOQKVAF-UHFFFAOYSA-N -1 3 332.363 4.087 20 0 EIADHM Cc1onc(-c2ccccc2C)c1C(=O)Nc1cccc([O-])c1F ZINC000530289876 1030269378 /nfs/dbraw/zinc/26/93/78/1030269378.db2.gz NDPSHUSRKOAFIJ-UHFFFAOYSA-N -1 3 326.327 4.055 20 0 EIADHM CC(C)Sc1c(Cl)cccc1NC(=O)c1cccc2n[n-]nc21 ZINC000526116805 1030286009 /nfs/dbraw/zinc/28/60/09/1030286009.db2.gz ZVXNAZYVRNTZFY-UHFFFAOYSA-N -1 3 346.843 4.364 20 0 EIADHM CC(C)Oc1ccc(NC(=O)CCCc2ccc([O-])c(F)c2)c(F)c1 ZINC000530330210 1030318630 /nfs/dbraw/zinc/31/86/30/1030318630.db2.gz BHSDMKDFJAKYDY-UHFFFAOYSA-N -1 3 349.377 4.419 20 0 EIADHM Cc1nc(CC(C)C)oc1C(=O)[N-]c1nnc(-c2ccsc2)s1 ZINC000188657096 1030412790 /nfs/dbraw/zinc/41/27/90/1030412790.db2.gz BHIDCXRBYFCNOR-UHFFFAOYSA-N -1 3 348.453 4.014 20 0 EIADHM O=C(Nc1cc(F)ccc1Oc1ccccc1)c1cccc2n[n-]nc21 ZINC000527107409 1030484459 /nfs/dbraw/zinc/48/44/59/1030484459.db2.gz OKCOHQGIURWPAY-UHFFFAOYSA-N -1 3 348.337 4.142 20 0 EIADHM O=C(Cc1ccc([O-])c(F)c1)N(Cc1ccccc1Cl)CC1CC1 ZINC000451673835 1030637817 /nfs/dbraw/zinc/63/78/17/1030637817.db2.gz LOGIWAQWLGODML-UHFFFAOYSA-N -1 3 347.817 4.166 20 0 EIADHM C[C@H]1CC[C@H](c2ccccc2)N(C(=O)Cc2ccc([O-])c(F)c2)C1 ZINC000451691722 1030661774 /nfs/dbraw/zinc/66/17/74/1030661774.db2.gz RTPNHDWSNGLKFF-KBXCAEBGSA-N -1 3 327.399 4.074 20 0 EIADHM C[C@@H]1CC[C@H](c2ccccc2)N(C(=O)Cc2ccc([O-])c(F)c2)C1 ZINC000451691820 1030662184 /nfs/dbraw/zinc/66/21/84/1030662184.db2.gz RTPNHDWSNGLKFF-RDTXWAMCSA-N -1 3 327.399 4.074 20 0 EIADHM CSc1ccc(C(=O)Nc2cc(Br)ccc2[O-])cc1 ZINC000530916672 1030806233 /nfs/dbraw/zinc/80/62/33/1030806233.db2.gz KBKFVKTWSOIKBD-UHFFFAOYSA-N -1 3 338.226 4.129 20 0 EIADHM COc1cc([C@H](C)NCc2cccc(C(=O)[O-])c2)ccc1OC(C)C ZINC000263513661 1030910632 /nfs/dbraw/zinc/91/06/32/1030910632.db2.gz ZQODGURIRVMDEC-AWEZNQCLSA-N -1 3 343.423 4.031 20 0 EIADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)[C@@H]3CCC[C@@H]3CC)c2)n1 ZINC000448723472 1030984658 /nfs/dbraw/zinc/98/46/58/1030984658.db2.gz HVRWBXDTIPYUBY-SUMWQHHRSA-N -1 3 339.439 4.176 20 0 EIADHM CCCCOc1ccc(NC(=O)Cc2ccc([O-])c(F)c2)c(C)c1 ZINC000448767103 1031053644 /nfs/dbraw/zinc/05/36/44/1031053644.db2.gz ILBMZYVCULCXDR-UHFFFAOYSA-N -1 3 331.387 4.200 20 0 EIADHM CC[C@@H]1CCCN(Cc2ccc(C(=O)[O-])cc2Br)CC1 ZINC000226732178 1031103108 /nfs/dbraw/zinc/10/31/08/1031103108.db2.gz CDQKITOCCFFFRA-GFCCVEGCSA-N -1 3 340.261 4.159 20 0 EIADHM CC(C)Sc1ccc([C@H](C)NC(=O)Cc2ccc([O-])c(F)c2)cc1 ZINC000448910472 1031263553 /nfs/dbraw/zinc/26/35/53/1031263553.db2.gz JZPWRFLRRNILAT-ZDUSSCGKSA-N -1 3 347.455 4.452 20 0 EIADHM O=C(Cc1coc(-c2ccc(F)cc2)n1)Nc1cc(Cl)ccc1[O-] ZINC000113419750 1031360558 /nfs/dbraw/zinc/36/05/58/1031360558.db2.gz YCERUGOCXBWJED-UHFFFAOYSA-N -1 3 346.745 4.021 20 0 EIADHM CO[C@H](Cc1ccccc1)c1noc(-c2ccc(C(C)C)cc2[O-])n1 ZINC000453224530 1031743654 /nfs/dbraw/zinc/74/36/54/1031743654.db2.gz LVFSGWYUFSDEFW-GOSISDBHSA-N -1 3 338.407 4.496 20 0 EIADHM Cc1occc1SCc1nc(=O)c2c(-c3ccco3)csc2[n-]1 ZINC000131554989 1031876181 /nfs/dbraw/zinc/87/61/81/1031876181.db2.gz PWNRVTIBLKMJDZ-UHFFFAOYSA-N -1 3 344.417 4.438 20 0 EIADHM CC1(C)CCC[C@H]1C[N-]S(=O)(=O)c1cccc(Cl)c1Cl ZINC001211951174 1031988854 /nfs/dbraw/zinc/98/88/54/1031988854.db2.gz ZBSLGPWWGGPREX-JTQLQIEISA-N -1 3 336.284 4.098 20 0 EIADHM Cn1c(C(=O)Nc2ccc([O-])c(C(F)(F)F)c2)cc2ccccc21 ZINC000532040656 1031992487 /nfs/dbraw/zinc/99/24/87/1031992487.db2.gz FHEMAWWZLKMVSE-UHFFFAOYSA-N -1 3 334.297 4.155 20 0 EIADHM Cc1cc(C)cc([C@H](C)NC(=O)CCCc2ccc([O-])c(F)c2)c1 ZINC000468993339 1033620567 /nfs/dbraw/zinc/62/05/67/1033620567.db2.gz QPSFYEFJQDZHPV-HNNXBMFYSA-N -1 3 329.415 4.348 20 0 EIADHM Cc1ccc([O-])c(C(=O)Nc2cc(Cc3ccccn3)ccc2C)c1 ZINC000512772306 1033904133 /nfs/dbraw/zinc/90/41/33/1033904133.db2.gz YAWHSVMHYFJUIA-UHFFFAOYSA-N -1 3 332.403 4.247 20 0 EIADHM CC[C@@H]1C[C@]1(NC(=O)c1cc([O-])ccc1Cl)c1cccc(C)c1 ZINC000512925562 1034200799 /nfs/dbraw/zinc/20/07/99/1034200799.db2.gz JPZPCDLIZCHTOA-BFUOFWGJSA-N -1 3 329.827 4.409 20 0 EIADHM O=C([N-]c1n[nH]c(-c2ccccc2Cl)n1)c1sccc1Cl ZINC000513022023 1034332634 /nfs/dbraw/zinc/33/26/34/1034332634.db2.gz NQMPBNGFTNBUAW-UHFFFAOYSA-N -1 3 339.207 4.092 20 0 EIADHM CSc1ccc([O-])c(C(=O)N2CC[C@](C)(c3ccc(F)cc3)C2)c1 ZINC000614349124 1034381086 /nfs/dbraw/zinc/38/10/86/1034381086.db2.gz RHCMSJSIKZRVOG-IBGZPJMESA-N -1 3 345.439 4.057 20 0 EIADHM COC[C@H](c1ccc(Cl)cc1)N(C)Cc1c(F)ccc([O-])c1F ZINC000513308198 1034871894 /nfs/dbraw/zinc/87/18/94/1034871894.db2.gz FSDJMGVAPDOFKK-OAHLLOKOSA-N -1 3 341.785 4.143 20 0 EIADHM O=C(NC[C@@H](c1ccccc1)C(F)(F)F)c1cc([O-])ccc1Cl ZINC000501396835 1035435534 /nfs/dbraw/zinc/43/55/34/1035435534.db2.gz RNPXQVDSOJMNHD-ZDUSSCGKSA-N -1 3 343.732 4.122 20 0 EIADHM CCCc1cccc(C(C)C)c1NC(=O)NCc1ncccc1[O-] ZINC000347422102 1035621319 /nfs/dbraw/zinc/62/13/19/1035621319.db2.gz QWVGMGXBVLDYLH-UHFFFAOYSA-N -1 3 327.428 4.185 20 0 EIADHM Cc1cc(C(=O)Nc2n[n-]c(-c3cc4ccccc4o3)n2)sc1C ZINC000485116151 1035704453 /nfs/dbraw/zinc/70/44/53/1035704453.db2.gz YMDUCAKFMAPQTE-UHFFFAOYSA-N -1 3 338.392 4.149 20 0 EIADHM CCc1ccc(-c2nc(-c3ccccc3Br)no2)c([O-])c1 ZINC000904965756 1035705421 /nfs/dbraw/zinc/70/54/21/1035705421.db2.gz ZKHXDZJQQVQUFM-UHFFFAOYSA-N -1 3 345.196 4.434 20 0 EIADHM O=c1nc([C@@H]2CC2(Cl)Cl)[n-]c2sc(C(F)(F)F)cc21 ZINC000905031713 1035719625 /nfs/dbraw/zinc/71/96/25/1035719625.db2.gz MYTUQMSRIRLVGL-BYPYZUCNSA-N -1 3 329.130 4.077 20 0 EIADHM CC(C)(C)[C@H]1OCCC[C@H]1CNC(=O)c1cc([O-])c2ccccc2c1 ZINC000575222428 1035728083 /nfs/dbraw/zinc/72/80/83/1035728083.db2.gz AEHRSXXTLITWMA-KXBFYZLASA-N -1 3 341.451 4.117 20 0 EIADHM CC[C@H](C)NC(=O)c1ccc(NCc2c(F)ccc([O-])c2F)c(C)c1 ZINC000414464678 1035785619 /nfs/dbraw/zinc/78/56/19/1035785619.db2.gz QDNGWZWMUQXEJA-LBPRGKRZSA-N -1 3 348.393 4.119 20 0 EIADHM Cc1cc(OCCN[C@@H](C(=O)[O-])c2ccccc2F)ccc1C(C)C ZINC000905374403 1035808285 /nfs/dbraw/zinc/80/82/85/1035808285.db2.gz CTTDGZSCFHCJBI-LJQANCHMSA-N -1 3 345.414 4.052 20 0 EIADHM COCc1cccc(-c2nc3cc(Cl)c(Cl)cc3c(=O)[n-]2)c1 ZINC000485363082 1035842971 /nfs/dbraw/zinc/84/29/71/1035842971.db2.gz YCEZNHIFECCJCF-UHFFFAOYSA-N -1 3 335.190 4.043 20 0 EIADHM COc1cccc(C(=O)Nc2ccc3nc(C4CC4)sc3c2)c1[O-] ZINC000195733939 1035885142 /nfs/dbraw/zinc/88/51/42/1035885142.db2.gz HBMLIVBIWHSQQW-UHFFFAOYSA-N -1 3 340.404 4.140 20 0 EIADHM [O-]c1c(Cl)cc(CN2C[C@@H]3CCCC[C@@H]3C2)cc1Br ZINC001231745633 1036056508 /nfs/dbraw/zinc/05/65/08/1036056508.db2.gz GLTRMMMICDVBJR-TXEJJXNPSA-N -1 3 344.680 4.430 20 0 EIADHM CC1(C)CN(C(=O)c2cc([O-])c3ccccc3c2)[C@H]1c1ccncc1 ZINC000349726970 1036075728 /nfs/dbraw/zinc/07/57/28/1036075728.db2.gz JNAJUCQQVKTIOW-IBGZPJMESA-N -1 3 332.403 4.164 20 0 EIADHM C[C@H](Cc1cncc2ccccc21)C(=O)Nc1ccc(Cl)cc1[O-] ZINC000502518713 1036282069 /nfs/dbraw/zinc/28/20/69/1036282069.db2.gz PQNAPRJHSIEASL-GFCCVEGCSA-N -1 3 340.810 4.411 20 0 EIADHM CC[C@@H](Cc1ccccc1)C(=O)Nc1ccc(Br)cc1[O-] ZINC000602093180 1036333445 /nfs/dbraw/zinc/33/34/45/1036333445.db2.gz JXCCZDCKGBCXNT-ZDUSSCGKSA-N -1 3 348.240 4.362 20 0 EIADHM CCCCc1nc(NC(=O)[C@@H]2CCC(C)=C(C)C2)c(C(=O)OCC)[n-]1 ZINC001269128161 1036346286 /nfs/dbraw/zinc/34/62/86/1036346286.db2.gz BPBOLQDKWZVXEL-CQSZACIVSA-N -1 3 347.459 4.004 20 0 EIADHM O=c1cc(C=Cc2csc(-c3cccs3)n2)nc(C2CC2)[n-]1 ZINC000485982148 1036409084 /nfs/dbraw/zinc/40/90/84/1036409084.db2.gz VABCICMQMRMECT-WAYWQWQTSA-N -1 3 327.434 4.415 20 0 EIADHM O=C([O-])c1cccc(OCCN2CCC[C@@H]2c2ccccc2Cl)c1 ZINC000572127693 1036438698 /nfs/dbraw/zinc/43/86/98/1036438698.db2.gz OOPISNJCIGYIRF-GOSISDBHSA-N -1 3 345.826 4.254 20 0 EIADHM O=c1cc(C=Cc2cccc(Cl)c2Cl)nc(-c2ccncc2)[n-]1 ZINC000486028111 1036442866 /nfs/dbraw/zinc/44/28/66/1036442866.db2.gz JOVQLDGRIPIHAH-PLNGDYQASA-N -1 3 344.201 4.309 20 0 EIADHM O=c1cc(C=Cc2csc3ccccc23)nc(-c2ccncc2)[n-]1 ZINC000486073974 1036472426 /nfs/dbraw/zinc/47/24/26/1036472426.db2.gz IQPREVIUGALEBH-AATRIKPKSA-N -1 3 331.400 4.217 20 0 EIADHM CC(C)c1ccc2c(c1)[C@@H](NC(=O)NCc1ccc([O-])c(F)c1)CC2 ZINC000430048608 1036472839 /nfs/dbraw/zinc/47/28/39/1036472839.db2.gz XVFYWIYSCBXPOX-SFHVURJKSA-N -1 3 342.414 4.141 20 0 EIADHM CCS[C@@H]1CC[C@H](N(C)C(=O)c2cc([O-])cc(C(F)(F)F)c2)C1 ZINC000598691305 1036752121 /nfs/dbraw/zinc/75/21/21/1036752121.db2.gz UHVVCASSOQZPRO-GXTWGEPZSA-N -1 3 347.402 4.157 20 0 EIADHM CC(C)(C)OC(=O)c1cccc(CNCc2cccc([O-])c2Cl)c1 ZINC000590186665 1037006519 /nfs/dbraw/zinc/00/65/19/1037006519.db2.gz LANZELFXMJYPFL-UHFFFAOYSA-N -1 3 347.842 4.291 20 0 EIADHM C[C@@H]([N-]S(=O)(=O)c1ccc(Cl)s1)C(C)(C)c1ccccc1 ZINC000590299074 1037034328 /nfs/dbraw/zinc/03/43/28/1037034328.db2.gz CNDWSJHVVVQERZ-LLVKDONJSA-N -1 3 343.901 4.046 20 0 EIADHM CCC[C@@H]1CCCC[C@@H]1C[N-]S(=O)(=O)c1cc(F)ccc1Cl ZINC001212163371 1037053393 /nfs/dbraw/zinc/05/33/93/1037053393.db2.gz VKMRCDQXLHJIPX-CHWSQXEVSA-N -1 3 347.883 4.364 20 0 EIADHM CC[C@@H](CC(=O)N=c1cc(-c2ccccc2OC)[n-][nH]1)c1ccccc1 ZINC000590962399 1037214865 /nfs/dbraw/zinc/21/48/65/1037214865.db2.gz VRXKDLURGROSEP-HNNXBMFYSA-N -1 3 349.434 4.030 20 0 EIADHM CCN(Cc1ccc(Cl)c(Cl)c1)[C@H](C(=O)[O-])c1cccnc1 ZINC000573570505 1037605128 /nfs/dbraw/zinc/60/51/28/1037605128.db2.gz GKRWCMFIRCIUOI-HNNXBMFYSA-N -1 3 339.222 4.036 20 0 EIADHM Cc1cc(=O)[n-]c([C@H](C)Sc2nnc(-c3cccc(Cl)c3)o2)n1 ZINC000488483338 1037630860 /nfs/dbraw/zinc/63/08/60/1037630860.db2.gz SRKGUVQFRAXYBY-VIFPVBQESA-N -1 3 348.815 4.047 20 0 EIADHM CC[C@H](Oc1ccccc1C(C)C)C(=O)NCc1ccc([O-])c(F)c1 ZINC000606536911 1038149498 /nfs/dbraw/zinc/14/94/98/1038149498.db2.gz ZHNYIFGRRITRJO-SFHVURJKSA-N -1 3 345.414 4.129 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)NCc1cc2ccccc2s1 ZINC000489594664 1038155343 /nfs/dbraw/zinc/15/53/43/1038155343.db2.gz KLRVBGOYLOBKMA-UHFFFAOYSA-N -1 3 343.423 4.385 20 0 EIADHM CC1(C)CCCN(Cc2coc(-c3ccc(C(=O)[O-])cc3)n2)CC1 ZINC000574331565 1038173903 /nfs/dbraw/zinc/17/39/03/1038173903.db2.gz FSEIFCKLUQRFDQ-UHFFFAOYSA-N -1 3 328.412 4.052 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)N1CCCCC[C@H]1c1ccccc1 ZINC000606714745 1038225950 /nfs/dbraw/zinc/22/59/50/1038225950.db2.gz FPQDOUNKCMHWOG-SFHVURJKSA-N -1 3 342.414 4.358 20 0 EIADHM C[C@@H](N=c1ncnc2[nH][n-]cc1-2)c1ccccc1-c1ccc(Cl)cc1 ZINC000606896623 1038289335 /nfs/dbraw/zinc/28/93/35/1038289335.db2.gz NZDWKAXYRRKCEH-GFCCVEGCSA-N -1 3 349.825 4.220 20 0 EIADHM O=C(Nc1cc(F)ccc1[O-])[C@H](Oc1ccccc1)c1ccccc1 ZINC000533971364 1038744855 /nfs/dbraw/zinc/74/48/55/1038744855.db2.gz WMGORLBJOLSQFS-LJQANCHMSA-N -1 3 337.350 4.290 20 0 EIADHM Cc1cc(S(=O)(=O)[N-]c2cccc(Cl)c2F)cc(C)c1F ZINC000460455905 1038899169 /nfs/dbraw/zinc/89/91/69/1038899169.db2.gz QEIKYGFDLGTBOE-UHFFFAOYSA-N -1 3 331.771 4.036 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N1C[C@@H]2CCC[C@]2(C(F)(F)F)C1 ZINC000899420500 1039113682 /nfs/dbraw/zinc/11/36/82/1039113682.db2.gz HXACMRFCYWFMCD-KSSFIOAISA-N -1 3 349.352 4.350 20 0 EIADHM O=C(Nc1ccc([O-])c(C(F)(F)F)c1)[C@H]1CC[C@@H](C(F)(F)F)C1 ZINC000552116034 1039147485 /nfs/dbraw/zinc/14/74/85/1039147485.db2.gz ZVQZDQPHPIRIOB-JGVFFNPUSA-N -1 3 341.251 4.328 20 0 EIADHM C[C@]1(CNC(=O)c2cc([O-])c3ccccc3c2)CCOC2(CCC2)C1 ZINC000899490048 1039208581 /nfs/dbraw/zinc/20/85/81/1039208581.db2.gz ZCKWOSMVGGKPNA-FQEVSTJZSA-N -1 3 339.435 4.015 20 0 EIADHM CC(=O)c1cccc(NC(=O)[C@H](OC(C)(C)C)c2ccccc2)c1[O-] ZINC000552287643 1039340043 /nfs/dbraw/zinc/34/00/43/1039340043.db2.gz YEDRWVKMFCFVMJ-GOSISDBHSA-N -1 3 341.407 4.090 20 0 EIADHM CC(=O)c1cccc(NC(=O)c2ccc(Oc3cccnc3)cc2)c1[O-] ZINC000552287250 1039342021 /nfs/dbraw/zinc/34/20/21/1039342021.db2.gz MFYVEJGERSRZAH-UHFFFAOYSA-N -1 3 348.358 4.034 20 0 EIADHM COc1ccc(C(=O)Nc2cccc(C(C)=O)c2[O-])c2ccccc12 ZINC000552288393 1039343584 /nfs/dbraw/zinc/34/35/84/1039343584.db2.gz SODXCWSGKHERFE-UHFFFAOYSA-N -1 3 335.359 4.009 20 0 EIADHM O=C([O-])c1cc(Cl)ccc1CN1CCC(Cc2ccccc2)CC1 ZINC001142643484 1039524736 /nfs/dbraw/zinc/52/47/36/1039524736.db2.gz WRAOPVPILDVDBO-UHFFFAOYSA-N -1 3 343.854 4.493 20 0 EIADHM O=C(OCc1coc(-c2cccc(Cl)c2)n1)c1ccc([O-])cc1 ZINC000030725944 1040012235 /nfs/dbraw/zinc/01/22/35/1040012235.db2.gz ZGIWFVXAQQBPQW-UHFFFAOYSA-N -1 3 329.739 4.058 20 0 EIADHM Cc1ccc(-c2nc(NC(=O)[C@H](C)c3ccc4ccccc4c3)n[n-]2)o1 ZINC000479442603 1040348170 /nfs/dbraw/zinc/34/81/70/1040348170.db2.gz DMMJUOINPLTCBW-CYBMUJFWSA-N -1 3 346.390 4.269 20 0 EIADHM COc1ccc(C(=O)Nc2cc(Cl)ccc2[O-])c2ccccc12 ZINC000553759161 1040494980 /nfs/dbraw/zinc/49/49/80/1040494980.db2.gz DTFSNUYGNXKSKV-UHFFFAOYSA-N -1 3 327.767 4.460 20 0 EIADHM CC(C)c1cnc(-c2ccc(NC([O-])=NO[C@H]3CCCCO3)cc2)o1 ZINC000160464826 1040534524 /nfs/dbraw/zinc/53/45/24/1040534524.db2.gz YKBWRHGRCIMXPD-INIZCTEOSA-N -1 3 345.399 4.045 20 0 EIADHM CC(C)c1cnc(-c2ccc(NC(=O)[N-]O[C@H]3CCCCO3)cc2)o1 ZINC000160464826 1040534544 /nfs/dbraw/zinc/53/45/44/1040534544.db2.gz YKBWRHGRCIMXPD-INIZCTEOSA-N -1 3 345.399 4.045 20 0 EIADHM O=C(N=c1cc(-c2ccccc2)[n-][nH]1)c1occc1-c1ccccc1 ZINC000435676920 1040537019 /nfs/dbraw/zinc/53/70/19/1040537019.db2.gz ZWQZQTNINVFIEF-UHFFFAOYSA-N -1 3 329.359 4.011 20 0 EIADHM COc1cc(C)c([N-]S(=O)(=O)c2ccc(Cl)cc2C)cc1C ZINC000435718140 1040570534 /nfs/dbraw/zinc/57/05/34/1040570534.db2.gz BFQMCUBAWBLYBP-UHFFFAOYSA-N -1 3 339.844 4.075 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)N1CCCC[C@H]1c1ccc(F)cc1 ZINC000483810430 1041019628 /nfs/dbraw/zinc/01/96/28/1041019628.db2.gz ZENSIXLSGXITSL-KRWDZBQOSA-N -1 3 346.377 4.107 20 0 EIADHM CC(C)(C)OCc1ccccc1C(=O)N=c1cc(-c2ccccc2)[n-][nH]1 ZINC000538057692 1041028258 /nfs/dbraw/zinc/02/82/58/1041028258.db2.gz ZFORIJWGWXHFPF-UHFFFAOYSA-N -1 3 349.434 4.066 20 0 EIADHM CCc1cc(=O)[n-]c(CN[C@@H](c2ccc(Cl)cc2)[C@@H](C)CC)n1 ZINC000538214627 1041171017 /nfs/dbraw/zinc/17/10/17/1041171017.db2.gz UGMCSMNLINVPEZ-KPZWWZAWSA-N -1 3 333.863 4.275 20 0 EIADHM CCc1ncc(CN[C@@H](CC(=O)[O-])c2ccc(C(C)C)cc2)s1 ZINC000904001689 1041247160 /nfs/dbraw/zinc/24/71/60/1041247160.db2.gz DGSANNMLPFYBGT-INIZCTEOSA-N -1 3 332.469 4.135 20 0 EIADHM CCc1ccc([O-])c(C(=O)N2CCC(c3cccc(F)c3F)CC2)c1 ZINC000515941416 1041266560 /nfs/dbraw/zinc/26/65/60/1041266560.db2.gz UIAMYPPBIOBSEJ-UHFFFAOYSA-N -1 3 345.389 4.253 20 0 EIADHM C=Cc1ccc(S(=O)(=O)[N-]c2ccc(OC(F)(F)F)cc2)cc1 ZINC000436476764 1041274393 /nfs/dbraw/zinc/27/43/93/1041274393.db2.gz FZOSGTNHLGUBPL-UHFFFAOYSA-N -1 3 343.326 4.029 20 0 EIADHM COc1c(C)cc(C)cc1S(=O)(=O)[N-]c1cccc(C)c1Cl ZINC000554617805 1041281847 /nfs/dbraw/zinc/28/18/47/1041281847.db2.gz YBFPLWBQHGERTD-UHFFFAOYSA-N -1 3 339.844 4.075 20 0 EIADHM Cc1cccc(C(=O)Nc2cccc(OCC(F)(F)F)c2C)c1[O-] ZINC000436519541 1041302692 /nfs/dbraw/zinc/30/26/92/1041302692.db2.gz XKVNKDUPZDDTQT-UHFFFAOYSA-N -1 3 339.313 4.202 20 0 EIADHM CCOc1ccc(-c2noc(-c3cccc(OC)c3[O-])n2)cc1Cl ZINC000436522745 1041305551 /nfs/dbraw/zinc/30/55/51/1041305551.db2.gz NOKHQXYDLMHYBS-UHFFFAOYSA-N -1 3 346.770 4.170 20 0 EIADHM O=C([O-])CCc1cccc(CNCc2ccc(C(F)(F)F)s2)c1 ZINC000904026654 1041306750 /nfs/dbraw/zinc/30/67/50/1041306750.db2.gz XLLSLMHSXYRRMC-UHFFFAOYSA-N -1 3 343.370 4.074 20 0 EIADHM CC[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)c1ccc(OC)cc1[O-] ZINC000436540842 1041333465 /nfs/dbraw/zinc/33/34/65/1041333465.db2.gz ULRBATNQLAXEBW-MJGOQNOKSA-N -1 3 339.435 4.199 20 0 EIADHM CC(C)c1ccc(-c2nc([C@H](C)C(=O)OC(C)(C)C)no2)c([O-])c1 ZINC000436577384 1041340471 /nfs/dbraw/zinc/34/04/71/1041340471.db2.gz OPXLLOMOPWSFSH-NSHDSACASA-N -1 3 332.400 4.011 20 0 EIADHM CC[C@H](CN(CC)C(=O)c1ccc(OC)cc1[O-])c1ccccc1 ZINC000436565488 1041346456 /nfs/dbraw/zinc/34/64/56/1041346456.db2.gz MWMCRAWCSWLCLA-OAHLLOKOSA-N -1 3 327.424 4.057 20 0 EIADHM CC(C)c1ccc(C(=O)N2CCCC[C@@H]2c2cccn2C)c([O-])c1 ZINC000436570859 1041348746 /nfs/dbraw/zinc/34/87/46/1041348746.db2.gz BDNRSJHQRFOZKU-GOSISDBHSA-N -1 3 326.440 4.222 20 0 EIADHM CC(C)c1ccc(C(=O)N2C[C@@H](c3ccccc3)OC[C@H]2C)c([O-])c1 ZINC000436569302 1041349513 /nfs/dbraw/zinc/34/95/13/1041349513.db2.gz CIVOQBGDOYEUQX-QRWLVFNGSA-N -1 3 339.435 4.118 20 0 EIADHM Cc1ccc(C(=O)N(CCC(F)(F)F)Cc2ccccc2)c([O-])c1 ZINC000436584488 1041360952 /nfs/dbraw/zinc/36/09/52/1041360952.db2.gz PWBWFEDFRBMHAQ-UHFFFAOYSA-N -1 3 337.341 4.295 20 0 EIADHM Cc1occc1CN(C)C(=O)c1cc(CCc2ccccc2)ccc1[O-] ZINC000436604402 1041367744 /nfs/dbraw/zinc/36/77/44/1041367744.db2.gz CKWSLNBZNACOSR-UHFFFAOYSA-N -1 3 349.430 4.351 20 0 EIADHM CC(C)N(CC(F)F)C(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436610502 1041372291 /nfs/dbraw/zinc/37/22/91/1041372291.db2.gz XERPRNYJMSPILB-UHFFFAOYSA-N -1 3 333.378 4.099 20 0 EIADHM Cc1ccc(C(=O)Nc2cc(Cc3ccccn3)ccc2C)c([O-])c1 ZINC000436631481 1041382125 /nfs/dbraw/zinc/38/21/25/1041382125.db2.gz SHCCSHUPPRCVAJ-UHFFFAOYSA-N -1 3 332.403 4.247 20 0 EIADHM Cc1cccc(C(=O)Nc2cc(Cc3ccccn3)ccc2C)c1[O-] ZINC000436635188 1041385705 /nfs/dbraw/zinc/38/57/05/1041385705.db2.gz MWJFCPCZMRBDCE-UHFFFAOYSA-N -1 3 332.403 4.247 20 0 EIADHM CC(C)c1ccc(C(=O)NCc2coc(-c3cccs3)n2)c([O-])c1 ZINC000436650216 1041391957 /nfs/dbraw/zinc/39/19/57/1041391957.db2.gz REKDDDCBBGUVSH-UHFFFAOYSA-N -1 3 342.420 4.162 20 0 EIADHM COc1cc(-c2nc3cc(C)c(C)cc3[nH]2)cc(Br)c1[O-] ZINC000436656282 1041396884 /nfs/dbraw/zinc/39/68/84/1041396884.db2.gz MHOIPORXKSIXNH-UHFFFAOYSA-N -1 3 347.212 4.323 20 0 EIADHM COc1ccc(C(=O)N2C[C@H](C)CC[C@H]2c2ccccc2)c([O-])c1 ZINC000436657302 1041412298 /nfs/dbraw/zinc/41/22/98/1041412298.db2.gz LDMUSYVCIGNSQM-KDOFPFPSSA-N -1 3 325.408 4.014 20 0 EIADHM CC(=O)c1ccc(C(=O)N2CCCC[C@H]2c2ccc(F)cc2)cc1[O-] ZINC000436658915 1041413590 /nfs/dbraw/zinc/41/35/90/1041413590.db2.gz WIVDCNTUVWXAOR-SFHVURJKSA-N -1 3 341.382 4.101 20 0 EIADHM COc1cccc(C(=O)N2CCc3c2cccc3-c2ccccc2)c1[O-] ZINC000436700467 1041432106 /nfs/dbraw/zinc/43/21/06/1041432106.db2.gz VZXHIMPQUUMNCK-UHFFFAOYSA-N -1 3 345.398 4.271 20 0 EIADHM CC(C)c1ccc(C(=O)N2CCC(CC(F)(F)F)CC2)c([O-])c1 ZINC000436725785 1041437289 /nfs/dbraw/zinc/43/72/89/1041437289.db2.gz ZXUVYUKJEBLRNU-UHFFFAOYSA-N -1 3 329.362 4.320 20 0 EIADHM Cc1ccoc1CN(C)C(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436745139 1041452815 /nfs/dbraw/zinc/45/28/15/1041452815.db2.gz AVBIPCAINOTZOG-UHFFFAOYSA-N -1 3 335.403 4.157 20 0 EIADHM COc1ccc(C(=O)N([C@@H](C)c2ccc(Cl)cc2)C2CC2)c([O-])c1 ZINC000436800126 1041479513 /nfs/dbraw/zinc/47/95/13/1041479513.db2.gz SXMZTIILWGQJLA-LBPRGKRZSA-N -1 3 345.826 4.420 20 0 EIADHM Cc1ccc(C(=O)N2CCC(Cc3ccc(F)c(F)c3)CC2)c([O-])c1 ZINC000436819153 1041486714 /nfs/dbraw/zinc/48/67/14/1041486714.db2.gz CSSJBWUQOACFHN-UHFFFAOYSA-N -1 3 345.389 4.074 20 0 EIADHM CCCN(C(=O)c1ccc(CC)cc1[O-])[C@H]1CCCc2cccnc21 ZINC000436834789 1041497610 /nfs/dbraw/zinc/49/76/10/1041497610.db2.gz ATAUWAZYZGKMBL-SFHVURJKSA-N -1 3 338.451 4.279 20 0 EIADHM CCc1ccc(C(=O)N2C[C@@H](c3ccc(F)cc3)C[C@@H]2C)c([O-])c1 ZINC000436834705 1041498928 /nfs/dbraw/zinc/49/89/28/1041498928.db2.gz QVTLHQGRHVFVJN-BBRMVZONSA-N -1 3 327.399 4.112 20 0 EIADHM CCN(C(=O)c1ccc2c(c1[O-])OC(C)(C)C2)c1ccccc1C ZINC000538743597 1041517640 /nfs/dbraw/zinc/51/76/40/1041517640.db2.gz QJIZUWFHOINBPO-UHFFFAOYSA-N -1 3 325.408 4.081 20 0 EIADHM CCN(C)[C@H](c1nc(-c2ccc([O-])cc2Cl)no1)c1ccccc1 ZINC000436870222 1041528812 /nfs/dbraw/zinc/52/88/12/1041528812.db2.gz GZZSGNUWGFOXNA-INIZCTEOSA-N -1 3 343.814 4.137 20 0 EIADHM CCc1ccc(-c2nc([C@@H](OC)c3ccccc3Cl)no2)c([O-])c1 ZINC000436874561 1041533229 /nfs/dbraw/zinc/53/32/29/1041533229.db2.gz WGJVBFWOKWOFKU-INIZCTEOSA-N -1 3 344.798 4.394 20 0 EIADHM CCc1ccc([O-])c(C(=O)Nc2cc(-c3nc(C)co3)ccc2C)c1 ZINC000538781605 1041534600 /nfs/dbraw/zinc/53/46/00/1041534600.db2.gz MXNFDBBQMICLIY-UHFFFAOYSA-N -1 3 336.391 4.479 20 0 EIADHM CCCOC1(c2noc(-c3cccc(OC)c3[O-])n2)CCCCC1 ZINC000436880372 1041539668 /nfs/dbraw/zinc/53/96/68/1041539668.db2.gz JEVTVMDYNDQRFD-UHFFFAOYSA-N -1 3 332.400 4.037 20 0 EIADHM CCCOC1(c2noc(-c3cc(OC)ccc3[O-])n2)CCCCC1 ZINC000436882822 1041540651 /nfs/dbraw/zinc/54/06/51/1041540651.db2.gz WPJCWTCXBUKGMK-UHFFFAOYSA-N -1 3 332.400 4.037 20 0 EIADHM CCc1ccc([O-])c(C(=O)N2CCCCC[C@@H]2[C@@H]2CCCCC2=O)c1 ZINC000538784915 1041543105 /nfs/dbraw/zinc/54/31/05/1041543105.db2.gz QVMADPFZVWPUBA-FUHWJXTLSA-N -1 3 343.467 4.099 20 0 EIADHM [O-]c1ccc(OCc2ccccc2)cc1-c1nc(-c2cccnc2)no1 ZINC000436895704 1041551372 /nfs/dbraw/zinc/55/13/72/1041551372.db2.gz YJMKRKQFEZBEPD-UHFFFAOYSA-N -1 3 345.358 4.083 20 0 EIADHM [O-]c1ccc(Cc2ccccc2)cc1-c1nc(-c2cccnc2)no1 ZINC000436895463 1041551432 /nfs/dbraw/zinc/55/14/32/1041551432.db2.gz WZDRALBFHVTKKI-UHFFFAOYSA-N -1 3 329.359 4.095 20 0 EIADHM COc1cc(-c2noc(-c3ccc(C)cc3[O-])n2)ccc1OC(F)F ZINC000436896190 1041551922 /nfs/dbraw/zinc/55/19/22/1041551922.db2.gz MBUYCHGNSXZSLC-UHFFFAOYSA-N -1 3 348.305 4.028 20 0 EIADHM Cc1ccc(C(=O)N2CCC(c3cccc(Cl)c3)CC2)c([O-])c1 ZINC000436924168 1041559245 /nfs/dbraw/zinc/55/92/45/1041559245.db2.gz VYHLQFTWFBAQMR-UHFFFAOYSA-N -1 3 329.827 4.374 20 0 EIADHM C[C@@H]1CCCN(C(=O)c2cc(Oc3ccccc3)ccc2[O-])CC1 ZINC000436946090 1041569558 /nfs/dbraw/zinc/56/95/58/1041569558.db2.gz COEKFLVCTIWKFX-OAHLLOKOSA-N -1 3 325.408 4.447 20 0 EIADHM Cc1ccc(C(=O)N(CC(C)C)[C@H]2CCCc3cccnc32)c([O-])c1 ZINC000436957444 1041575347 /nfs/dbraw/zinc/57/53/47/1041575347.db2.gz UTSASWJLPXRENW-SFHVURJKSA-N -1 3 338.451 4.271 20 0 EIADHM COc1cc(NC(=O)c2cccc(C)c2[O-])cc(OC)c1C(C)C ZINC000436974059 1041577840 /nfs/dbraw/zinc/57/78/40/1041577840.db2.gz ZWBAHYVCOUOTEI-UHFFFAOYSA-N -1 3 329.396 4.094 20 0 EIADHM COc1cc(NC(=O)c2cc(C)ccc2[O-])cc(OC)c1C(C)C ZINC000436976481 1041579764 /nfs/dbraw/zinc/57/97/64/1041579764.db2.gz BPCUCJLPZXKZIZ-UHFFFAOYSA-N -1 3 329.396 4.094 20 0 EIADHM Cc1ccc(-c2ocnc2C(=O)[N-]c2cc(F)cc(F)c2F)cc1 ZINC000516501655 1041608349 /nfs/dbraw/zinc/60/83/49/1041608349.db2.gz KTFRNDKZMILAEZ-UHFFFAOYSA-N -1 3 332.281 4.320 20 0 EIADHM CCC(C)(C)NC(=O)c1ccc(NCc2cc([O-])cc(F)c2)cc1 ZINC000437124469 1041666880 /nfs/dbraw/zinc/66/68/80/1041666880.db2.gz BWNKBQJEEZCWRC-UHFFFAOYSA-N -1 3 330.403 4.062 20 0 EIADHM Cc1cccc(C(=O)Nc2ccc(OC(F)F)c(Cl)c2)c1[O-] ZINC000301998298 1042047315 /nfs/dbraw/zinc/04/73/15/1042047315.db2.gz QLZAUJHBVHLRGO-UHFFFAOYSA-N -1 3 327.714 4.208 20 0 EIADHM [O-]c1cc(F)cc(CN2CCC[C@@H]2c2nc3cc(Cl)ccc3[nH]2)c1 ZINC000438254034 1042106875 /nfs/dbraw/zinc/10/68/75/1042106875.db2.gz BKCOXEAMTMKUCA-QGZVFWFLSA-N -1 3 345.805 4.398 20 0 EIADHM Cc1ccc([N-]S(=O)(=O)c2ccc(C)c(C(F)(F)F)c2)cc1 ZINC000303041095 1042265894 /nfs/dbraw/zinc/26/58/94/1042265894.db2.gz SIBKKRACNSPJFQ-UHFFFAOYSA-N -1 3 329.343 4.123 20 0 EIADHM CCOCc1ccc([N-]S(=O)(=O)c2ccc(CC(C)C)cc2)cc1 ZINC000438725215 1042326465 /nfs/dbraw/zinc/32/64/65/1042326465.db2.gz PQXOXMJDNJCBEG-UHFFFAOYSA-N -1 3 347.480 4.222 20 0 EIADHM O=C(C[C@H](Cc1ccccc1)c1ccccc1)Nc1ncccc1[O-] ZINC000438882298 1042404307 /nfs/dbraw/zinc/40/43/07/1042404307.db2.gz DNVQQBVTTAKNKL-SFHVURJKSA-N -1 3 332.403 4.142 20 0 EIADHM C[C@@H](CNC(=O)CCCc1ccc([O-])c(F)c1)Sc1ccccc1 ZINC000469422066 1042411636 /nfs/dbraw/zinc/41/16/36/1042411636.db2.gz KCRVPEJWHJNZJR-AWEZNQCLSA-N -1 3 347.455 4.151 20 0 EIADHM Cc1cccc2c(CCC(=O)Nc3cc(Cl)ccc3[O-])c[nH]c21 ZINC000439097306 1042491820 /nfs/dbraw/zinc/49/18/20/1042491820.db2.gz NSHRFZQVTVAJMV-UHFFFAOYSA-N -1 3 328.799 4.407 20 0 EIADHM Cc1ccc(-c2ocnc2C(=O)[N-]c2cc(F)c(F)cc2F)cc1 ZINC000172980712 1042523817 /nfs/dbraw/zinc/52/38/17/1042523817.db2.gz ICZYBUWOWVAHJN-UHFFFAOYSA-N -1 3 332.281 4.320 20 0 EIADHM O=S(=O)(CCc1cccc(Cl)c1)[N-]c1cc(Cl)ccc1F ZINC000506568364 1042619276 /nfs/dbraw/zinc/61/92/76/1042619276.db2.gz NXLICHHQMQLDPE-UHFFFAOYSA-N -1 3 348.226 4.117 20 0 EIADHM O=C(/C=C\c1ccc2ccc(Cl)cc2n1)Nc1cccc([O-])c1F ZINC000492777585 1042748383 /nfs/dbraw/zinc/74/83/83/1042748383.db2.gz PFZHFMXVJVXTED-HJWRWDBZSA-N -1 3 342.757 4.385 20 0 EIADHM CCCCn1ncc(NC(=O)c2cc([O-])ccc2Cl)c1C(C)C ZINC000506662625 1042748567 /nfs/dbraw/zinc/74/85/67/1042748567.db2.gz SMAFJPSSRTWBPN-UHFFFAOYSA-N -1 3 335.835 4.418 20 0 EIADHM [O-]c1cc(Cl)ccc1NC(=S)NCCSc1ccccc1 ZINC000753902020 1042873755 /nfs/dbraw/zinc/87/37/55/1042873755.db2.gz NBDYQMWZSRGJPO-UHFFFAOYSA-N -1 3 338.885 4.124 20 0 EIADHM Cc1nc(-c2cccc(NC(=O)c3ccc(C)c(C)c3[O-])c2)[nH]c1C ZINC000729525810 1043072191 /nfs/dbraw/zinc/07/21/91/1043072191.db2.gz LFYYACFTXQRSFR-UHFFFAOYSA-N -1 3 335.407 4.268 20 0 EIADHM O=C([N-]c1csc(-c2ccccc2)n1)c1c(F)ccc(F)c1F ZINC000672333376 1043120990 /nfs/dbraw/zinc/12/09/90/1043120990.db2.gz FLLASCMDSYTPET-UHFFFAOYSA-N -1 3 334.322 4.480 20 0 EIADHM C[C@@H](c1ccc(Cl)cc1Cl)N(C)C(=O)c1cccc(O)c1[O-] ZINC000186886017 1043131173 /nfs/dbraw/zinc/13/11/73/1043131173.db2.gz GROGAVJCPPDEOJ-VIFPVBQESA-N -1 3 340.206 4.238 20 0 EIADHM CC[C@H](NC(=O)NCc1ccc([O-])c(F)c1)C(C)(C)c1ccccc1 ZINC000465968188 1043193802 /nfs/dbraw/zinc/19/38/02/1043193802.db2.gz MSCVRWPLTUFUTB-SFHVURJKSA-N -1 3 344.430 4.087 20 0 EIADHM COc1ccc([C@@H](C)N(C)C(=O)c2cc([O-])c3ccccc3c2)cc1 ZINC000525923902 1043234734 /nfs/dbraw/zinc/23/47/34/1043234734.db2.gz LMKPXEZJANGLKP-CQSZACIVSA-N -1 3 335.403 4.387 20 0 EIADHM CCOc1ccccc1CN(C)C(=O)c1cc([O-])c2ccccc2c1 ZINC000526869210 1043243323 /nfs/dbraw/zinc/24/33/23/1043243323.db2.gz FPINIFHQBPPUJH-UHFFFAOYSA-N -1 3 335.403 4.216 20 0 EIADHM C[C@H](NC(=O)c1cc([O-])c2ccccc2c1)c1c(F)cccc1F ZINC000526836232 1043243779 /nfs/dbraw/zinc/24/37/79/1043243779.db2.gz WTDVKLJDNVDDPC-NSHDSACASA-N -1 3 327.330 4.315 20 0 EIADHM Cc1nn(-c2ccccc2)cc1NC(=O)c1cc([O-])c2ccccc2c1 ZINC000526924099 1043246123 /nfs/dbraw/zinc/24/61/23/1043246123.db2.gz OXBKZUROIOYGNS-UHFFFAOYSA-N -1 3 343.386 4.292 20 0 EIADHM C[C@@H](NC(=O)c1cc([O-])c2ccccc2c1)c1cccc(F)c1F ZINC000527170350 1043252375 /nfs/dbraw/zinc/25/23/75/1043252375.db2.gz NZLXAWFHRVCUPL-LLVKDONJSA-N -1 3 327.330 4.315 20 0 EIADHM C[C@@H]([C@@H]1Cc2ccccc2O1)N(C)C(=O)c1cc([O-])c2ccccc2c1 ZINC000527166885 1043253237 /nfs/dbraw/zinc/25/32/37/1043253237.db2.gz PBBMWNLZFJPOOL-QKKBWIMNSA-N -1 3 347.414 4.010 20 0 EIADHM Cc1csc(C2(NC(=O)c3cc([O-])c4ccccc4c3)CCC2)n1 ZINC000280975757 1043262158 /nfs/dbraw/zinc/26/21/58/1043262158.db2.gz RWIYPNPHAICLAA-UHFFFAOYSA-N -1 3 338.432 4.120 20 0 EIADHM CCn1c2cc(F)ccc2nc1NC(=O)c1cc([O-])c2ccccc2c1 ZINC000527463809 1043263226 /nfs/dbraw/zinc/26/32/26/1043263226.db2.gz GSVVETXTFREISM-UHFFFAOYSA-N -1 3 349.365 4.306 20 0 EIADHM Cc1cccc([C@H]2CCCN2C(=O)NCc2ccc([O-])c(F)c2)c1C ZINC000465981531 1043274412 /nfs/dbraw/zinc/27/44/12/1043274412.db2.gz NXNAPSVGYPGYAM-GOSISDBHSA-N -1 3 342.414 4.195 20 0 EIADHM Cc1ccc([C@@H]2CCCCN2C(=O)NCc2ccc([O-])c(F)c2)cc1 ZINC000465983205 1043284786 /nfs/dbraw/zinc/28/47/86/1043284786.db2.gz REEZCRHWKSFDQZ-SFHVURJKSA-N -1 3 342.414 4.277 20 0 EIADHM CCC[C@H](CCc1ccccc1)NC(=O)NCc1ccc([O-])c(F)c1 ZINC000465984802 1043292858 /nfs/dbraw/zinc/29/28/58/1043292858.db2.gz FBUQWGXEWKXQFA-QGZVFWFLSA-N -1 3 344.430 4.132 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@@H](C)CCCC(C)C)nc2)n1 ZINC000428118677 1043331799 /nfs/dbraw/zinc/33/17/99/1043331799.db2.gz XCGRHGHGOUJYCU-AWEZNQCLSA-N -1 3 328.460 4.433 20 0 EIADHM CCN(CC)C(=O)c1ccc(Nc2cccc(Cl)c2[O-])c(OC)c1 ZINC001212468983 1043335626 /nfs/dbraw/zinc/33/56/26/1043335626.db2.gz XWRUOVFZWYOUKF-UHFFFAOYSA-N -1 3 348.830 4.280 20 0 EIADHM CC(=O)c1csc(C(=O)[N-]c2nnc(C3CCCCC3)s2)c1 ZINC000730165878 1043463850 /nfs/dbraw/zinc/46/38/50/1043463850.db2.gz JBBUUSAZCXDRSU-UHFFFAOYSA-N -1 3 335.454 4.102 20 0 EIADHM CSc1ccncc1[N-]C(=O)c1nc(-c2cccs2)oc1C ZINC000750122429 1043489158 /nfs/dbraw/zinc/48/91/58/1043489158.db2.gz ZTROYPKVPVPWRK-UHFFFAOYSA-N -1 3 331.422 4.081 20 0 EIADHM Cc1ccc([N-]S(=O)(=O)c2ccc(CC(F)(F)F)cc2)c(C)c1 ZINC000189224039 1043489602 /nfs/dbraw/zinc/48/96/02/1043489602.db2.gz SDPCJJAIBJQTDW-UHFFFAOYSA-N -1 3 343.370 4.209 20 0 EIADHM [O-]c1c(F)cc(F)cc1Nc1c(F)cccc1OC1CCOCC1 ZINC001212491127 1043584667 /nfs/dbraw/zinc/58/46/67/1043584667.db2.gz JTUJFPMODMNPCV-UHFFFAOYSA-N -1 3 339.313 4.111 20 0 EIADHM CCc1cccc(C(=O)Nc2ccc(Oc3ccc(C)nn3)cc2)c1[O-] ZINC000674361645 1043634960 /nfs/dbraw/zinc/63/49/60/1043634960.db2.gz USJNWNMGAPCUFP-UHFFFAOYSA-N -1 3 349.390 4.098 20 0 EIADHM CN(Cc1cccc2ccccc21)C(=O)NCc1ccc([O-])c(F)c1 ZINC000172626540 1043809345 /nfs/dbraw/zinc/80/93/45/1043809345.db2.gz CXUHMQWXADZMOW-UHFFFAOYSA-N -1 3 338.382 4.026 20 0 EIADHM CCc1ccc([C@H](NC(=O)c2nnc3ccccc3c2[O-])C(C)C)cc1 ZINC000731894148 1043841610 /nfs/dbraw/zinc/84/16/10/1043841610.db2.gz JOLCHGDJKIXYND-GOSISDBHSA-N -1 3 349.434 4.025 20 0 EIADHM CC(C)Oc1ccc(CO[N-]C(=O)CCCc2ccccc2)cc1 ZINC000732803999 1044008586 /nfs/dbraw/zinc/00/85/86/1044008586.db2.gz CIHJXDPJBPASAN-UHFFFAOYSA-N -1 3 327.424 4.045 20 0 EIADHM CCc1ccc([O-])c(C(=O)Nc2cccc(OCc3cccnc3)c2)c1 ZINC000499705783 1044275189 /nfs/dbraw/zinc/27/51/89/1044275189.db2.gz YMXDFRLQMYBQHT-UHFFFAOYSA-N -1 3 348.402 4.181 20 0 EIADHM Cc1csc(CCCCNC(=O)c2cc3sccc3c([O-])c2)n1 ZINC001143591090 1044330206 /nfs/dbraw/zinc/33/02/06/1044330206.db2.gz FUHUIRVHPVUIIU-UHFFFAOYSA-N -1 3 346.477 4.125 20 0 EIADHM O=C(Cc1cccc2ccccc21)[N-]OCc1ccc(Cl)cc1 ZINC000733895239 1044402874 /nfs/dbraw/zinc/40/28/74/1044402874.db2.gz NOSZWVGDEUZDJP-UHFFFAOYSA-N -1 3 325.795 4.284 20 0 EIADHM O=C([N-]c1cc(F)c(F)cc1F)c1nc(-c2ccccc2)cs1 ZINC000522236628 1044414021 /nfs/dbraw/zinc/41/40/21/1044414021.db2.gz PRKCCMRIGAQRNK-UHFFFAOYSA-N -1 3 334.322 4.480 20 0 EIADHM O=C(CCC1CCCCC1)[N-]OCc1ccc(OC(F)F)cc1 ZINC000733998130 1044458296 /nfs/dbraw/zinc/45/82/96/1044458296.db2.gz NYFYRJLTPZTAPC-UHFFFAOYSA-N -1 3 327.371 4.196 20 0 EIADHM CCOc1ccc(C(C)=O)cc1CO[N-]C(=O)CCC1CCCCC1 ZINC000733998096 1044458389 /nfs/dbraw/zinc/45/83/89/1044458389.db2.gz NMSONEIHGUCGHD-UHFFFAOYSA-N -1 3 347.455 4.196 20 0 EIADHM CCCOc1ccc([N-]S(=O)(=O)c2ccc(C(F)F)cc2)cc1 ZINC000673480384 1044492823 /nfs/dbraw/zinc/49/28/23/1044492823.db2.gz GWTSBOJKSVZVBV-UHFFFAOYSA-N -1 3 341.379 4.214 20 0 EIADHM CC[C@H]1CCCN(Cn2c(Cc3cccs3)n[n-]c2=S)CC1 ZINC000153335733 1044723914 /nfs/dbraw/zinc/72/39/14/1044723914.db2.gz WVKAHECKLLDWQO-ZDUSSCGKSA-N -1 3 336.530 4.063 20 0 EIADHM S=c1nc(-c2ccccn2)[n-]n1CN(CC1CC1)C1CCCCC1 ZINC000735299080 1044786587 /nfs/dbraw/zinc/78/65/87/1044786587.db2.gz YVSNJFVSGQAGNZ-UHFFFAOYSA-N -1 3 343.500 4.005 20 0 EIADHM CC(C)CCN(Cn1[n-]c(-c2ccccn2)nc1=S)C1CCCC1 ZINC000735298746 1044788553 /nfs/dbraw/zinc/78/85/53/1044788553.db2.gz ZPBIIPFULGMHGJ-UHFFFAOYSA-N -1 3 345.516 4.251 20 0 EIADHM O=S(=O)(/C=C/c1ccc(F)cc1)[N-]c1ccccc1C(F)(F)F ZINC000176582128 1044799829 /nfs/dbraw/zinc/79/98/29/1044799829.db2.gz DECFUTVMFFSEJA-MDZDMXLPSA-N -1 3 345.317 4.257 20 0 EIADHM Cc1ccc(Cl)c([N-]S(=O)(=O)c2cccc3cc(C)cnc32)c1 ZINC000474313973 1044856916 /nfs/dbraw/zinc/85/69/16/1044856916.db2.gz QOARTSPSMFZVKQ-UHFFFAOYSA-N -1 3 346.839 4.306 20 0 EIADHM Cc1nc(C(C)(C)[N-]C(=O)C(F)(F)c2ccc(F)cc2)sc1C ZINC000736516596 1044952421 /nfs/dbraw/zinc/95/24/21/1044952421.db2.gz YDEPHUTUWQFYDT-UHFFFAOYSA-N -1 3 342.386 4.042 20 0 EIADHM CC(C)(C)[C@H]1CCCN(Cn2[n-]c(-c3ccccn3)nc2=S)CC1 ZINC000738237626 1045052427 /nfs/dbraw/zinc/05/24/27/1045052427.db2.gz AOMCJJFVHVWBCX-AWEZNQCLSA-N -1 3 345.516 4.108 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N(Cc1ccccc1)CC(F)F ZINC000472208975 1045069076 /nfs/dbraw/zinc/06/90/76/1045069076.db2.gz ODANRGUWVXABRV-UHFFFAOYSA-N -1 3 341.357 4.453 20 0 EIADHM CC[C@@]1(C(=O)[O-])CCCN(Cc2csc(-c3ccccc3F)n2)C1 ZINC000923471476 1045120258 /nfs/dbraw/zinc/12/02/58/1045120258.db2.gz REFIDINOBVMPRV-GOSISDBHSA-N -1 3 348.443 4.026 20 0 EIADHM CC(C)(C(=O)[O-])[C@@H]1CCCN(Cc2cc(Cl)ccc2Cl)C1 ZINC000135040011 1045195433 /nfs/dbraw/zinc/19/54/33/1045195433.db2.gz OMLPCYDUNPFURP-GFCCVEGCSA-N -1 3 330.255 4.316 20 0 EIADHM Cc1nc(NC(=O)[N-]OCc2ccccc2)sc1-c1ccccc1 ZINC000915324069 1045270306 /nfs/dbraw/zinc/27/03/06/1045270306.db2.gz IZLNVMMFAFYYPF-UHFFFAOYSA-N -1 3 339.420 4.372 20 0 EIADHM O=C(Nc1cc(Br)ccc1F)c1cc([O-])ccc1Cl ZINC000236557199 1045359067 /nfs/dbraw/zinc/35/90/67/1045359067.db2.gz AHFUSAYLWWSXDW-UHFFFAOYSA-N -1 3 344.567 4.200 20 0 EIADHM O=C(Nc1ccc(Br)cc1)c1cc([O-])ccc1Cl ZINC000236557614 1045359448 /nfs/dbraw/zinc/35/94/48/1045359448.db2.gz KPBBOVFJFAODPS-UHFFFAOYSA-N -1 3 326.577 4.060 20 0 EIADHM O=C(CCCOc1ccccc1Cl)Nc1cc(Cl)ccc1[O-] ZINC000060270457 1045514998 /nfs/dbraw/zinc/51/49/98/1045514998.db2.gz BTYLHEIGTSUEKZ-UHFFFAOYSA-N -1 3 340.206 4.497 20 0 EIADHM C[C@H](NCc1cc(=O)oc2cc([O-])c(Cl)cc12)c1cccs1 ZINC000915873064 1045532368 /nfs/dbraw/zinc/53/23/68/1045532368.db2.gz XURQKGGXWOCQSY-VIFPVBQESA-N -1 3 335.812 4.064 20 0 EIADHM CCOc1ccc([N-]S(=O)(=O)c2ccc3c(c2)CCCC3)c(C)c1 ZINC000614867730 1045566949 /nfs/dbraw/zinc/56/69/49/1045566949.db2.gz OUHKTZKJCMVDAF-UHFFFAOYSA-N -1 3 345.464 4.073 20 0 EIADHM Cc1cc(NC(=O)c2cc3sccc3c([O-])c2)ccc1N(C)C ZINC000791324737 1045720567 /nfs/dbraw/zinc/72/05/67/1045720567.db2.gz PCROJEZONTVCKU-UHFFFAOYSA-N -1 3 326.421 4.234 20 0 EIADHM COc1ccccc1C(C)(C)NC(=O)c1cc2sccc2c([O-])c1 ZINC000791350029 1045728152 /nfs/dbraw/zinc/72/81/52/1045728152.db2.gz FIODIPRZXACXEV-UHFFFAOYSA-N -1 3 341.432 4.281 20 0 EIADHM Cc1ccc(C[C@@H](C)NC(=O)c2cc3sccc3c([O-])c2)s1 ZINC000791367148 1045731049 /nfs/dbraw/zinc/73/10/49/1045731049.db2.gz PYKXCYZIHDUFMB-SNVBAGLBSA-N -1 3 331.462 4.338 20 0 EIADHM Cc1cc(=O)[n-]c(CS[C@H](C)c2ncc(-c3ccccc3)o2)n1 ZINC000763208027 1045741384 /nfs/dbraw/zinc/74/13/84/1045741384.db2.gz HCRLAUSMRSNMSH-GFCCVEGCSA-N -1 3 327.409 4.140 20 0 EIADHM O=C1c2cc(Cl)ccc2N[C@H](c2ccc([O-])c(F)c2)N1CC1CC1 ZINC000533713428 1045808174 /nfs/dbraw/zinc/80/81/74/1045808174.db2.gz VAJGBUYVQNBQBV-KRWDZBQOSA-N -1 3 346.789 4.161 20 0 EIADHM C[C@]1(c2noc(-c3cc(Cc4ccccc4)ccc3[O-])n2)CCCO1 ZINC000763319439 1045821064 /nfs/dbraw/zinc/82/10/64/1045821064.db2.gz GGAFBZNVWSYUIW-HXUWFJFHSA-N -1 3 336.391 4.059 20 0 EIADHM [O-]c1ccc(Nc2c(F)cc(Br)cc2F)c(F)c1F ZINC001212007600 1045827967 /nfs/dbraw/zinc/82/79/67/1045827967.db2.gz PVVLJYXITNYVMY-UHFFFAOYSA-N -1 3 336.082 4.455 20 0 EIADHM COC(=O)c1ccc(C(F)(F)F)c(Nc2ccc([O-])c(F)c2F)c1 ZINC001212014101 1045835349 /nfs/dbraw/zinc/83/53/49/1045835349.db2.gz ZMRWGLSEUMVFSE-UHFFFAOYSA-N -1 3 347.239 4.219 20 0 EIADHM COc1cc(C)c(Nc2ccc([O-])c(F)c2F)cc1Br ZINC001212016564 1045841282 /nfs/dbraw/zinc/84/12/82/1045841282.db2.gz WJPOMNRGUDTSQI-UHFFFAOYSA-N -1 3 344.155 4.494 20 0 EIADHM [O-]c1ccc(Nc2c(F)cccc2OC[C@H]2CCCO2)c(F)c1F ZINC001212016541 1045841757 /nfs/dbraw/zinc/84/17/57/1045841757.db2.gz VCSGZCNJYIAZMH-SNVBAGLBSA-N -1 3 339.313 4.111 20 0 EIADHM COc1ccc2c(c1)CCCN2C(=O)c1cc([O-])c2ccccc2c1 ZINC000792042020 1045854998 /nfs/dbraw/zinc/85/49/98/1045854998.db2.gz YOOIEPORAOWHRI-UHFFFAOYSA-N -1 3 333.387 4.147 20 0 EIADHM Cc1cnc([C@@H](NCc2c([O-])ccc(Cl)c2F)C2CC2)s1 ZINC000191206327 1045946116 /nfs/dbraw/zinc/94/61/16/1045946116.db2.gz JKFTUHWSQMZMAD-AWEZNQCLSA-N -1 3 326.824 4.191 20 0 EIADHM CC1(C)CCCc2sc([N-]C(=O)c3ncoc3C(F)(F)F)nc21 ZINC000615043491 1046038452 /nfs/dbraw/zinc/03/84/52/1046038452.db2.gz KSKVMQFLUOKQQS-UHFFFAOYSA-N -1 3 345.346 4.016 20 0 EIADHM O=C(NCC(F)(F)c1ccccc1)c1cc2sccc2c([O-])c1 ZINC000793081196 1046134316 /nfs/dbraw/zinc/13/43/16/1046134316.db2.gz IGVSMTSZTVCPNC-UHFFFAOYSA-N -1 3 333.359 4.129 20 0 EIADHM Cc1ccc(NC(=O)c2c(C)nc(C(C)(C)C)[n-]c2=O)c(Cl)c1C ZINC000648966808 1046155685 /nfs/dbraw/zinc/15/56/85/1046155685.db2.gz CAWWBULRWMGIAY-UHFFFAOYSA-N -1 3 347.846 4.311 20 0 EIADHM Cc1conc1[N-]C(=O)c1csc(-c2ccc(Cl)s2)n1 ZINC000123811609 1046198211 /nfs/dbraw/zinc/19/82/11/1046198211.db2.gz JUCVFRSHVSIQRP-UHFFFAOYSA-N -1 3 325.802 4.074 20 0 EIADHM [O-]c1ccc(Br)cc1/C=N/CCc1c[nH]c2ccccc12 ZINC000005287775 1046227520 /nfs/dbraw/zinc/22/75/20/1046227520.db2.gz LWHUJRIEIVPTHN-VXLYETTFSA-N -1 3 343.224 4.298 20 0 EIADHM CC(C)Sc1cccc(Cl)c1CN1C[C@H](C)C[C@@H](C(=O)[O-])C1 ZINC000263092155 1046251279 /nfs/dbraw/zinc/25/12/79/1046251279.db2.gz UNQRBAJDPJIYSQ-CHWSQXEVSA-N -1 3 341.904 4.383 20 0 EIADHM O=C([O-])c1ccc(CN2CC(c3cccc(C(F)(F)F)c3)C2)cc1 ZINC000263385477 1046277127 /nfs/dbraw/zinc/27/71/27/1046277127.db2.gz CSTMUZFAMDZYJR-UHFFFAOYSA-N -1 3 335.325 4.003 20 0 EIADHM CCOc1cccc2cc([C@@H](C)NCc3ccc(C(=O)[O-])cc3)oc21 ZINC000263447479 1046288911 /nfs/dbraw/zinc/28/89/11/1046288911.db2.gz GGQQMARJKPZWCR-CYBMUJFWSA-N -1 3 339.391 4.381 20 0 EIADHM O=C([O-])[C@@]12CCC[C@H]1CN(Cc1cc(Cl)cc(C(F)(F)F)c1)C2 ZINC000263517411 1046299531 /nfs/dbraw/zinc/29/95/31/1046299531.db2.gz PGEZJTZBWGPWJE-XHDPSFHLSA-N -1 3 347.764 4.046 20 0 EIADHM CC(=O)SCCCCCCNC(=O)c1cc([O-])c2ccccc2c1 ZINC000793847217 1046338715 /nfs/dbraw/zinc/33/87/15/1046338715.db2.gz DUHQWRYWHVAEGB-UHFFFAOYSA-N -1 3 345.464 4.115 20 0 EIADHM Cc1[nH]c2ccccc2c1C(=O)Nc1ccc(Br)cc1[O-] ZINC000125994397 1046414113 /nfs/dbraw/zinc/41/41/13/1046414113.db2.gz RFMASWWLIHMZLR-UHFFFAOYSA-N -1 3 345.196 4.197 20 0 EIADHM CCOc1cc(CNc2ccc3cnn(CC)c3c2)cc(Cl)c1[O-] ZINC000459462060 1046701342 /nfs/dbraw/zinc/70/13/42/1046701342.db2.gz JUPNOJKEQQYVCI-UHFFFAOYSA-N -1 3 345.830 4.426 20 0 EIADHM CC[C@@H](C)n1ncc(NCc2cccc([O-])c2Br)c1C ZINC000459535262 1046761242 /nfs/dbraw/zinc/76/12/42/1046761242.db2.gz XGIUKZFPPGLDMW-SNVBAGLBSA-N -1 3 338.249 4.243 20 0 EIADHM O=C(OCc1coc(-c2ccc(F)c(F)c2)n1)c1cc2occc2[n-]1 ZINC000786034952 1046804599 /nfs/dbraw/zinc/80/45/99/1046804599.db2.gz YNTZTTJEUBPSLK-UHFFFAOYSA-N -1 3 344.273 4.051 20 0 EIADHM O=C([N-]CCCSC/C=C\c1ccc(Cl)cc1)C(F)(F)F ZINC000786802503 1046874252 /nfs/dbraw/zinc/87/42/52/1046874252.db2.gz WBZWCSFGKDOSKS-IWQZZHSRSA-N -1 3 337.794 4.155 20 0 EIADHM O=C(Nc1cccc([O-])c1F)c1ccc(C(F)(F)F)cc1Cl ZINC000537153488 1046989337 /nfs/dbraw/zinc/98/93/37/1046989337.db2.gz IASQSURUQDPESR-UHFFFAOYSA-N -1 3 333.668 4.456 20 0 EIADHM Cc1cc([C@H]([N-]C(=O)C(F)F)c2ccccc2Cl)ccc1F ZINC000787384126 1046996869 /nfs/dbraw/zinc/99/68/69/1046996869.db2.gz OUWRCBCNYHIJOV-AWEZNQCLSA-N -1 3 327.733 4.258 20 0 EIADHM Cc1ccnc(Cl)c1[N-]S(=O)(=O)c1ccccc1C(C)(C)C ZINC000788205265 1047132741 /nfs/dbraw/zinc/13/27/41/1047132741.db2.gz PFAYTYQUQMKHHZ-UHFFFAOYSA-N -1 3 338.860 4.142 20 0 EIADHM O=C(NCc1cccc2cccnc21)c1cc2sccc2c([O-])c1 ZINC000788294331 1047149343 /nfs/dbraw/zinc/14/93/43/1047149343.db2.gz VIOXFTSMPBOILW-UHFFFAOYSA-N -1 3 334.400 4.085 20 0 EIADHM CC[C@H](NC(=O)c1cc2sccc2c([O-])c1)c1ccc(OC)cc1 ZINC000788267058 1047149016 /nfs/dbraw/zinc/14/90/16/1047149016.db2.gz RYVHBOJKYYPCGF-INIZCTEOSA-N -1 3 341.432 4.497 20 0 EIADHM Cc1sc2[n-]c(-c3cscn3)nc(=O)c2c1-c1ccccc1 ZINC000498114822 1047369906 /nfs/dbraw/zinc/36/99/06/1047369906.db2.gz ABHPNHXUNFCHAX-UHFFFAOYSA-N -1 3 325.418 4.496 20 0 EIADHM CC(C)C[C@H](C)OCCC(=O)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000476158135 1047389713 /nfs/dbraw/zinc/38/97/13/1047389713.db2.gz NSPOHIJWMUFYCJ-NSHDSACASA-N -1 3 333.350 4.191 20 0 EIADHM CSc1cc(F)ccc1[N-]C(=O)c1csc([C@@H]2CCCO2)n1 ZINC000648619913 1047396111 /nfs/dbraw/zinc/39/61/11/1047396111.db2.gz UJZNQTAMAJENHM-LBPRGKRZSA-N -1 3 338.429 4.108 20 0 EIADHM O=C(Nc1ccc([O-])c(C(F)(F)F)c1)c1c[nH]c(-c2ccccc2)n1 ZINC000476170155 1047398583 /nfs/dbraw/zinc/39/85/83/1047398583.db2.gz SRXTUMNSXQAJOD-UHFFFAOYSA-N -1 3 347.296 4.053 20 0 EIADHM O=C([N-]OCCC(F)(F)F)C1(Cc2cccc(F)c2)CCCCC1 ZINC000807288888 1047439390 /nfs/dbraw/zinc/43/93/90/1047439390.db2.gz BPNFGQYNIQTSIZ-UHFFFAOYSA-N -1 3 347.352 4.319 20 0 EIADHM Cc1nc(CC(C)C)oc1C(=O)[N-]c1nnc(C2CCCCC2)s1 ZINC000789613054 1047449173 /nfs/dbraw/zinc/44/91/73/1047449173.db2.gz IJPDNYKOHJXTIY-UHFFFAOYSA-N -1 3 348.472 4.333 20 0 EIADHM Cc1ccc(/C=C\S(=O)(=O)[N-]c2ccccc2C(F)(F)F)cc1 ZINC000790068548 1047508015 /nfs/dbraw/zinc/50/80/15/1047508015.db2.gz NJYSKBSRJVCWRP-KHPPLWFESA-N -1 3 341.354 4.426 20 0 EIADHM CCC(CC)n1nccc1C(=O)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000129788844 1047510063 /nfs/dbraw/zinc/51/00/63/1047510063.db2.gz DMRRYXKXBFNJHL-UHFFFAOYSA-N -1 3 341.333 4.221 20 0 EIADHM CCOc1cc(CNCc2nc(C(C)(C)C)co2)cc(Cl)c1[O-] ZINC000897945083 1047514668 /nfs/dbraw/zinc/51/46/68/1047514668.db2.gz YNDUGJLYLNHTIN-UHFFFAOYSA-N -1 3 338.835 4.020 20 0 EIADHM CCc1cccc(C(=O)N2CCC3(CC2)c2ccccc2N=C3C)c1[O-] ZINC000898244728 1047593200 /nfs/dbraw/zinc/59/32/00/1047593200.db2.gz XMWMMUPYSIIIOJ-UHFFFAOYSA-N -1 3 348.446 4.235 20 0 EIADHM CCCC(=O)Nc1cccc(NC(=O)c2ccc(C)c(C)c2[O-])c1C ZINC000130918242 1047814016 /nfs/dbraw/zinc/81/40/16/1047814016.db2.gz ROMNZHGSKCWYOX-UHFFFAOYSA-N -1 3 340.423 4.308 20 0 EIADHM O=C([N-]c1nc(-c2cccs2)ns1)c1ccsc1Cl ZINC001127494834 1047843527 /nfs/dbraw/zinc/84/35/27/1047843527.db2.gz CRULDDDQVXXTHB-UHFFFAOYSA-N -1 3 327.843 4.234 20 0 EIADHM O=C(OCc1cccc(F)c1OC(F)F)c1cccc(Cl)c1[O-] ZINC001131225620 1047855003 /nfs/dbraw/zinc/85/50/03/1047855003.db2.gz CZDCFBWNVWTPMH-UHFFFAOYSA-N -1 3 346.688 4.143 20 0 EIADHM Cc1ccccc1-c1ccccc1C(=O)Nc1nnc(C(F)(F)F)[n-]1 ZINC001134128218 1047865774 /nfs/dbraw/zinc/86/57/74/1047865774.db2.gz LUALKEHVRHSAMQ-UHFFFAOYSA-N -1 3 346.312 4.051 20 0 EIADHM Cc1ccccc1-c1ccccc1C(=O)Nc1nc(C(F)(F)F)n[n-]1 ZINC001134128218 1047865775 /nfs/dbraw/zinc/86/57/75/1047865775.db2.gz LUALKEHVRHSAMQ-UHFFFAOYSA-N -1 3 346.312 4.051 20 0 EIADHM O=S(=O)(/C=C\c1ccccc1Cl)[N-]c1cc(F)cc(F)c1F ZINC000814212154 1047890813 /nfs/dbraw/zinc/89/08/13/1047890813.db2.gz GLTFYLWPQCRFCC-WAYWQWQTSA-N -1 3 347.745 4.170 20 0 EIADHM O=S(=O)(/C=C/c1ccc(Cl)cc1)[N-]c1cc(F)cc(F)c1F ZINC000814213053 1047892221 /nfs/dbraw/zinc/89/22/21/1047892221.db2.gz UZBIIJZCJMZSER-AATRIKPKSA-N -1 3 347.745 4.170 20 0 EIADHM CCc1ccc([C@H]2C[C@H](C)CCN2C(=O)c2ccc(OC)cc2[O-])o1 ZINC001137026844 1048080220 /nfs/dbraw/zinc/08/02/20/1048080220.db2.gz UWRJMUZVNKWSNP-CXAGYDPISA-N -1 3 343.423 4.170 20 0 EIADHM CC(C)Cc1cc(NC(=O)c2cc(Cc3ccccc3)ccc2[O-])n[nH]1 ZINC001143795211 1048210149 /nfs/dbraw/zinc/21/01/49/1048210149.db2.gz ZACOYIAEHXEISR-UHFFFAOYSA-N -1 3 349.434 4.157 20 0 EIADHM Cc1ccc(-c2csc3[n-]c(-c4cccc(F)n4)nc(=O)c23)s1 ZINC000155129614 1048299766 /nfs/dbraw/zinc/29/97/66/1048299766.db2.gz HTIYVFHRVXYFAE-UHFFFAOYSA-N -1 3 343.408 4.223 20 0 EIADHM CC(C)Oc1c(F)cc(NC(=O)c2cc([O-])ccc2Cl)cc1F ZINC000499120177 1048300518 /nfs/dbraw/zinc/30/05/18/1048300518.db2.gz XHLXSBVFGNNJGE-UHFFFAOYSA-N -1 3 341.741 4.363 20 0 EIADHM COc1cc(CNCc2cccc([O-])c2Cl)ccc1OC(C)C ZINC000815114178 1048329680 /nfs/dbraw/zinc/32/96/80/1048329680.db2.gz KAOFCAXZXMKIMH-UHFFFAOYSA-N -1 3 335.831 4.131 20 0 EIADHM CC(C)(CC[N-]S(=O)(=O)c1ccc(Cl)s1)c1ccccc1 ZINC000919950635 1048337946 /nfs/dbraw/zinc/33/79/46/1048337946.db2.gz GXJRHYNLPQANJA-UHFFFAOYSA-N -1 3 343.901 4.048 20 0 EIADHM COc1ccccc1-c1cc(C(=O)[N-]c2ncsc2C(C)C)no1 ZINC000809394771 1048350693 /nfs/dbraw/zinc/35/06/93/1048350693.db2.gz YELIYTDJBDOMDO-UHFFFAOYSA-N -1 3 343.408 4.182 20 0 EIADHM CCc1ccc(-c2nc(-c3c(Cl)nc4sccn43)no2)c([O-])c1 ZINC000809473328 1048363980 /nfs/dbraw/zinc/36/39/80/1048363980.db2.gz CYXJFFLQHGVXCH-UHFFFAOYSA-N -1 3 346.799 4.034 20 0 EIADHM CSc1nc2ccc(NC(=O)Cc3ccc([O-])c(F)c3)cc2s1 ZINC001135521422 1048761263 /nfs/dbraw/zinc/76/12/63/1048761263.db2.gz NEXUPFNFSOCLIF-UHFFFAOYSA-N -1 3 348.424 4.044 20 0 EIADHM Cc1sc2[n-]c([C@@H](C)OC(=O)C[C@@H](C)C3CC3)nc(=O)c2c1C ZINC000920728690 1048764434 /nfs/dbraw/zinc/76/44/34/1048764434.db2.gz QMETULUKFGMQGT-PSASIEDQSA-N -1 3 334.441 4.054 20 0 EIADHM Cc1cc(NC(=O)Cc2ccc([O-])c(F)c2)cc(C(F)(F)F)c1 ZINC001144631771 1048767194 /nfs/dbraw/zinc/76/71/94/1048767194.db2.gz ZNYYSKNHRMXJOJ-UHFFFAOYSA-N -1 3 327.277 4.040 20 0 EIADHM C[C@@H](NC(=O)c1cc([O-])ccc1Cl)c1nc2ccccc2s1 ZINC000810407389 1048792720 /nfs/dbraw/zinc/79/27/20/1048792720.db2.gz RWMHIABIOUPWDM-SECBINFHSA-N -1 3 332.812 4.146 20 0 EIADHM C[C@H]([N-]C(=O)C(F)(F)c1ccc(F)cc1)c1ccccc1Cl ZINC000920840719 1048800700 /nfs/dbraw/zinc/80/07/00/1048800700.db2.gz MIZCULKRGBKLSI-JTQLQIEISA-N -1 3 327.733 4.448 20 0 EIADHM CC1(C)C[C@H](NCc2c(F)ccc([O-])c2F)c2cc(F)ccc2O1 ZINC000846053222 1048807049 /nfs/dbraw/zinc/80/70/49/1048807049.db2.gz TWFAAHIKMMRCBY-AWEZNQCLSA-N -1 3 337.341 4.202 20 0 EIADHM CN(Cc1c(F)ccc([O-])c1F)C[C@H]1CCCO[C@@H]1c1ccccc1 ZINC000816499313 1048820504 /nfs/dbraw/zinc/82/05/04/1048820504.db2.gz LHIREFRZRGKKQA-FOIQADDNSA-N -1 3 347.405 4.270 20 0 EIADHM O=C([N-]Cc1ccc(Cl)cc1)C(F)(F)c1cccc(Cl)c1 ZINC000920997943 1048826009 /nfs/dbraw/zinc/82/60/09/1048826009.db2.gz RPKJXCKEKDHGHR-UHFFFAOYSA-N -1 3 330.161 4.402 20 0 EIADHM Cc1ccccc1[C@H](O)C1CCN(Cc2cccc([O-])c2Cl)CC1 ZINC000816609007 1048844266 /nfs/dbraw/zinc/84/42/66/1048844266.db2.gz PUWDXZOKBFVROV-HXUWFJFHSA-N -1 3 345.870 4.300 20 0 EIADHM Cc1ccc(-c2nc(CN(CCC(=O)[O-])CC(C)C)cs2)cc1 ZINC000846265876 1048851300 /nfs/dbraw/zinc/85/13/00/1048851300.db2.gz PMLRSTQRYZWMHF-UHFFFAOYSA-N -1 3 332.469 4.051 20 0 EIADHM O=C(Nc1ccc(Nc2ccccc2)cc1)c1cc(=O)[n-]c(C2CC2)n1 ZINC000816830870 1048864777 /nfs/dbraw/zinc/86/47/77/1048864777.db2.gz XFWVDPXLRUEISI-UHFFFAOYSA-N -1 3 346.390 4.056 20 0 EIADHM O=C(Nc1ccc2c(c1)oc1ccccc12)c1cc(=O)[n-]c(C2CC2)n1 ZINC000816869837 1048871955 /nfs/dbraw/zinc/87/19/55/1048871955.db2.gz DHIRXJYDKOKPKQ-UHFFFAOYSA-N -1 3 345.358 4.211 20 0 EIADHM Cc1c([N-]C(=O)c2coc(-c3ccccc3)n2)noc1C(C)(C)C ZINC001132458957 1048872903 /nfs/dbraw/zinc/87/29/03/1048872903.db2.gz OCAWCDKCYHSHNK-UHFFFAOYSA-N -1 3 325.368 4.188 20 0 EIADHM Cc1cccc2c(CC(=O)Nc3ccc([O-])c(C(F)(F)F)c3)c[nH]c21 ZINC000134082927 1048881186 /nfs/dbraw/zinc/88/11/86/1048881186.db2.gz GTZHYAVBEPDISK-UHFFFAOYSA-N -1 3 348.324 4.382 20 0 EIADHM O=C(O[C@H]1CCCC12CCOCC2)c1cc2cc(Cl)sc2[n-]1 ZINC000810860685 1048887171 /nfs/dbraw/zinc/88/71/71/1048887171.db2.gz AJUODKRKMINOLO-LBPRGKRZSA-N -1 3 339.844 4.389 20 0 EIADHM C[C@H](OC(=O)c1cc2cc(Cl)sc2[n-]1)c1ccc(N(C)C)cn1 ZINC000810970453 1048906070 /nfs/dbraw/zinc/90/60/70/1048906070.db2.gz KIUXRIWBHGWQBL-VIFPVBQESA-N -1 3 349.843 4.262 20 0 EIADHM CCCCC[C@@H](NC(=O)c1cc(NC(C)=O)ccc1[O-])C(C)(C)C ZINC001146536980 1049033342 /nfs/dbraw/zinc/03/33/42/1049033342.db2.gz AXDSEAGYYLMOGU-QGZVFWFLSA-N -1 3 334.460 4.075 20 0 EIADHM O=C(OCc1cc(-c2ccco2)on1)c1cc2cc(Cl)sc2[n-]1 ZINC000811393632 1049050859 /nfs/dbraw/zinc/05/08/59/1049050859.db2.gz OGFWWIJCDYVWCL-UHFFFAOYSA-N -1 3 348.767 4.488 20 0 EIADHM Cc1ccccc1C(=O)COC(=O)c1cc2cc(Cl)sc2[n-]1 ZINC000811393664 1049051065 /nfs/dbraw/zinc/05/10/65/1049051065.db2.gz CEWCICAYVBJLPC-UHFFFAOYSA-N -1 3 333.796 4.231 20 0 EIADHM CCC[C@@H](Cc1ccccc1)N(CCC)C(=O)c1ccc(N)cc1[O-] ZINC000817933893 1049062766 /nfs/dbraw/zinc/06/27/66/1049062766.db2.gz VWCKGUOGICBRSA-SFHVURJKSA-N -1 3 340.467 4.238 20 0 EIADHM Cc1nc(-c2ccccc2)ncc1C(=O)Nc1cc(Cl)ccc1[O-] ZINC000135142501 1049076409 /nfs/dbraw/zinc/07/64/09/1049076409.db2.gz MNRDIPCNLNUNKE-UHFFFAOYSA-N -1 3 339.782 4.063 20 0 EIADHM CN(Cc1c(F)cccc1F)C(=O)c1cc2sccc2c([O-])c1 ZINC000818555751 1049183075 /nfs/dbraw/zinc/18/30/75/1049183075.db2.gz RQVFJTPPEUCCTL-UHFFFAOYSA-N -1 3 333.359 4.157 20 0 EIADHM CCSCC[C@@H](C)NC(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC001148095104 1049261340 /nfs/dbraw/zinc/26/13/40/1049261340.db2.gz FIZVTYZJVMJMSR-CQSZACIVSA-N -1 3 345.464 4.446 20 0 EIADHM Cc1ncccc1NC(=O)c1cc(CCc2ccccc2)ccc1[O-] ZINC001148076506 1049261586 /nfs/dbraw/zinc/26/15/86/1049261586.db2.gz NUFIQLYNBLDCAK-UHFFFAOYSA-N -1 3 332.403 4.133 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)Nc1ccccc1-c1ncco1 ZINC001148252458 1049289987 /nfs/dbraw/zinc/28/99/87/1049289987.db2.gz JEXMLHRIPPCYDV-UHFFFAOYSA-N -1 3 340.354 4.148 20 0 EIADHM Cc1cccc([O-])c1C(=O)N1CCc2cc(-c3ccccc3)oc2C1 ZINC001148722650 1049360243 /nfs/dbraw/zinc/36/02/43/1049360243.db2.gz GIKWQMJDRSFRPO-UHFFFAOYSA-N -1 3 333.387 4.159 20 0 EIADHM Cc1c(F)c(C)c(F)c(C(=O)[N-]c2cc(-c3ccncc3)no2)c1F ZINC001148752189 1049372345 /nfs/dbraw/zinc/37/23/45/1049372345.db2.gz DHDMBUGJVMWGFK-UHFFFAOYSA-N -1 3 347.296 4.023 20 0 EIADHM Cc1cccc(C2(CNC(=O)c3ccc(O)cc3[O-])CCCCC2)c1 ZINC001136276546 1049384356 /nfs/dbraw/zinc/38/43/56/1049384356.db2.gz BJVGACGVZZSZTK-UHFFFAOYSA-N -1 3 339.435 4.038 20 0 EIADHM CCc1ccc(C(=O)Nc2cc(Cl)ccc2NC2CC2)c([O-])c1 ZINC001148837573 1049385592 /nfs/dbraw/zinc/38/55/92/1049385592.db2.gz UJAMRRBFEIZOJL-UHFFFAOYSA-N -1 3 330.815 4.435 20 0 EIADHM O=S(=O)(/C=C\c1ccc(Cl)cc1)[N-]c1cc2c(cn1)CCCC2 ZINC000812330266 1049429719 /nfs/dbraw/zinc/42/97/19/1049429719.db2.gz BDDGTPZSECTSAN-KTKRTIGZSA-N -1 3 348.855 4.026 20 0 EIADHM O=C(Nc1ccc(OC2CCCC2)cc1)c1[n-]cnc1C(F)(F)F ZINC000820919877 1049571483 /nfs/dbraw/zinc/57/14/83/1049571483.db2.gz ZMEZWMWLWDQBPP-UHFFFAOYSA-N -1 3 339.317 4.002 20 0 EIADHM O=C(Nc1ccc(OC2CCCC2)cc1)c1nc[n-]c1C(F)(F)F ZINC000820919877 1049571500 /nfs/dbraw/zinc/57/15/00/1049571500.db2.gz ZMEZWMWLWDQBPP-UHFFFAOYSA-N -1 3 339.317 4.002 20 0 EIADHM CCc1cccc(C(=O)Nc2ccc(Nc3ccccc3)nc2)c1[O-] ZINC001136467933 1049658171 /nfs/dbraw/zinc/65/81/71/1049658171.db2.gz SSUZNLMYARBLPQ-UHFFFAOYSA-N -1 3 333.391 4.346 20 0 EIADHM C[C@@H](NCc1ccc([O-])c(F)c1)c1noc(-c2ccc(Cl)cc2)n1 ZINC000813338397 1049755494 /nfs/dbraw/zinc/75/54/94/1049755494.db2.gz GQRMHDDGPOARPH-SNVBAGLBSA-N -1 3 347.777 4.086 20 0 EIADHM CCCCOc1ccc(NC(=O)c2[n-]cnc2C(F)(F)F)c(C)c1 ZINC000823130769 1049825833 /nfs/dbraw/zinc/82/58/33/1049825833.db2.gz JRRIZQBYZBIDKJ-UHFFFAOYSA-N -1 3 341.333 4.168 20 0 EIADHM CCCCOc1ccc(NC(=O)c2nc[n-]c2C(F)(F)F)c(C)c1 ZINC000823130769 1049825838 /nfs/dbraw/zinc/82/58/38/1049825838.db2.gz JRRIZQBYZBIDKJ-UHFFFAOYSA-N -1 3 341.333 4.168 20 0 EIADHM COC(=O)c1cc(C(C)C)ccc1NC(=O)c1ccc(C)c(C)c1[O-] ZINC001136682724 1049826739 /nfs/dbraw/zinc/82/67/39/1049826739.db2.gz GRIIUSBSSNPPQE-UHFFFAOYSA-N -1 3 341.407 4.171 20 0 EIADHM CCCc1nc(C)c(COC(=O)c2cc3cc(Cl)sc3[n-]2)o1 ZINC000814074329 1049870180 /nfs/dbraw/zinc/87/01/80/1049870180.db2.gz QZYGCWFMYFYQIG-UHFFFAOYSA-N -1 3 338.816 4.489 20 0 EIADHM CC(=O)c1ccc(C(=O)N[C@@H](CC(C)C)c2ccccc2C)cc1[O-] ZINC001136769346 1049873509 /nfs/dbraw/zinc/87/35/09/1049873509.db2.gz JCUMKVBRZCEBNP-IBGZPJMESA-N -1 3 339.435 4.420 20 0 EIADHM CC(C)CCc1nnc([N-]C(=O)c2scnc2C(C)(C)C)s1 ZINC000617096325 1049949584 /nfs/dbraw/zinc/94/95/84/1049949584.db2.gz PXYMRCNEYCQCKF-UHFFFAOYSA-N -1 3 338.502 4.133 20 0 EIADHM COc1cc(C)c(C)cc1NC(=O)CCCc1ccc([O-])c(F)c1 ZINC000617547629 1050045105 /nfs/dbraw/zinc/04/51/05/1050045105.db2.gz WRKWRDPWVPKICW-UHFFFAOYSA-N -1 3 331.387 4.118 20 0 EIADHM O=C(Nc1cc([O-])cc(Cl)c1)c1ccc(OCC2CC2)cc1F ZINC001185860091 1050178679 /nfs/dbraw/zinc/17/86/79/1050178679.db2.gz CPTVUHPHGWENTJ-UHFFFAOYSA-N -1 3 335.762 4.226 20 0 EIADHM CCCOc1ccc(NC(=O)c2cc3c(cc2[O-])CCCC3)cc1F ZINC001150170931 1050444316 /nfs/dbraw/zinc/44/43/16/1050444316.db2.gz TZGOQHCTFHSQFA-UHFFFAOYSA-N -1 3 343.398 4.451 20 0 EIADHM Cn1ccc2cccc(NCc3cccc([O-])c3Br)c21 ZINC001178496648 1050469515 /nfs/dbraw/zinc/46/95/15/1050469515.db2.gz FCOCLOKKMISAME-UHFFFAOYSA-N -1 3 331.213 4.259 20 0 EIADHM O=C(Nc1cc(Cl)cc(Cl)c1)Nc1cc(=O)[n-]c(C2CC2)n1 ZINC001187125055 1050486685 /nfs/dbraw/zinc/48/66/85/1050486685.db2.gz AYMJQPUNRHMJLM-UHFFFAOYSA-N -1 3 339.182 4.010 20 0 EIADHM CC(C)(C)OC(=O)Nc1ccccc1C(=O)Nc1ccc(F)c([O-])c1 ZINC001187667718 1050589821 /nfs/dbraw/zinc/58/98/21/1050589821.db2.gz UZOMEFNFNMWLJW-UHFFFAOYSA-N -1 3 346.358 4.131 20 0 EIADHM O=C([N-]c1cc(Cl)cc2ncoc21)c1ccoc1C(F)(F)F ZINC001187720503 1050608402 /nfs/dbraw/zinc/60/84/02/1050608402.db2.gz AOBRYATUAOJGHL-UHFFFAOYSA-N -1 3 330.649 4.345 20 0 EIADHM COc1ccc(Cl)cc1NC(=O)Nc1cc([O-])cc(Cl)c1 ZINC001187928488 1050652369 /nfs/dbraw/zinc/65/23/69/1050652369.db2.gz LJUAQFRYFQIOOE-UHFFFAOYSA-N -1 3 327.167 4.352 20 0 EIADHM CSc1cccc(NC(=O)Nc2nc3c(cccc3[O-])s2)c1 ZINC001188016128 1050679606 /nfs/dbraw/zinc/67/96/06/1050679606.db2.gz TVZNUWLZDOMHLP-UHFFFAOYSA-N -1 3 331.422 4.368 20 0 EIADHM Cc1cc(C)n(-c2ccccc2C(=O)Nc2cc([O-])cc(Cl)c2)n1 ZINC001188243579 1050724591 /nfs/dbraw/zinc/72/45/91/1050724591.db2.gz ZKBMSNZRCAENJS-UHFFFAOYSA-N -1 3 341.798 4.100 20 0 EIADHM O=C(/C=C/c1c(F)ccc(F)c1Cl)Nc1ccc(F)c([O-])c1 ZINC001179772183 1050768743 /nfs/dbraw/zinc/76/87/43/1050768743.db2.gz UPQAHONVMXJDHQ-QHHAFSJGSA-N -1 3 327.689 4.115 20 0 EIADHM O=C(/C=C/c1cccc(C(F)(F)F)c1F)Nc1ccc(F)c([O-])c1 ZINC001179786741 1050778398 /nfs/dbraw/zinc/77/83/98/1050778398.db2.gz UWMBAEDPTOEJNS-QPJJXVBHSA-N -1 3 343.251 4.341 20 0 EIADHM Cc1ccc(Cl)cc1NC(=O)[N-]c1cc(-c2ccccn2)no1 ZINC001188703701 1050827156 /nfs/dbraw/zinc/82/71/56/1050827156.db2.gz YEKYPUNAUAUEJD-UHFFFAOYSA-N -1 3 328.759 4.342 20 0 EIADHM COc1ccc(NC(=O)[N-]c2cc(-c3cccs3)no2)cc1OC ZINC001188767508 1050843751 /nfs/dbraw/zinc/84/37/51/1050843751.db2.gz QGQYMWHCVSQGGR-UHFFFAOYSA-N -1 3 345.380 4.064 20 0 EIADHM COc1ccc(NC(=O)Nc2ccc(C)c([O-])c2Cl)cc1OC ZINC001188800811 1050847896 /nfs/dbraw/zinc/84/78/96/1050847896.db2.gz WQHGDODGLIOCQX-UHFFFAOYSA-N -1 3 336.775 4.015 20 0 EIADHM Cn1cccc1[C@H]1CCCCN1Cc1cccc([O-])c1Br ZINC001180137229 1050883241 /nfs/dbraw/zinc/88/32/41/1050883241.db2.gz WOLUGIANVCMVOX-OAHLLOKOSA-N -1 3 349.272 4.220 20 0 EIADHM Cn1cccc1[C@@H]1CCCCN1Cc1cccc([O-])c1Br ZINC001180137228 1050884173 /nfs/dbraw/zinc/88/41/73/1050884173.db2.gz WOLUGIANVCMVOX-HNNXBMFYSA-N -1 3 349.272 4.220 20 0 EIADHM C[C@H]1CN(Cc2cccc([O-])c2Br)[C@H]1c1ccccc1 ZINC001180143364 1050885457 /nfs/dbraw/zinc/88/54/57/1050885457.db2.gz WDQPYBNKKDPDHQ-YVEFUNNKSA-N -1 3 332.241 4.348 20 0 EIADHM C[C@@H]1CN(Cc2cccc([O-])c2Br)[C@H]1c1ccccc1 ZINC001180143361 1050886831 /nfs/dbraw/zinc/88/68/31/1050886831.db2.gz WDQPYBNKKDPDHQ-SJKOYZFVSA-N -1 3 332.241 4.348 20 0 EIADHM O=C(Nc1cccc2cc[nH]c21)c1cccc(OC(F)(F)F)c1[O-] ZINC001189765503 1051057034 /nfs/dbraw/zinc/05/70/34/1051057034.db2.gz CUSMGZVVHYAMPF-UHFFFAOYSA-N -1 3 336.269 4.024 20 0 EIADHM CC(C)c1cccc(F)c1[N-]S(=O)(=O)Cc1ccc(F)cc1F ZINC001189835190 1051072263 /nfs/dbraw/zinc/07/22/63/1051072263.db2.gz ZXTJVMDOYDLHTG-UHFFFAOYSA-N -1 3 343.370 4.169 20 0 EIADHM Cc1noc(-c2ccccc2)c1NC(=O)Nc1cc(F)ccc1[O-] ZINC001190364233 1051153139 /nfs/dbraw/zinc/15/31/39/1051153139.db2.gz JHXFUVHRSDMAPP-UHFFFAOYSA-N -1 3 327.315 4.139 20 0 EIADHM Cc1nc(C(F)(F)F)c(C(=O)Nc2cc([O-])cc(Cl)c2)s1 ZINC001190501436 1051196527 /nfs/dbraw/zinc/19/65/27/1051196527.db2.gz ZALXIWFXZTZVPQ-UHFFFAOYSA-N -1 3 336.722 4.082 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2cccc(Cl)c2Cl)c(F)c1 ZINC000404989607 1051202876 /nfs/dbraw/zinc/20/28/76/1051202876.db2.gz SEAOBETYOQCCOT-UHFFFAOYSA-N -1 3 334.199 4.242 20 0 EIADHM O=C(Nc1ccc(Cl)cc1[O-])c1sccc1Br ZINC000153676746 1051213620 /nfs/dbraw/zinc/21/36/20/1051213620.db2.gz ICPWSOGYBBAQPF-UHFFFAOYSA-N -1 3 332.606 4.122 20 0 EIADHM Cc1cccc(Oc2cccc(NC(=O)c3cccc4n[n-]nc43)c2)c1 ZINC001174919584 1051249350 /nfs/dbraw/zinc/24/93/50/1051249350.db2.gz HSJOIYDDNITJJC-UHFFFAOYSA-N -1 3 344.374 4.311 20 0 EIADHM O=C(Nc1ccc(F)c([O-])c1)Nc1ccccc1OC(F)(F)F ZINC001190683253 1051257345 /nfs/dbraw/zinc/25/73/45/1051257345.db2.gz FSTYNIKSQUNNLU-UHFFFAOYSA-N -1 3 330.237 4.074 20 0 EIADHM CCOc1c(F)cc(C(=O)Nc2cc([O-])cc(Cl)c2)cc1Cl ZINC001190748610 1051269780 /nfs/dbraw/zinc/26/97/80/1051269780.db2.gz UNGDOJBJABVNMJ-UHFFFAOYSA-N -1 3 344.169 4.489 20 0 EIADHM COc1cccc(F)c1Nc1cc(Br)cc(F)c1[O-] ZINC001174995555 1051285677 /nfs/dbraw/zinc/28/56/77/1051285677.db2.gz WTAXPOKGIIPJFT-UHFFFAOYSA-N -1 3 330.128 4.185 20 0 EIADHM O=c1cc(Oc2ccc(Nc3c(F)cc([O-])cc3F)cc2)cc[nH]1 ZINC001175100111 1051346873 /nfs/dbraw/zinc/34/68/73/1051346873.db2.gz VZHREFHREIQPGV-UHFFFAOYSA-N -1 3 330.290 4.307 20 0 EIADHM COC(=O)c1cc2cc(Nc3c(F)cc([O-])cc3F)ccc2s1 ZINC001175097149 1051380741 /nfs/dbraw/zinc/38/07/41/1051380741.db2.gz QFNDKQCEKFLXLL-UHFFFAOYSA-N -1 3 335.331 4.415 20 0 EIADHM [O-]c1c(F)cc(Br)cc1Nc1c(F)cc(F)cc1F ZINC001175146280 1051412491 /nfs/dbraw/zinc/41/24/91/1051412491.db2.gz MOYOIAGQCQFHFI-UHFFFAOYSA-N -1 3 336.082 4.455 20 0 EIADHM Cc1ccc(F)cc1NC(=O)Nc1ccc(Br)cc1[O-] ZINC001191410583 1051450106 /nfs/dbraw/zinc/45/01/06/1051450106.db2.gz NGZNJMHJBFZOHU-UHFFFAOYSA-N -1 3 339.164 4.246 20 0 EIADHM [O-]c1ccc(F)c(Nc2cc(Cl)cnc2Br)c1F ZINC001175262822 1051500850 /nfs/dbraw/zinc/50/08/50/1051500850.db2.gz MYKMXHVUIJHQJP-UHFFFAOYSA-N -1 3 335.535 4.225 20 0 EIADHM O=C(Nc1cccnc1)c1ccccc1Nc1c(F)ccc([O-])c1F ZINC001175268074 1051503954 /nfs/dbraw/zinc/50/39/54/1051503954.db2.gz GIGZUGSNJOTCQY-UHFFFAOYSA-N -1 3 341.317 4.061 20 0 EIADHM [O-]c1ccc(F)c(Nc2cc(F)ccc2OC[C@H]2CCCO2)c1F ZINC001175268362 1051505052 /nfs/dbraw/zinc/50/50/52/1051505052.db2.gz LDODIXWWNVCLKS-LLVKDONJSA-N -1 3 339.313 4.111 20 0 EIADHM CN1C(=O)CC(C)(C)c2cc(Nc3c(F)ccc([O-])c3F)ccc21 ZINC001175270680 1051510209 /nfs/dbraw/zinc/51/02/09/1051510209.db2.gz HIKDVDHVUSJWFA-UHFFFAOYSA-N -1 3 332.350 4.058 20 0 EIADHM c1ccc(COc2ccccc2Nc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC001175429984 1051588517 /nfs/dbraw/zinc/58/85/17/1051588517.db2.gz YYIPWSFNLSTZEW-UHFFFAOYSA-N -1 3 343.390 4.189 20 0 EIADHM Cc1nc(-c2cccc(Nc3ccc(-c4nn[n-]n4)cc3)c2)cs1 ZINC001175429217 1051589058 /nfs/dbraw/zinc/58/90/58/1051589058.db2.gz RVGMIQRUOUDFQJ-UHFFFAOYSA-N -1 3 334.408 4.042 20 0 EIADHM CCSc1cccc(NC(=O)c2c[n-]c3c(C)cccc3c2=O)c1 ZINC001182721550 1051668955 /nfs/dbraw/zinc/66/89/55/1051668955.db2.gz RYUUJNQPARWPSS-UHFFFAOYSA-N -1 3 338.432 4.201 20 0 EIADHM CCc1ccc(C(=O)Nc2ccc(N3CCCCC3)c(F)c2)c([O-])c1 ZINC001175642617 1051689025 /nfs/dbraw/zinc/68/90/25/1051689025.db2.gz ZXOLHQNPJMVLCT-UHFFFAOYSA-N -1 3 342.414 4.336 20 0 EIADHM O=C(Nc1ccc([O-])c(F)c1)Nc1ccc(OC(F)F)c(Cl)c1 ZINC001192314339 1051689335 /nfs/dbraw/zinc/68/93/35/1051689335.db2.gz IGRYJJLEKZPMLY-UHFFFAOYSA-N -1 3 346.692 4.430 20 0 EIADHM CC(C)(C)c1ccc(C(=O)N[C@H](c2ccnc(F)c2)C2CC2)c([O-])c1 ZINC001192339901 1051693974 /nfs/dbraw/zinc/69/39/74/1051693974.db2.gz MFSZYGQAXZDIOA-SFHVURJKSA-N -1 3 342.414 4.105 20 0 EIADHM C[C@@H](C(=O)Nc1cncc([O-])c1)c1cccc(Oc2ccccc2)c1 ZINC001182736001 1051694555 /nfs/dbraw/zinc/69/45/55/1051694555.db2.gz IIQGDBISFKLXJP-CQSZACIVSA-N -1 3 334.375 4.322 20 0 EIADHM CC(=O)c1cccc(NC(=O)Nc2ccc3sccc3c2)c1[O-] ZINC001192456448 1051741519 /nfs/dbraw/zinc/74/15/19/1051741519.db2.gz ZZFOSVUHCKCQES-UHFFFAOYSA-N -1 3 326.377 4.454 20 0 EIADHM CCCCCSc1ncccc1C(=O)Nc1nc(C)ccc1[O-] ZINC001192581903 1051769507 /nfs/dbraw/zinc/76/95/07/1051769507.db2.gz YZNXLZDXNVZCPM-UHFFFAOYSA-N -1 3 331.441 4.025 20 0 EIADHM CCc1ccc(S(=O)(=O)[N-]c2c(F)cccc2NC(C)C)cc1 ZINC000158869087 1051796236 /nfs/dbraw/zinc/79/62/36/1051796236.db2.gz RWUPEPMDLMVHLC-UHFFFAOYSA-N -1 3 336.432 4.009 20 0 EIADHM CC1(C)CCCC[C@H]1C(=O)Nc1n[n-]c(-c2cc3ccccc3o2)n1 ZINC001183369128 1051838910 /nfs/dbraw/zinc/83/89/10/1051838910.db2.gz WOQXRFQLBNCYBO-ZDUSSCGKSA-N -1 3 338.411 4.373 20 0 EIADHM CCN(CC)C(=O)c1ccc(F)c(Nc2c(F)cc([O-])cc2F)c1 ZINC001176073529 1051886588 /nfs/dbraw/zinc/88/65/88/1051886588.db2.gz XPRHZKFRHVQIRW-UHFFFAOYSA-N -1 3 338.329 4.035 20 0 EIADHM O=C(c1ccc(F)c(Nc2cccc([O-])c2Cl)c1)N1CCCC1 ZINC001176213289 1051959232 /nfs/dbraw/zinc/95/92/32/1051959232.db2.gz MABJMKICQDYMIL-UHFFFAOYSA-N -1 3 334.778 4.164 20 0 EIADHM CC(C)(NC(=O)c1ccc([O-])cc1C(F)(F)F)c1cccc(F)c1 ZINC001193758233 1051992499 /nfs/dbraw/zinc/99/24/99/1051992499.db2.gz MQPKYJHBYOLICI-UHFFFAOYSA-N -1 3 341.304 4.215 20 0 EIADHM CSc1ccccc1[C@@H](C)NCc1nnc(-c2ccccc2[O-])o1 ZINC001193760838 1051994531 /nfs/dbraw/zinc/99/45/31/1051994531.db2.gz BBJMTRXUUJLKOB-GFCCVEGCSA-N -1 3 341.436 4.015 20 0 EIADHM O=c1cc(Nc2ccc(O)cc2C(F)(F)F)n(C2CCCC2)[n-]1 ZINC001176339597 1051995534 /nfs/dbraw/zinc/99/55/34/1051995534.db2.gz KFBGCBTWBMTOKV-UHFFFAOYSA-N -1 3 327.306 4.172 20 0 EIADHM COc1c(Cl)cc(Nc2cc(=O)[n-]c(C3CC3)n2)cc1Cl ZINC001176307647 1052012178 /nfs/dbraw/zinc/01/21/78/1052012178.db2.gz KFNSMTLFQYFMHH-UHFFFAOYSA-N -1 3 326.183 4.119 20 0 EIADHM COc1cccc(-c2cc(C(=O)Nc3cc([O-])cc(Cl)c3)c[nH]2)c1 ZINC001193854694 1052015082 /nfs/dbraw/zinc/01/50/82/1052015082.db2.gz RPXQWGSSVYTEBV-UHFFFAOYSA-N -1 3 342.782 4.302 20 0 EIADHM Cc1ccc(OC(=O)Nc2cc(Br)c(C)cc2[O-])cc1 ZINC001194462628 1052150039 /nfs/dbraw/zinc/15/00/39/1052150039.db2.gz JMHDLQMCZPDTBU-UHFFFAOYSA-N -1 3 336.185 4.382 20 0 EIADHM Cc1cccc(C)c1S(=O)(=O)[N-]c1cccc(C(F)(F)F)c1C ZINC001194634523 1052182417 /nfs/dbraw/zinc/18/24/17/1052182417.db2.gz TVHDCQZXJWPCFJ-UHFFFAOYSA-N -1 3 343.370 4.431 20 0 EIADHM O=C(NCc1c(F)cccc1Cl)c1cc([O-])cc(C(F)(F)F)c1 ZINC000622297617 1052192814 /nfs/dbraw/zinc/19/28/14/1052192814.db2.gz FOTKGGCMHBOAFC-UHFFFAOYSA-N -1 3 347.695 4.134 20 0 EIADHM CCOc1cc(/C=C/C(=O)c2sccc2OC)cc(Cl)c1[O-] ZINC000184768562 1052202507 /nfs/dbraw/zinc/20/25/07/1052202507.db2.gz UXIMBYLXDWHKSE-SNAWJCMRSA-N -1 3 338.812 4.411 20 0 EIADHM CC(C)CN(C(=O)c1cc(Cc2ccccc2)ccc1[O-])C(C)C ZINC000622341239 1052206684 /nfs/dbraw/zinc/20/66/84/1052206684.db2.gz WUFDSXFLOBDZRZ-UHFFFAOYSA-N -1 3 325.452 4.490 20 0 EIADHM CC(C)c1ccc(C(=O)N2CCc3cc(F)ccc3[C@@H]2C)c([O-])c1 ZINC001176981736 1052213202 /nfs/dbraw/zinc/21/32/02/1052213202.db2.gz VYIPXWGOHLJLNB-ZDUSSCGKSA-N -1 3 327.399 4.414 20 0 EIADHM CCc1ccc(C(=O)N(C)[C@H](C)Cc2ccc(Cl)cc2)c([O-])c1 ZINC000622381900 1052237427 /nfs/dbraw/zinc/23/74/27/1052237427.db2.gz FBFZAHDVHOIXOD-CYBMUJFWSA-N -1 3 331.843 4.311 20 0 EIADHM O=C(Nc1ccc2c(c1)COC2)c1cc(Cc2ccccc2)ccc1[O-] ZINC000622478165 1052288171 /nfs/dbraw/zinc/28/81/71/1052288171.db2.gz WSTZOOWXHCQSNW-UHFFFAOYSA-N -1 3 345.398 4.266 20 0 EIADHM Cc1ccc([O-])c(C(=O)N2CCOc3c2cccc3C(C)(C)C)c1 ZINC000622541628 1052321450 /nfs/dbraw/zinc/32/14/50/1052321450.db2.gz ZXWKYVLQSNVWNJ-UHFFFAOYSA-N -1 3 325.408 4.037 20 0 EIADHM CCc1ccc([O-])c(C(=O)N(CC2CC2)c2ccc(OC)cc2)c1 ZINC000622646452 1052368719 /nfs/dbraw/zinc/36/87/19/1052368719.db2.gz FPDISTFYUWNJDP-UHFFFAOYSA-N -1 3 325.408 4.020 20 0 EIADHM CCc1ccc([O-])c(C(=O)N2CC(c3cccc(C(F)(F)F)c3)C2)c1 ZINC000622661395 1052375437 /nfs/dbraw/zinc/37/54/37/1052375437.db2.gz DHPFAXDBGQOXRN-UHFFFAOYSA-N -1 3 349.352 4.213 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)N1CC[C@@H](C2CCCCC2)C1 ZINC000622750511 1052424186 /nfs/dbraw/zinc/42/41/86/1052424186.db2.gz JODLBTWRZFGLBL-QGZVFWFLSA-N -1 3 333.447 4.283 20 0 EIADHM O=C([N-]c1nnc(-c2cccc(Cl)c2)s1)c1ccoc1Cl ZINC000192304050 1052493229 /nfs/dbraw/zinc/49/32/29/1052493229.db2.gz WNYVXWZURDYYLW-UHFFFAOYSA-N -1 3 340.191 4.357 20 0 EIADHM O=C(N=c1cc(-c2cccc(Cl)c2)[n-][nH]1)c1ccccc1Cl ZINC000622892205 1052525076 /nfs/dbraw/zinc/52/50/76/1052525076.db2.gz FVAQVTCWASJYCO-UHFFFAOYSA-N -1 3 332.190 4.058 20 0 EIADHM CC1(C(=O)[O-])CCN(CCSc2cc(Cl)ccc2Cl)CC1 ZINC000062844070 1052531659 /nfs/dbraw/zinc/53/16/59/1052531659.db2.gz DJAKVFSJRWZQJZ-UHFFFAOYSA-N -1 3 348.295 4.272 20 0 EIADHM O=C(Nc1cc(F)ccc1[O-])c1cc(Br)ccc1Cl ZINC000174880322 1052576666 /nfs/dbraw/zinc/57/66/66/1052576666.db2.gz GZZPXXZCQODWIH-UHFFFAOYSA-N -1 3 344.567 4.200 20 0 EIADHM O=C(Nc1cc(Br)ccc1[O-])c1cccc(C(F)F)c1 ZINC000176187470 1052613428 /nfs/dbraw/zinc/61/34/28/1052613428.db2.gz FJFIGIBZBMQQFR-UHFFFAOYSA-N -1 3 342.139 4.345 20 0 EIADHM Cc1nc(-c2ccsc2)ccc1C(=O)Nc1cc(F)ccc1[O-] ZINC000178327489 1052704871 /nfs/dbraw/zinc/70/48/71/1052704871.db2.gz LPGMRJGEMAXMPT-UHFFFAOYSA-N -1 3 328.368 4.216 20 0 EIADHM Cc1[nH]c2ccccc2c1C(=O)Nc1cc(Br)ccc1[O-] ZINC000179652798 1052746294 /nfs/dbraw/zinc/74/62/94/1052746294.db2.gz IWBMVXMUBOTVSG-UHFFFAOYSA-N -1 3 345.196 4.197 20 0 EIADHM Cc1noc(-c2ccccc2)c1[N-]C(=O)c1cc(F)c(F)c(F)c1 ZINC000183392401 1052972500 /nfs/dbraw/zinc/97/25/00/1052972500.db2.gz UYKCQBPRUNQKEL-UHFFFAOYSA-N -1 3 332.281 4.320 20 0 EIADHM C[C@H](c1ccc(Cl)cc1Cl)S(=O)(=O)c1cccc([O-])c1 ZINC000183994786 1052988931 /nfs/dbraw/zinc/98/89/31/1052988931.db2.gz CXYLEYBYLAOXNQ-SECBINFHSA-N -1 3 331.220 4.234 20 0 EIADHM Cc1ccc([C@H](C)NCc2cc(=O)oc3cc([O-])c(Cl)cc23)cc1 ZINC000794561714 1053081543 /nfs/dbraw/zinc/08/15/43/1053081543.db2.gz JDBKWPOAIFJQRX-LBPRGKRZSA-N -1 3 343.810 4.311 20 0 EIADHM O=C(Nc1ccccc1Cc1ccccc1)c1cnc(C(F)(F)F)[n-]1 ZINC001194781709 1053091172 /nfs/dbraw/zinc/09/11/72/1053091172.db2.gz FFBGSZGTYWBXRL-UHFFFAOYSA-N -1 3 345.324 4.272 20 0 EIADHM CC1(C)CCN(Cc2nnc(-c3ccccc3[O-])o2)c2ccccc21 ZINC001194792099 1053094084 /nfs/dbraw/zinc/09/40/84/1053094084.db2.gz PZXKVPNVUYVVSR-UHFFFAOYSA-N -1 3 335.407 4.130 20 0 EIADHM CCCCCCOc1ccc(C=Cc2nccc(=O)[n-]2)cc1OC ZINC000764436910 1053103965 /nfs/dbraw/zinc/10/39/65/1053103965.db2.gz XMXCDGAETPYHDY-NTMALXAHSA-N -1 3 328.412 4.320 20 0 EIADHM O=C([O-])CC1(CCNCc2c(F)cccc2Cl)CCCCC1 ZINC000382184091 1053157600 /nfs/dbraw/zinc/15/76/00/1053157600.db2.gz UXTBRUABKLWCOE-UHFFFAOYSA-N -1 3 327.827 4.384 20 0 EIADHM [O-]c1ccc(CN[C@H](CCc2ccccc2)C(F)(F)F)cc1F ZINC000775632121 1053253931 /nfs/dbraw/zinc/25/39/31/1053253931.db2.gz HINAYUWOQUUQAE-MRXNPFEDSA-N -1 3 327.321 4.185 20 0 EIADHM CC(=O)c1cccc([O-])c1NC(=O)Oc1ccccc1C(F)(F)F ZINC001195201507 1053329617 /nfs/dbraw/zinc/32/96/17/1053329617.db2.gz ZZFKCAQRBKYVEK-UHFFFAOYSA-N -1 3 339.269 4.225 20 0 EIADHM Cc1cccc([N-]S(=O)(=O)c2c(C)cccc2Cl)c1Cl ZINC001195316984 1053374680 /nfs/dbraw/zinc/37/46/80/1053374680.db2.gz YUYAOIDQVLBURM-UHFFFAOYSA-N -1 3 330.236 4.411 20 0 EIADHM CCOC([O-])=NC(=S)Nc1cc2oc3ccccc3c2cc1OC ZINC001195490629 1053422193 /nfs/dbraw/zinc/42/21/93/1053422193.db2.gz LCVBHVRXWFLAJL-UHFFFAOYSA-N -1 3 344.392 4.038 20 0 EIADHM CCOC(=O)[N-]C(=S)Nc1cc2oc3ccccc3c2cc1OC ZINC001195490629 1053422197 /nfs/dbraw/zinc/42/21/97/1053422197.db2.gz LCVBHVRXWFLAJL-UHFFFAOYSA-N -1 3 344.392 4.038 20 0 EIADHM [O-]c1cccc(C(F)(F)F)c1NC(=S)Nc1ccccc1F ZINC001195777000 1053483352 /nfs/dbraw/zinc/48/33/52/1053483352.db2.gz SMFKKNAZFBTPRX-UHFFFAOYSA-N -1 3 330.306 4.359 20 0 EIADHM Cc1ccccc1-c1cccc([N-]S(=O)(=O)c2ccc(O)cc2)c1 ZINC001195802674 1053492240 /nfs/dbraw/zinc/49/22/40/1053492240.db2.gz IYMAQPKNUHQJIU-UHFFFAOYSA-N -1 3 339.416 4.168 20 0 EIADHM Cc1ccccc1-c1ccc([N-]S(=O)(=O)c2ccc(O)cc2)cc1 ZINC001195803045 1053493071 /nfs/dbraw/zinc/49/30/71/1053493071.db2.gz UYAOCQUVQQZULU-UHFFFAOYSA-N -1 3 339.416 4.168 20 0 EIADHM Cc1ccc([N-]S(=O)(=O)c2ccc(O)cc2)c(-c2ccccc2)c1 ZINC001195805894 1053493107 /nfs/dbraw/zinc/49/31/07/1053493107.db2.gz JNQWQMSGQUEMKQ-UHFFFAOYSA-N -1 3 339.416 4.168 20 0 EIADHM Cc1nc2sccc2c([N-]C(=O)c2snc(Cl)c2Cl)n1 ZINC001196334174 1053642805 /nfs/dbraw/zinc/64/28/05/1053642805.db2.gz PJWVGFBBRWYXQU-UHFFFAOYSA-N -1 3 345.236 4.015 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1cc(Cl)nc2ccccc21 ZINC000111210346 1053663887 /nfs/dbraw/zinc/66/38/87/1053663887.db2.gz SKGJTIYDKODGLG-UHFFFAOYSA-N -1 3 333.174 4.500 20 0 EIADHM C[C@@H](OCCCNC(=O)c1cc([O-])c2ccccc2c1)c1ccccc1 ZINC000471639717 1053677345 /nfs/dbraw/zinc/67/73/45/1053677345.db2.gz QBKLMYYVYZOJQK-MRXNPFEDSA-N -1 3 349.430 4.443 20 0 EIADHM CCOCc1ccccc1CNC(=O)c1cc([O-])c2ccccc2c1 ZINC000471700044 1053687061 /nfs/dbraw/zinc/68/70/61/1053687061.db2.gz GSDKQNJUBBXEJZ-UHFFFAOYSA-N -1 3 335.403 4.012 20 0 EIADHM CC1(C)Oc2ccc(NC(=O)c3cc([O-])c4ccccc4c3)cc2O1 ZINC000471747035 1053700552 /nfs/dbraw/zinc/70/05/52/1053700552.db2.gz GCKKYPZJJGWHEP-UHFFFAOYSA-N -1 3 335.359 4.305 20 0 EIADHM COc1ccccc1CN(C(=O)c1cc([O-])c2ccccc2c1)C1CC1 ZINC000471786634 1053728804 /nfs/dbraw/zinc/72/88/04/1053728804.db2.gz JASJFISSWJVSBE-UHFFFAOYSA-N -1 3 347.414 4.359 20 0 EIADHM CCCCCc1ccc(NC(=O)c2[n-]cnc2C(F)(F)F)cc1 ZINC000854247429 1053789457 /nfs/dbraw/zinc/78/94/57/1053789457.db2.gz RULITXCCSNIMER-UHFFFAOYSA-N -1 3 325.334 4.414 20 0 EIADHM CCCCCc1ccc(NC(=O)c2nc[n-]c2C(F)(F)F)cc1 ZINC000854247429 1053789473 /nfs/dbraw/zinc/78/94/73/1053789473.db2.gz RULITXCCSNIMER-UHFFFAOYSA-N -1 3 325.334 4.414 20 0 EIADHM COc1ccc(C(=O)N[C@@H]2CCSc3ccc(Cl)cc32)c([O-])c1 ZINC000024247965 1053800815 /nfs/dbraw/zinc/80/08/15/1053800815.db2.gz LPGGWZXKUBNKNH-CQSZACIVSA-N -1 3 349.839 4.021 20 0 EIADHM O=c1ccnc(C=Cc2ccc(Br)cc2C(F)(F)F)[n-]1 ZINC000794943349 1053817141 /nfs/dbraw/zinc/81/71/41/1053817141.db2.gz XTHVVBSLIGGOFH-DUXPYHPUSA-N -1 3 345.118 4.134 20 0 EIADHM Cc1noc(C(F)(F)F)c1C(=O)[N-]c1nc(C(C)C)c(C)s1 ZINC000855235080 1053892219 /nfs/dbraw/zinc/89/22/19/1053892219.db2.gz WKKVKLBVEYQZTF-UHFFFAOYSA-N -1 3 333.335 4.142 20 0 EIADHM Cc1cccc(F)c1[N-]S(=O)(=O)Cc1cc(Cl)ccc1Cl ZINC001197526984 1053924350 /nfs/dbraw/zinc/92/43/50/1053924350.db2.gz PBKIHJLMHYAIKS-UHFFFAOYSA-N -1 3 348.226 4.383 20 0 EIADHM O=C(Nc1ccc2c(c1)[C@@H](O)CCCC2)c1cc([O-])ccc1Cl ZINC000855545763 1053936571 /nfs/dbraw/zinc/93/65/71/1053936571.db2.gz HHMTVCGPCXYSSU-KRWDZBQOSA-N -1 3 331.799 4.058 20 0 EIADHM Cc1cccc2cccc([N-]S(=O)(=O)Cc3c(F)cccc3F)c12 ZINC001197608626 1053957000 /nfs/dbraw/zinc/95/70/00/1053957000.db2.gz VWDCBKYEMSEOGE-UHFFFAOYSA-N -1 3 347.386 4.368 20 0 EIADHM O=C(c1cc2sccc2c([O-])c1)N1CCC[C@H](c2cccnc2)C1 ZINC000869049195 1053957937 /nfs/dbraw/zinc/95/79/37/1053957937.db2.gz SBIYCOWAHBDODE-AWEZNQCLSA-N -1 3 338.432 4.022 20 0 EIADHM Cc1ccc(NC(=S)Nc2nc3c(cccc3[O-])s2)c(C)c1 ZINC001197959869 1054037737 /nfs/dbraw/zinc/03/77/37/1054037737.db2.gz RKQDVUFZUREUMO-UHFFFAOYSA-N -1 3 329.450 4.428 20 0 EIADHM Cc1sc(-c2ccco2)nc1C(=O)[N-]c1nnc(CC(C)C)s1 ZINC000030605157 1054044309 /nfs/dbraw/zinc/04/43/09/1054044309.db2.gz OQZRWCTVFFRUMH-UHFFFAOYSA-N -1 3 348.453 4.014 20 0 EIADHM O=C([N-]OCC1CCC1)[C@@H]1CC=CC[C@H]1c1nc2ccccc2s1 ZINC000856346075 1054060211 /nfs/dbraw/zinc/06/02/11/1054060211.db2.gz NUBOBBHLSLRBHT-HUUCEWRRSA-N -1 3 342.464 4.194 20 0 EIADHM Cc1c([O-])ccc2c(CSc3ncccc3Cl)cc(=O)oc12 ZINC000011248121 1054113843 /nfs/dbraw/zinc/11/38/43/1054113843.db2.gz MAQOLGXBDWIXSM-UHFFFAOYSA-N -1 3 333.796 4.148 20 0 EIADHM Cc1cc([N-]S(=O)(=O)c2ccccc2Cl)c(Cl)cc1F ZINC000033699412 1054129720 /nfs/dbraw/zinc/12/97/20/1054129720.db2.gz HOMOJFUNDBMEGS-UHFFFAOYSA-N -1 3 334.199 4.242 20 0 EIADHM Cc1ccccc1NC(=S)Nc1cc(Br)ccc1[O-] ZINC001198421085 1054140671 /nfs/dbraw/zinc/14/06/71/1054140671.db2.gz VGLCQAYAJIFSHX-UHFFFAOYSA-N -1 3 337.242 4.272 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N1CCC[C@H](OC2CCC2)CC1 ZINC000871326131 1054191752 /nfs/dbraw/zinc/19/17/52/1054191752.db2.gz BMDRLXQLMACEGD-SFHVURJKSA-N -1 3 339.435 4.109 20 0 EIADHM CC(C)(C)c1csc(CNC(=O)c2cc([O-])c3ccccc3c2)n1 ZINC000472040779 1054205383 /nfs/dbraw/zinc/20/53/83/1054205383.db2.gz IVKBYBPLIZPIJW-UHFFFAOYSA-N -1 3 340.448 4.229 20 0 EIADHM CN1CCCN(C(=O)c2cc([O-])c3ccccc3c2)c2ccccc21 ZINC000472187378 1054229589 /nfs/dbraw/zinc/22/95/89/1054229589.db2.gz CGQSZVKWXMCACZ-UHFFFAOYSA-N -1 3 332.403 4.032 20 0 EIADHM O=C([N-]C1(c2ccccc2)CCC1)C(F)(F)c1c(F)cccc1F ZINC000857434595 1054236369 /nfs/dbraw/zinc/23/63/69/1054236369.db2.gz JGQPDXGSYVRVNX-UHFFFAOYSA-N -1 3 337.316 4.252 20 0 EIADHM O=C(N[C@H](C1CCCC1)C(F)(F)F)c1cc([O-])c2ccccc2c1 ZINC000472247528 1054251452 /nfs/dbraw/zinc/25/14/52/1054251452.db2.gz QUFLEBWNBGPEQL-MRXNPFEDSA-N -1 3 337.341 4.396 20 0 EIADHM CC(C)c1cccc(F)c1[N-]S(=O)(=O)c1ccc2occc2c1 ZINC001198869533 1054295963 /nfs/dbraw/zinc/29/59/63/1054295963.db2.gz FFMUCKBFWUSSCL-UHFFFAOYSA-N -1 3 333.384 4.496 20 0 EIADHM O=C(Nc1ccccc1-c1cn[nH]c1)c1cc([O-])c2ccccc2c1 ZINC000472514209 1054337606 /nfs/dbraw/zinc/33/76/06/1054337606.db2.gz AWAAODPIBXBFBN-UHFFFAOYSA-N -1 3 329.359 4.188 20 0 EIADHM COc1cc(C)c([C@@H](C)N[C@@H](C)c2cccc([O-])c2F)cc1OC ZINC000872022893 1054338697 /nfs/dbraw/zinc/33/86/97/1054338697.db2.gz MTMDLQBREFYGTO-QWHCGFSZSA-N -1 3 333.403 4.269 20 0 EIADHM C[C@@H](NCc1cccc(OCC(F)F)c1)c1cccc([O-])c1F ZINC000872047270 1054358199 /nfs/dbraw/zinc/35/81/99/1054358199.db2.gz RAIZTTJNBXMZLI-LLVKDONJSA-N -1 3 325.330 4.026 20 0 EIADHM CCn1c2ccccc2nc1[C@H](C)N[C@@H](C)c1cccc([O-])c1F ZINC000872045219 1054358370 /nfs/dbraw/zinc/35/83/70/1054358370.db2.gz KAMBYJLDTMYXSJ-STQMWFEESA-N -1 3 327.403 4.313 20 0 EIADHM C[C@H](N[C@@H](C)c1cccc([O-])c1F)c1ccc(Br)cn1 ZINC000872067692 1054375463 /nfs/dbraw/zinc/37/54/63/1054375463.db2.gz BKCQEWDVLMPXPG-UWVGGRQHSA-N -1 3 339.208 4.101 20 0 EIADHM C[C@@H](N[C@H](C)c1cccc([O-])c1F)c1ccc(C(F)(F)F)nc1 ZINC000872130823 1054406050 /nfs/dbraw/zinc/40/60/50/1054406050.db2.gz SKLPTQDQZCGNLZ-NXEZZACHSA-N -1 3 328.309 4.357 20 0 EIADHM CC1CCC(OC2CCN(Cc3cc(C(=O)[O-])cs3)CC2)CC1 ZINC000872157221 1054412909 /nfs/dbraw/zinc/41/29/09/1054412909.db2.gz NVXFMKVUPHVKAP-UHFFFAOYSA-N -1 3 337.485 4.006 20 0 EIADHM CC1(C)[C@H](c2cccc(Cl)c2)CCN1Cc1cc(C(=O)[O-])co1 ZINC000872168008 1054420746 /nfs/dbraw/zinc/42/07/46/1054420746.db2.gz PWFVQAYMVZKMMW-INIZCTEOSA-N -1 3 333.815 4.399 20 0 EIADHM [O-]c1ccc(NC(=S)Nc2ccc(-n3cccn3)cc2)cc1Cl ZINC001200884520 1054568314 /nfs/dbraw/zinc/56/83/14/1054568314.db2.gz VQVDWWMAQRLDFC-UHFFFAOYSA-N -1 3 344.827 4.040 20 0 EIADHM CCCCCCNC(=S)Nc1ccc(Br)cc1[O-] ZINC001200954382 1054605441 /nfs/dbraw/zinc/60/54/41/1054605441.db2.gz WUIWZLFQRRGXBN-UHFFFAOYSA-N -1 3 331.279 4.021 20 0 EIADHM C[C@]1(C(F)(F)F)CCN(C(=O)c2cc3sccc3c([O-])c2)C1 ZINC000874477070 1054667983 /nfs/dbraw/zinc/66/79/83/1054667983.db2.gz LZCZQFUDQYVNMR-AWEZNQCLSA-N -1 3 329.343 4.021 20 0 EIADHM Cc1nc(-c2ccccc2)c(C(=O)[N-]c2nc(C(C)C)ns2)s1 ZINC000874697847 1054719604 /nfs/dbraw/zinc/71/96/04/1054719604.db2.gz GPVLZXDDOARBIU-UHFFFAOYSA-N -1 3 344.465 4.346 20 0 EIADHM Fc1ccccc1[N-]c1nnc(SCCc2ccncc2)s1 ZINC000061715619 1054765956 /nfs/dbraw/zinc/76/59/56/1054765956.db2.gz SUOLAMMTVQFDRC-UHFFFAOYSA-N -1 3 332.429 4.151 20 0 EIADHM O=C([O-])/C=C/c1ccc(CN2CCC(c3cccc(Cl)c3)CC2)o1 ZINC000902341792 1054806505 /nfs/dbraw/zinc/80/65/05/1054806505.db2.gz FRCSRHALFRNIMW-VOTSOKGWSA-N -1 3 345.826 4.410 20 0 EIADHM COCc1ccc([N-]S(=O)(=O)c2c(C)c(C)c(C)c(C)c2C)cc1 ZINC001201800002 1054909550 /nfs/dbraw/zinc/90/95/50/1054909550.db2.gz ZZEKHLAGJNBRAQ-UHFFFAOYSA-N -1 3 347.480 4.176 20 0 EIADHM O=C([N-]c1cc(-c2ccccn2)no1)Nc1ccccc1C(F)(F)F ZINC001202155155 1055061446 /nfs/dbraw/zinc/06/14/46/1055061446.db2.gz XXQGZFPGMIWSNK-UHFFFAOYSA-N -1 3 348.284 4.399 20 0 EIADHM CC1(c2nsc([N-]C(=O)c3cc4c(cccc4F)s3)n2)CC1 ZINC000862608864 1055091101 /nfs/dbraw/zinc/09/11/01/1055091101.db2.gz DSPGHLDRUOUJEH-UHFFFAOYSA-N -1 3 333.413 4.196 20 0 EIADHM CC(=O)c1cccc(NC(=O)Nc2cccc(C(F)(F)F)c2)c1[O-] ZINC001202298089 1055129193 /nfs/dbraw/zinc/12/91/93/1055129193.db2.gz LGTRRNFGSFQNDH-UHFFFAOYSA-N -1 3 338.285 4.258 20 0 EIADHM [O-]c1ccccc1-c1nnc(CN(C2CC2)[C@H]2CCc3ccccc32)o1 ZINC000878216887 1055211140 /nfs/dbraw/zinc/21/11/40/1055211140.db2.gz QGQPXLKNUPJJDU-SFHVURJKSA-N -1 3 347.418 4.094 20 0 EIADHM O=C([O-])c1cnc(C2CCN(Cc3ccc(C4CC4)cc3)CC2)s1 ZINC000863473183 1055212230 /nfs/dbraw/zinc/21/22/30/1055212230.db2.gz CSPLGOAZTSLYJL-UHFFFAOYSA-N -1 3 342.464 4.098 20 0 EIADHM CCc1cc2c(CSCCC(F)(F)F)cc(=O)oc2cc1[O-] ZINC000794533704 1055224965 /nfs/dbraw/zinc/22/49/65/1055224965.db2.gz AGNNHDCHFTYPGU-UHFFFAOYSA-N -1 3 332.343 4.247 20 0 EIADHM CC(C)C[C@H](NCc1nnc(-c2ccccc2[O-])o1)c1ccccc1 ZINC000878345786 1055251527 /nfs/dbraw/zinc/25/15/27/1055251527.db2.gz AXHSLGQRIGPDPV-KRWDZBQOSA-N -1 3 337.423 4.319 20 0 EIADHM Cc1sc2[n-]c([C@H](C)OC(=O)[C@H]3CC[C@@H](C)C3)nc(=O)c2c1C ZINC000776424838 1055290517 /nfs/dbraw/zinc/29/05/17/1055290517.db2.gz PMRWWNFXDYOYCG-QRTLGDNMSA-N -1 3 334.441 4.054 20 0 EIADHM Cc1cc(O[C@@H](C)C(=O)NCc2ccc([O-])c(F)c2)ccc1C(C)C ZINC000303744547 1056264636 /nfs/dbraw/zinc/26/46/36/1056264636.db2.gz ACQJLUMCJKVCGC-AWEZNQCLSA-N -1 3 345.414 4.047 20 0 EIADHM CC[C@@H](NC(=O)c1cc([O-])c2ccccc2c1)c1nc(C)cs1 ZINC000354304369 1056416366 /nfs/dbraw/zinc/41/63/66/1056416366.db2.gz PYYJLGHZBFBVDY-OAHLLOKOSA-N -1 3 326.421 4.191 20 0 EIADHM [O-]c1ccc(CNC(=S)Nc2ccc(Cl)c(Cl)c2)cc1F ZINC000737461018 1058548180 /nfs/dbraw/zinc/54/81/80/1058548180.db2.gz HCXLSLHFNKRROM-UHFFFAOYSA-N -1 3 345.226 4.325 20 0 EIADHM Cc1cc(=O)[n-]c(-c2cccc(OC(=O)CCC3CCCCC3)c2)n1 ZINC000744218601 1059334230 /nfs/dbraw/zinc/33/42/30/1059334230.db2.gz OKJFBVKUXCYROK-UHFFFAOYSA-N -1 3 340.423 4.424 20 0 EIADHM Cc1nc(C(=O)[N-]c2cccc(Cl)c2SCC(F)F)co1 ZINC000185695041 1060103096 /nfs/dbraw/zinc/10/30/96/1060103096.db2.gz NGDQFBOBLFVMTI-UHFFFAOYSA-N -1 3 332.759 4.246 20 0 EIADHM [O-]c1ccc(Cl)c(Nc2c(O)cccc2Br)c1F ZINC001214561291 1060286062 /nfs/dbraw/zinc/28/60/62/1060286062.db2.gz DPZCSUGLUVAAKQ-UHFFFAOYSA-N -1 3 332.556 4.396 20 0 EIADHM CC[C@@H](NCc1nc(=O)c2sccc2[n-]1)c1ccc(C)c(F)c1 ZINC001168838073 1060450109 /nfs/dbraw/zinc/45/01/09/1060450109.db2.gz LSSKBXCHZSGJMI-CYBMUJFWSA-N -1 3 331.416 4.085 20 0 EIADHM O=C(/C=C/c1ccc(-c2ccc(F)cc2)s1)[N-]OCC(F)(F)F ZINC000766764142 1060884599 /nfs/dbraw/zinc/88/45/99/1060884599.db2.gz JPPJAEBVJATGTD-SOFGYWHQSA-N -1 3 345.317 4.178 20 0 EIADHM CON(C)C(=O)c1c(Cl)cccc1Nc1ccc(Cl)c([O-])c1 ZINC001212594167 1060928424 /nfs/dbraw/zinc/92/84/24/1060928424.db2.gz RVBLRTNATZZEHX-UHFFFAOYSA-N -1 3 341.194 4.076 20 0 EIADHM C[C@H](c1cc2ccccc2o1)N(C)C(=O)c1c[n-]c2ccccc2c1=O ZINC000053797374 214198769 /nfs/dbraw/zinc/19/87/69/214198769.db2.gz OBNHCNBDVLIGJE-CYBMUJFWSA-N -1 3 346.386 4.108 20 0 EIADHM Cc1ccc(NC(=O)c2cc(Br)ccc2Cl)c([O-])c1 ZINC000021900386 212261563 /nfs/dbraw/zinc/26/15/63/212261563.db2.gz VZSUTRRSZMQYFD-UHFFFAOYSA-N -1 3 340.604 4.369 20 0 EIADHM Cc1ccc(C(=O)N(C)Cc2ccccc2C(F)(F)F)c([O-])c1C ZINC000097466465 219026155 /nfs/dbraw/zinc/02/61/55/219026155.db2.gz JEBLCQXEZQJNDE-UHFFFAOYSA-N -1 3 337.341 4.300 20 0 EIADHM N#CC(=C([O-])C=C(C1CC1)C1CC1)c1nc2ccccc2n1C(F)F ZINC000054466148 1032174586 /nfs/dbraw/zinc/17/45/86/1032174586.db2.gz MGZXGZJLSJXYAK-CQSZACIVSA-N -1 3 341.361 4.354 20 0 EIADHM CC(C)c1ncsc1C(=O)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000450088783 1032275034 /nfs/dbraw/zinc/27/50/34/1032275034.db2.gz QEUPVCMUSUJXDO-UHFFFAOYSA-N -1 3 330.331 4.243 20 0 EIADHM CN(c1ccccc1NC(=O)Cc1ccc([O-])c(F)c1)C1CCCC1 ZINC000450181018 1032326749 /nfs/dbraw/zinc/32/67/49/1032326749.db2.gz NWLUECWEGJICIG-UHFFFAOYSA-N -1 3 342.414 4.091 20 0 EIADHM O=C(Cc1ccc([O-])c(F)c1)N1CCCC[C@H]1c1ccc(F)cc1F ZINC000450171945 1032327470 /nfs/dbraw/zinc/32/74/70/1032327470.db2.gz JKXZMUVMIZLENM-KRWDZBQOSA-N -1 3 349.352 4.106 20 0 EIADHM CCc1c(C(=O)Nc2ccc(Cl)cc2[O-])cnn1-c1ccccc1 ZINC000533160012 1032513209 /nfs/dbraw/zinc/51/32/09/1032513209.db2.gz JLRRLGLVJIVJOM-UHFFFAOYSA-N -1 3 341.798 4.046 20 0 EIADHM CC(C)(C)Oc1cc(F)ccc1NC(=O)Cc1ccc([O-])c(F)c1 ZINC000450513261 1032537731 /nfs/dbraw/zinc/53/77/31/1032537731.db2.gz WVPHWKSVIAPGNR-UHFFFAOYSA-N -1 3 335.350 4.029 20 0 EIADHM CC(C)c1ccc(-c2ncc(CN3CCC(C(=O)[O-])CC3)s2)cc1 ZINC000262676778 1032591910 /nfs/dbraw/zinc/59/19/10/1032591910.db2.gz UJZDIGPDOYZBCT-UHFFFAOYSA-N -1 3 344.480 4.230 20 0 EIADHM O=C(Cc1csc(-c2ccccc2)n1)Nc1ccc(Cl)cc1[O-] ZINC000153588093 1019146743 /nfs/dbraw/zinc/14/67/43/1019146743.db2.gz JNBYMKCOSDYNIU-UHFFFAOYSA-N -1 3 344.823 4.350 20 0 EIADHM CC(C)Cc1nnc([N-]C(=O)c2cnc(-c3ccccc3)s2)s1 ZINC000047075513 1019315450 /nfs/dbraw/zinc/31/54/50/1019315450.db2.gz QHYQAYPMEVJSHW-UHFFFAOYSA-N -1 3 344.465 4.112 20 0 EIADHM C[C@@H](c1ccc(OC(F)(F)F)cc1)[S@](=O)c1ccc([O-])cc1 ZINC000108086549 1019339095 /nfs/dbraw/zinc/33/90/95/1019339095.db2.gz GGGXMFACHFINRG-MLMJSJRWSA-N -1 3 330.327 4.160 20 0 EIADHM CC(C)[C@H]1CCc2nc([N-]C(=O)c3ocnc3C(F)F)sc2C1 ZINC000890592779 1019473387 /nfs/dbraw/zinc/47/33/87/1019473387.db2.gz FGFJRQIIIICFPF-QMMMGPOBSA-N -1 3 341.383 4.082 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1csc(Cc2ccccc2)n1 ZINC000109127892 1019585278 /nfs/dbraw/zinc/58/52/78/1019585278.db2.gz ODZQQJNXSGBVJG-UHFFFAOYSA-N -1 3 344.823 4.345 20 0 EIADHM CCN(Cc1nc2c3ccccc3oc2c(=O)[n-]1)c1cccc(C)c1 ZINC000512482173 1032885548 /nfs/dbraw/zinc/88/55/48/1032885548.db2.gz CCLRMFXZSSAHBL-UHFFFAOYSA-N -1 3 333.391 4.417 20 0 EIADHM CC[C@H]1CCc2nc(NC(=O)c3cc([O-])ccc3Cl)sc2C1 ZINC000683373480 1020450767 /nfs/dbraw/zinc/45/07/67/1020450767.db2.gz ISWPLKXRBWOLEF-VIFPVBQESA-N -1 3 336.844 4.269 20 0 EIADHM COc1cccc(-n2ncc(C)c2Nc2cccc(Cl)c2[O-])c1 ZINC001210219449 1020958475 /nfs/dbraw/zinc/95/84/75/1020958475.db2.gz JDOXZFYTJRMUSE-UHFFFAOYSA-N -1 3 329.787 4.292 20 0 EIADHM CC1(C)CCC(C)(C)N(C(=O)c2cc([O-])cc(Br)c2)C1 ZINC001167325273 1021115493 /nfs/dbraw/zinc/11/54/93/1021115493.db2.gz OEIOXEUADUAEEY-UHFFFAOYSA-N -1 3 340.261 4.196 20 0 EIADHM Cc1cc([C@@H](C)NCc2ncc(Br)cc2[O-])c(C)s1 ZINC000892510428 1021313231 /nfs/dbraw/zinc/31/32/31/1021313231.db2.gz YDFGIAPWIGNYDE-SECBINFHSA-N -1 3 341.274 4.079 20 0 EIADHM Cc1c([O-])ccc2c(CSc3ccc(Cl)cn3)cc(=O)oc12 ZINC000219814153 1021472186 /nfs/dbraw/zinc/47/21/86/1021472186.db2.gz JDMVYXHBYJPLEX-UHFFFAOYSA-N -1 3 333.796 4.148 20 0 EIADHM O=c1cc(C(F)(F)F)nc(C=Cc2cnc(C3CCC3)s2)[n-]1 ZINC000656106034 1021550231 /nfs/dbraw/zinc/55/02/31/1021550231.db2.gz IVNJGEDVDSLWQX-PLNGDYQASA-N -1 3 327.331 4.095 20 0 EIADHM CSc1ccc(CN2CCC(C(=O)c3ccc([O-])cc3)CC2)s1 ZINC000685833655 1021646785 /nfs/dbraw/zinc/64/67/85/1021646785.db2.gz LHLTYIFEXOYFDY-UHFFFAOYSA-N -1 3 347.505 4.271 20 0 EIADHM CCSc1cccc(F)c1[N-]S(=O)(=O)Cc1ccccc1C ZINC000580138322 1021704484 /nfs/dbraw/zinc/70/44/84/1021704484.db2.gz OULVFPLADUCNGR-UHFFFAOYSA-N -1 3 339.457 4.188 20 0 EIADHM C[C@@H](NCc1ncccc1[O-])c1ccccc1OCc1ccccc1 ZINC000580258806 1021807267 /nfs/dbraw/zinc/80/72/67/1021807267.db2.gz KDQWLDQCSJUWIN-MRXNPFEDSA-N -1 3 334.419 4.217 20 0 EIADHM COCCOc1c(F)cc(Nc2cccc([O-])c2Cl)cc1F ZINC001210859741 1021810145 /nfs/dbraw/zinc/81/01/45/1021810145.db2.gz MHIBLTZMTRTQEC-UHFFFAOYSA-N -1 3 329.730 4.093 20 0 EIADHM O=C([O-])C[C@H](NCc1cccs1)c1cccc(C(F)(F)F)c1 ZINC000340685473 1021997564 /nfs/dbraw/zinc/99/75/64/1021997564.db2.gz ZSCREHMFXXGUJY-ZDUSSCGKSA-N -1 3 329.343 4.073 20 0 EIADHM O=C([N-]c1nnc([C@@H]2CCCO2)s1)c1c(Cl)oc2ccccc21 ZINC000636359862 1022021652 /nfs/dbraw/zinc/02/16/52/1022021652.db2.gz QMFSLLFUKVBPSU-JTQLQIEISA-N -1 3 349.799 4.042 20 0 EIADHM CSc1ccc([O-])c(C(=O)N2CC[C@@H](c3cccc(C)c3)C2)c1 ZINC000613458145 1022064335 /nfs/dbraw/zinc/06/43/35/1022064335.db2.gz GNUDLPNISOUCEU-OAHLLOKOSA-N -1 3 327.449 4.052 20 0 EIADHM COc1ccc(-c2csc3[n-]c(-c4cccs4)nc(=O)c23)cc1 ZINC000046703804 1022143907 /nfs/dbraw/zinc/14/39/07/1022143907.db2.gz SXFKURUDUYECSH-UHFFFAOYSA-N -1 3 340.429 4.389 20 0 EIADHM CCS[C@@H]1CC[C@@H](N(C)Cc2cc(C(=O)[O-])ccc2Cl)C1 ZINC000580777967 1022488132 /nfs/dbraw/zinc/48/81/32/1022488132.db2.gz AUHBBCROVOBRBZ-ZIAGYGMSSA-N -1 3 327.877 4.144 20 0 EIADHM CC(C)(C)Oc1cccc(CCC(=O)Nc2c([O-])cccc2Cl)n1 ZINC000580862433 1022630392 /nfs/dbraw/zinc/63/03/92/1022630392.db2.gz WYNZKMIZHNKSDQ-UHFFFAOYSA-N -1 3 348.830 4.189 20 0 EIADHM CCOc1ccc(SCC(=O)Nc2cc(Cl)ccc2[O-])cc1 ZINC000104863506 1022837839 /nfs/dbraw/zinc/83/78/39/1022837839.db2.gz XDMQQTOPGGKFIP-UHFFFAOYSA-N -1 3 337.828 4.175 20 0 EIADHM CC[C@H]([N-]S(=O)(=O)c1c(F)cccc1F)c1cccc(Cl)c1 ZINC000046746854 1022890777 /nfs/dbraw/zinc/89/07/77/1022890777.db2.gz MSHJNCKHFJSGCA-AWEZNQCLSA-N -1 3 345.798 4.048 20 0 EIADHM COCOc1ccc(Nc2cc(Br)cc(F)c2[O-])cc1 ZINC001211643630 1022989262 /nfs/dbraw/zinc/98/92/62/1022989262.db2.gz AVZKYVRNTIUZKM-UHFFFAOYSA-N -1 3 342.164 4.020 20 0 EIADHM CCOc1ccc(-c2nc(CC)c(C(=O)[N-]c3cnoc3)s2)cc1 ZINC000684207970 1023063196 /nfs/dbraw/zinc/06/31/96/1023063196.db2.gz NIKKFHWFXOKVRT-UHFFFAOYSA-N -1 3 343.408 4.012 20 0 EIADHM Cc1cccc(S(=O)(=O)[N-]c2cc(C)c(F)cc2Cl)c1F ZINC000313239036 1023166929 /nfs/dbraw/zinc/16/69/29/1023166929.db2.gz PUMXZALGQPHWPH-UHFFFAOYSA-N -1 3 331.771 4.036 20 0 EIADHM CC(=O)c1ccccc1-c1noc(C=C([O-])c2ccccc2Cl)n1 ZINC001211646904 1023211178 /nfs/dbraw/zinc/21/11/78/1023211178.db2.gz BWUJQPSOTNYNNC-UHFFFAOYSA-N -1 3 340.766 4.018 20 0 EIADHM CCc1cccc(-c2noc(C=C([O-])c3ccccc3Cl)n2)c1 ZINC001211647262 1023219295 /nfs/dbraw/zinc/21/92/95/1023219295.db2.gz KSLPVKZHYHUQQA-UHFFFAOYSA-N -1 3 326.783 4.378 20 0 EIADHM Cc1ccc(Oc2ccccc2NC(=O)c2cccc3n[n-]nc32)cc1 ZINC000584739560 1023265694 /nfs/dbraw/zinc/26/56/94/1023265694.db2.gz WGVICXLIABJHFE-UHFFFAOYSA-N -1 3 344.374 4.311 20 0 EIADHM Cc1sccc1CN[C@H](CC(=O)[O-])c1cccc(C(F)(F)F)c1 ZINC000417577144 1023361255 /nfs/dbraw/zinc/36/12/55/1023361255.db2.gz ISIBMVSBIOOGNG-CQSZACIVSA-N -1 3 343.370 4.381 20 0 EIADHM Cc1cc(C(=O)CCC(=O)Nc2c([O-])cccc2Cl)c(C)s1 ZINC000581564734 1023364284 /nfs/dbraw/zinc/36/42/84/1023364284.db2.gz FXAAGRKFVVSYEV-UHFFFAOYSA-N -1 3 337.828 4.326 20 0 EIADHM CCCCOc1ccccc1CN[C@H]1C[C@@H](C(=O)[O-])c2ccccc21 ZINC000417628643 1023387751 /nfs/dbraw/zinc/38/77/51/1023387751.db2.gz PPJFWSBOGPMKKR-MOPGFXCFSA-N -1 3 339.435 4.268 20 0 EIADHM CC(C)(C)c1cnc(CNCCC2(CC(=O)[O-])CCCCC2)s1 ZINC000417648847 1023390039 /nfs/dbraw/zinc/39/00/39/1023390039.db2.gz KHSYTIQYZNBKOW-UHFFFAOYSA-N -1 3 338.517 4.346 20 0 EIADHM CCOc1cc(CNc2ccc(OC)c(OC)c2)cc(Cl)c1[O-] ZINC000076275258 1023471857 /nfs/dbraw/zinc/47/18/57/1023471857.db2.gz SKKQFXLIGSBWHV-UHFFFAOYSA-N -1 3 337.803 4.074 20 0 EIADHM O=C([O-])[C@@H]1CCN(Cc2cccc(Cl)c2Cl)[C@@H]2CCCC[C@H]12 ZINC000656763464 1023503886 /nfs/dbraw/zinc/50/38/86/1023503886.db2.gz FXSVXTQIAHTRIQ-UMVBOHGHSA-N -1 3 342.266 4.459 20 0 EIADHM O=C([O-])[C@H](c1ccc(Cl)cc1Cl)N1CCC[C@H](CCF)C1 ZINC000656763044 1023505366 /nfs/dbraw/zinc/50/53/66/1023505366.db2.gz KPRIARQMEXZQBT-YGRLFVJLSA-N -1 3 334.218 4.191 20 0 EIADHM O=C([O-])[C@H](c1ccc(Cl)cc1Cl)N1CCC[C@@H](CCF)C1 ZINC000656763041 1023505765 /nfs/dbraw/zinc/50/57/65/1023505765.db2.gz KPRIARQMEXZQBT-HZMBPMFUSA-N -1 3 334.218 4.191 20 0 EIADHM O=C([O-])[C@@H](c1ccc(Cl)c(Cl)c1)N1CCC[C@H](CCF)C1 ZINC000656763855 1023507403 /nfs/dbraw/zinc/50/74/03/1023507403.db2.gz RTUCXSTYZPZXDY-QMTHXVAHSA-N -1 3 334.218 4.191 20 0 EIADHM CC(C)(C)c1ccccc1S(=O)(=O)[N-]c1ccc(F)c(F)c1F ZINC000460413853 1023508061 /nfs/dbraw/zinc/50/80/61/1023508061.db2.gz VAJZLAKFVAYTFQ-UHFFFAOYSA-N -1 3 343.370 4.202 20 0 EIADHM CC[C@@H](NC(=O)CCCc1ccc([O-])c(F)c1)c1ccc(C)cc1 ZINC000468582110 1023515111 /nfs/dbraw/zinc/51/51/11/1023515111.db2.gz SXAPFHNEHRBECK-GOSISDBHSA-N -1 3 329.415 4.430 20 0 EIADHM CC(C)(C)c1ccccc1S(=O)(=O)[N-]c1cc(F)ccc1F ZINC000460440992 1023554879 /nfs/dbraw/zinc/55/48/79/1023554879.db2.gz RNCNCSGMASGADX-UHFFFAOYSA-N -1 3 325.380 4.063 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N3CCC[C@H](C(C)(C)C)C3)nc2)n1 ZINC000581701470 1023622328 /nfs/dbraw/zinc/62/23/28/1023622328.db2.gz XMIHBCOZDYPFJX-HNNXBMFYSA-N -1 3 340.471 4.069 20 0 EIADHM O=C(c1cc([O-])ccc1Cl)N1CC[C@H](CSc2ccccc2)C1 ZINC000431847039 1023635082 /nfs/dbraw/zinc/63/50/82/1023635082.db2.gz TUUONNYOTSMESO-ZDUSSCGKSA-N -1 3 347.867 4.300 20 0 EIADHM O=C(c1cc([O-])ccc1Cl)N1CC[C@@H](CSc2ccccc2)C1 ZINC000431847038 1023635444 /nfs/dbraw/zinc/63/54/44/1023635444.db2.gz TUUONNYOTSMESO-CYBMUJFWSA-N -1 3 347.867 4.300 20 0 EIADHM O=C([O-])C1CCN(Cc2ccc(Oc3ccccc3F)c(F)c2)CC1 ZINC000430660536 1023740202 /nfs/dbraw/zinc/74/02/02/1023740202.db2.gz DOWJVRCIAASJJB-UHFFFAOYSA-N -1 3 347.361 4.054 20 0 EIADHM O=C(N[C@@H]1C[C@H]1c1ccc(Cl)c(F)c1)c1cc([O-])ccc1Cl ZINC000511697136 1023829388 /nfs/dbraw/zinc/82/93/88/1023829388.db2.gz IBWBWQOEHJXLHH-ZUZCIYMTSA-N -1 3 340.181 4.124 20 0 EIADHM C[C@@H](NC(=O)c1cc([O-])ccc1Cl)c1c(F)cccc1Cl ZINC000581899174 1023850123 /nfs/dbraw/zinc/85/01/23/1023850123.db2.gz DXUMSYVYADAGPY-MRVPVSSYSA-N -1 3 328.170 4.329 20 0 EIADHM Cc1ccc(Cc2nnc([N-]C(=O)c3sccc3Cl)s2)cc1 ZINC000511811289 1023897071 /nfs/dbraw/zinc/89/70/71/1023897071.db2.gz QVRSKQAXJDQFHX-UHFFFAOYSA-N -1 3 349.868 4.405 20 0 EIADHM CC(C)c1nnc([N-]C(=O)c2csc(-c3ccccc3)n2)s1 ZINC000198564579 1023995699 /nfs/dbraw/zinc/99/56/99/1023995699.db2.gz ZAFMJJFCWLOHTA-UHFFFAOYSA-N -1 3 330.438 4.037 20 0 EIADHM Cc1cc(=O)[n-]c(C(C)(C)NCc2ccc(-c3ccsc3)cc2)n1 ZINC000660749787 1024045393 /nfs/dbraw/zinc/04/53/93/1024045393.db2.gz PTORWCUWCIKRKT-UHFFFAOYSA-N -1 3 339.464 4.244 20 0 EIADHM CCSc1ccc(Cl)cc1[N-]C(=O)c1ccnc(F)c1OC ZINC001126027319 1024216229 /nfs/dbraw/zinc/21/62/29/1024216229.db2.gz CLTUHTZTFLVEAN-UHFFFAOYSA-N -1 3 340.807 4.247 20 0 EIADHM CCn1nc(C)c(NC(=O)c2cc(Cc3ccccc3)ccc2[O-])c1C ZINC000091684330 1024335559 /nfs/dbraw/zinc/33/55/59/1024335559.db2.gz LXVHIZMGYBTSKR-UHFFFAOYSA-N -1 3 349.434 4.069 20 0 EIADHM O=S(=O)([N-]c1ccc(N2CCCCCC2)cc1)c1cccc(F)c1 ZINC000326578944 1024407350 /nfs/dbraw/zinc/40/73/50/1024407350.db2.gz GZPYJFMICKVGAJ-UHFFFAOYSA-N -1 3 348.443 4.007 20 0 EIADHM Cc1c(Cl)cccc1S(=O)(=O)[N-]c1ccc(Cl)cc1F ZINC000048653021 1024670432 /nfs/dbraw/zinc/67/04/32/1024670432.db2.gz CIWGQQSZBXQSMV-UHFFFAOYSA-N -1 3 334.199 4.242 20 0 EIADHM O=C([O-])[C@@H](CCN(Cc1ccc(F)cc1F)C1CC1)c1ccccc1 ZINC000652388019 1024800736 /nfs/dbraw/zinc/80/07/36/1024800736.db2.gz LUUHEJGPQQSKOT-SFHVURJKSA-N -1 3 345.389 4.188 20 0 EIADHM Cc1cc([C@H]2CCCN2Cc2c3ccccc3sc2C(=O)[O-])on1 ZINC000652396978 1024806516 /nfs/dbraw/zinc/80/65/16/1024806516.db2.gz IQXBBNUPJNXNMI-CQSZACIVSA-N -1 3 342.420 4.233 20 0 EIADHM O=C([O-])C[C@@H](NCc1cccc(OC2CCCC2)c1)c1ccsc1 ZINC000276960634 1024832475 /nfs/dbraw/zinc/83/24/75/1024832475.db2.gz FRPTVTYXCPVULU-GOSISDBHSA-N -1 3 345.464 4.375 20 0 EIADHM C[C@@H](c1ccc(C(=O)[O-])o1)N1CCC(c2cccc(F)c2F)CC1 ZINC000652449635 1024838122 /nfs/dbraw/zinc/83/81/22/1024838122.db2.gz HYENGHRFQJSHEB-NSHDSACASA-N -1 3 335.350 4.197 20 0 EIADHM CCOc1cccc(C(=O)/C=C/c2cc(Cl)c([O-])c(OC)c2)c1 ZINC000060162651 1024938137 /nfs/dbraw/zinc/93/81/37/1024938137.db2.gz MYJYYHKLERPNSG-BQYQJAHWSA-N -1 3 332.783 4.349 20 0 EIADHM [O-]c1ccc(Cc2ccccc2)cc1-c1nc(-c2ccncc2)no1 ZINC000184864013 1024979572 /nfs/dbraw/zinc/97/95/72/1024979572.db2.gz NHMCHNHOOWFBLW-UHFFFAOYSA-N -1 3 329.359 4.095 20 0 EIADHM O=C(NN=Cc1ccc(-c2ccc(Cl)cc2)o1)c1ccc([O-])cc1 ZINC000254815382 1024989999 /nfs/dbraw/zinc/98/99/99/1024989999.db2.gz RTCNZOWMYIFBHY-UHFFFAOYSA-N -1 3 340.766 4.070 20 0 EIADHM Cc1cc(C)n(-c2ccc(CNc3ccc4c(c3)[N-]C(=S)C4)cc2)n1 ZINC001167799799 1025105775 /nfs/dbraw/zinc/10/57/75/1025105775.db2.gz HICLHMVIAAGXFB-UHFFFAOYSA-N -1 3 348.475 4.397 20 0 EIADHM Cc1csc([C@H](C)/N=C/c2cc(Br)ccc2[O-])n1 ZINC000067734957 1025233314 /nfs/dbraw/zinc/23/33/14/1025233314.db2.gz CUQIIHWECDFEFQ-JBZZFUPASA-N -1 3 325.231 4.100 20 0 EIADHM CCc1cc(=O)[n-]c(CN[C@@H](CC2CCCC2)c2ccccc2)n1 ZINC000342227472 1025502995 /nfs/dbraw/zinc/50/29/95/1025502995.db2.gz RCRFEVSVBMXLQA-SFHVURJKSA-N -1 3 325.456 4.156 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2ccc(C(F)(F)F)cc2)c(C)c1 ZINC000014225368 1025781936 /nfs/dbraw/zinc/78/19/36/1025781936.db2.gz HZSCOHMBUDRHKB-UHFFFAOYSA-N -1 3 329.343 4.123 20 0 EIADHM CC[C@H](c1ccc(Cl)cc1)N1CC[C@@](C(=O)[O-])(C(F)(F)F)C1 ZINC000315815579 1025784920 /nfs/dbraw/zinc/78/49/20/1025784920.db2.gz DZWILUMNJSBZOX-TZMCWYRMSA-N -1 3 335.753 4.130 20 0 EIADHM CCCc1ccc(S(=O)(=O)[N-]c2cc(Cl)ccc2F)cc1 ZINC000007403695 1025847910 /nfs/dbraw/zinc/84/79/10/1025847910.db2.gz ULKDNJTYEOVYNM-UHFFFAOYSA-N -1 3 327.808 4.232 20 0 EIADHM CC[C@@H]1CN(Cc2cc(=O)[n-]c(-c3ccccc3)n2)c2ccccc2O1 ZINC001167513931 1025871538 /nfs/dbraw/zinc/87/15/38/1025871538.db2.gz ZXNNPAHOBQOHNV-QGZVFWFLSA-N -1 3 347.418 4.027 20 0 EIADHM CCC(CC)c1nnc(NC(=O)c2cc([O-])ccc2Cl)s1 ZINC000277416659 1025928501 /nfs/dbraw/zinc/92/85/01/1025928501.db2.gz MAVONJYSZAWJOV-UHFFFAOYSA-N -1 3 325.821 4.053 20 0 EIADHM Cc1c(Cl)cccc1S(=O)(=O)[N-]c1cccc(Cl)c1F ZINC000048653621 1026029067 /nfs/dbraw/zinc/02/90/67/1026029067.db2.gz FUTPYESJGCUPIZ-UHFFFAOYSA-N -1 3 334.199 4.242 20 0 EIADHM O=C(CCCOCCc1ccccc1)Nc1cc(Cl)ccc1[O-] ZINC000111210655 1026099291 /nfs/dbraw/zinc/09/92/91/1026099291.db2.gz RBMLEDPQFIRNBH-UHFFFAOYSA-N -1 3 333.815 4.024 20 0 EIADHM Cc1c(-c2ccccc2)sc2[n-]c(-c3cscn3)nc(=O)c12 ZINC000432497394 1026190260 /nfs/dbraw/zinc/19/02/60/1026190260.db2.gz ZXZPKCYYKDXAKE-UHFFFAOYSA-N -1 3 325.418 4.496 20 0 EIADHM CCc1cc2c([n-]c([C@H]3CSc4ccccc4O3)nc2=O)s1 ZINC000279269307 1026250385 /nfs/dbraw/zinc/25/03/85/1026250385.db2.gz NEOXCRADACVZCY-GFCCVEGCSA-N -1 3 330.434 4.185 20 0 EIADHM C[C@@H](c1ncc(-c2ccc(Cl)cc2)o1)N1CCC[C@](C)(C(=O)[O-])C1 ZINC000563277257 1026312720 /nfs/dbraw/zinc/31/27/20/1026312720.db2.gz NMKYEBYKMSHFBU-SGTLLEGYSA-N -1 3 348.830 4.243 20 0 EIADHM CCSc1nnc([N-]C(=O)c2ccc(-c3ccc(F)cc3)o2)s1 ZINC000021280635 1026320720 /nfs/dbraw/zinc/32/07/20/1026320720.db2.gz JLDIEJHKGWTLOJ-UHFFFAOYSA-N -1 3 349.412 4.302 20 0 EIADHM O=C([O-])c1cccc(CN2CCC[C@@H]2Cc2cccc(F)c2)c1Cl ZINC000563278358 1026320767 /nfs/dbraw/zinc/32/07/67/1026320767.db2.gz ITBOVZVDJIGBCM-MRXNPFEDSA-N -1 3 347.817 4.384 20 0 EIADHM Cc1ccc(-c2ccc(C)c(NC(=O)c3cc(=O)[n-]c(C4CC4)n3)c2)o1 ZINC000582251258 1026377553 /nfs/dbraw/zinc/37/75/53/1026377553.db2.gz PGIBYYLURKTVNY-UHFFFAOYSA-N -1 3 349.390 4.189 20 0 EIADHM Cc1cc(C(F)(F)F)ccc1CN[C@@H](CC(=O)[O-])c1ccsc1 ZINC000426683066 1026471933 /nfs/dbraw/zinc/47/19/33/1026471933.db2.gz OKEJQVPKHYLUSA-AWEZNQCLSA-N -1 3 343.370 4.381 20 0 EIADHM Cc1ccc([C@H](NCc2ccc(F)c(C(F)(F)F)c2)C(=O)[O-])cc1 ZINC000426698733 1026484717 /nfs/dbraw/zinc/48/47/17/1026484717.db2.gz AZMGYKDFKJZORQ-HNNXBMFYSA-N -1 3 341.304 4.068 20 0 EIADHM CC(C)COc1cccc(CN[C@@H](CC(=O)[O-])c2ccsc2)c1 ZINC000426691081 1026490953 /nfs/dbraw/zinc/49/09/53/1026490953.db2.gz GCZKEPHQRQSEPU-KRWDZBQOSA-N -1 3 333.453 4.089 20 0 EIADHM CCSc1cccc(CN[C@H](C(=O)[O-])c2cccc(Cl)c2)c1 ZINC000426737082 1026519266 /nfs/dbraw/zinc/51/92/66/1026519266.db2.gz LSSLPPBMUFZNBO-INIZCTEOSA-N -1 3 335.856 4.368 20 0 EIADHM CC(C)Oc1cccc(CN[C@H](C(=O)[O-])c2cccc(Cl)c2)c1 ZINC000426749410 1026534986 /nfs/dbraw/zinc/53/49/86/1026534986.db2.gz FTCWLDXBDYSXCW-KRWDZBQOSA-N -1 3 333.815 4.043 20 0 EIADHM O=C([O-])C[C@H](NCc1ccc2ncccc2c1)c1cccc(Cl)c1 ZINC000426803757 1026570895 /nfs/dbraw/zinc/57/08/95/1026570895.db2.gz PBMSUCNZHIQREQ-SFHVURJKSA-N -1 3 340.810 4.194 20 0 EIADHM CCOc1ccc([N-]S(=O)(=O)c2ccc(C)c(Cl)c2)c(C)c1 ZINC000511129525 1026663765 /nfs/dbraw/zinc/66/37/65/1026663765.db2.gz HSNCGKQQTQUVRU-UHFFFAOYSA-N -1 3 339.844 4.156 20 0 EIADHM Cc1ccccc1[C@H](CC(C)C)NC(=O)c1c[n-]c2ccccc2c1=O ZINC000112324120 1026670793 /nfs/dbraw/zinc/67/07/93/1026670793.db2.gz IJBZJYSBQJHCLC-FQEVSTJZSA-N -1 3 348.446 4.354 20 0 EIADHM CC(C)n1cc(NC(=O)c2cc(Oc3ccccc3)ccc2[O-])cn1 ZINC000582516574 1026742719 /nfs/dbraw/zinc/74/27/19/1026742719.db2.gz INORQMMLNZHAIM-UHFFFAOYSA-N -1 3 337.379 4.214 20 0 EIADHM O=c1ccnc(C(=Cc2ccc(Cl)cc2F)Cc2ccccc2)[n-]1 ZINC000432691941 1026768029 /nfs/dbraw/zinc/76/80/29/1026768029.db2.gz AEKONXINCMFPLF-PTNGSMBKSA-N -1 3 340.785 4.346 20 0 EIADHM Cc1oc(C(C)C)nc1C(=O)[N-]c1nnc(CC2CCCCC2)s1 ZINC000511171590 1026839470 /nfs/dbraw/zinc/83/94/70/1026839470.db2.gz BDARBFRWXWNHKG-UHFFFAOYSA-N -1 3 348.472 4.333 20 0 EIADHM C/C(=C\c1ccccc1)CN(C)C(=O)CCCc1ccc([O-])c(F)c1 ZINC000427530758 1026883900 /nfs/dbraw/zinc/88/39/00/1026883900.db2.gz LDDMNOCUVUZCSC-DTQAZKPQSA-N -1 3 341.426 4.416 20 0 EIADHM Cc1ccc(Br)c(C)c1C(=O)Nc1cc(F)ccc1[O-] ZINC000519839763 1027012402 /nfs/dbraw/zinc/01/24/02/1027012402.db2.gz KXOMCVKKNGWNEK-UHFFFAOYSA-N -1 3 338.176 4.163 20 0 EIADHM Cc1ccc(-c2csc3[n-]c(COC(C)C)nc(=O)c23)c(C)c1 ZINC000075078693 1027025496 /nfs/dbraw/zinc/02/54/96/1027025496.db2.gz QOIXQIFYIOYRSI-UHFFFAOYSA-N -1 3 328.437 4.193 20 0 EIADHM O=C(Nc1ccc([O-])c(C(F)(F)F)c1)c1ccc2ccccc2n1 ZINC000440990142 1027173721 /nfs/dbraw/zinc/17/37/21/1027173721.db2.gz VKSLMOOFPHCRDJ-UHFFFAOYSA-N -1 3 332.281 4.212 20 0 EIADHM CSc1ccccc1S(=O)(=O)[N-]c1ccc(Cl)cc1F ZINC000188254868 1027225187 /nfs/dbraw/zinc/22/51/87/1027225187.db2.gz RDAAIJSPHGELCI-UHFFFAOYSA-N -1 3 331.821 4.002 20 0 EIADHM Cc1noc(C)c1[C@@H](C)CC(=O)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000152285214 1027555276 /nfs/dbraw/zinc/55/52/76/1027555276.db2.gz UPZXWJRPPHKKND-QMMMGPOBSA-N -1 3 342.317 4.148 20 0 EIADHM Cc1noc(C)c1[C@H](C)CC(=O)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000152285302 1027555513 /nfs/dbraw/zinc/55/55/13/1027555513.db2.gz UPZXWJRPPHKKND-MRVPVSSYSA-N -1 3 342.317 4.148 20 0 EIADHM CCn1c2ccc(C(=O)[O-])cc2nc1CN1CCC[C@H]1CCC(C)C ZINC000514609828 1027579184 /nfs/dbraw/zinc/57/91/84/1027579184.db2.gz MUAAMQYDMOTDIL-INIZCTEOSA-N -1 3 343.471 4.155 20 0 EIADHM CC[C@H](Cc1ccc(Cl)cc1)NC(=O)c1cc([O-])ccc1Cl ZINC000582920517 1027689763 /nfs/dbraw/zinc/68/97/63/1027689763.db2.gz UBIBPLNPLOYGFV-CYBMUJFWSA-N -1 3 338.234 4.450 20 0 EIADHM C[C@H](CC(C)(C)C)NC(=O)c1c[n-]c(=NC(=O)OC(C)(C)C)s1 ZINC001141904546 1027741507 /nfs/dbraw/zinc/74/15/07/1027741507.db2.gz UVRGXJBSWAUQIW-SNVBAGLBSA-N -1 3 341.477 4.045 20 0 EIADHM CSCc1c2ccccc2oc1C(=O)NCc1ccc([O-])c(F)c1 ZINC000610011620 1027800421 /nfs/dbraw/zinc/80/04/21/1027800421.db2.gz HOHGUQYYHXGZPZ-UHFFFAOYSA-N -1 3 345.395 4.071 20 0 EIADHM CC(=O)Nc1ccc([O-])c(C(=O)N(C)C2CCC(C(C)(C)C)CC2)c1 ZINC000330461870 1027854337 /nfs/dbraw/zinc/85/43/37/1027854337.db2.gz SEELIPVZNAYDBY-UHFFFAOYSA-N -1 3 346.471 4.028 20 0 EIADHM CC(C)c1ncc(C(=O)[N-]c2nnc(/C=C/c3ccco3)s2)s1 ZINC000152431584 1027958351 /nfs/dbraw/zinc/95/83/51/1027958351.db2.gz WNEFKEYVGIBMJK-AATRIKPKSA-N -1 3 346.437 4.134 20 0 EIADHM Cc1ccc(C(C)C)c(OCCC(=O)NCc2ccc([O-])c(F)c2)c1 ZINC000443863891 1028001186 /nfs/dbraw/zinc/00/11/86/1028001186.db2.gz BNIQJXGJPNQZJX-UHFFFAOYSA-N -1 3 345.414 4.048 20 0 EIADHM O=C(N[C@H]1CC[C@@H](c2ccccc2F)C1)c1cc([O-])ccc1Cl ZINC000511235794 1028308869 /nfs/dbraw/zinc/30/88/69/1028308869.db2.gz PFDBAUNEKPDPMJ-NEPJUHHUSA-N -1 3 333.790 4.251 20 0 EIADHM Cc1ccc(NC(=O)c2c[n-]c3c(C)cc(F)cc3c2=O)cc1Cl ZINC000155145511 1028358798 /nfs/dbraw/zinc/35/87/98/1028358798.db2.gz BPDNNVZQYSSIBY-UHFFFAOYSA-N -1 3 344.773 4.190 20 0 EIADHM Cc1ccc(C)c([C@H](C)N(C)Cc2nc(=O)c3sccc3[n-]2)c1 ZINC000346323570 1028370750 /nfs/dbraw/zinc/37/07/50/1028370750.db2.gz PEMPKUKEROMCQJ-ZDUSSCGKSA-N -1 3 327.453 4.207 20 0 EIADHM Cc1cc(C)c([N-]S(=O)(=O)c2ccc(F)c(Cl)c2)c(C)c1 ZINC000016101161 1028472561 /nfs/dbraw/zinc/47/25/61/1028472561.db2.gz NATDRCRCVOUZAH-UHFFFAOYSA-N -1 3 327.808 4.205 20 0 EIADHM CCOC(=O)c1cc(Nc2cc(F)c([O-])c(F)c2)ccc1Cl ZINC001213384295 1028728268 /nfs/dbraw/zinc/72/82/68/1028728268.db2.gz DHUOOHCBIDCSBE-UHFFFAOYSA-N -1 3 327.714 4.244 20 0 EIADHM CC(C)CN(C(=O)c1cc(=O)[n-]c(C2CC2)n1)c1ccc(Cl)cc1 ZINC000583508531 1028826364 /nfs/dbraw/zinc/82/63/64/1028826364.db2.gz MZWBSZDHWAWHHB-UHFFFAOYSA-N -1 3 345.830 4.016 20 0 EIADHM COc1cccc(-c2nc(C(C)(C)c3ccccc3Cl)no2)c1[O-] ZINC000445684448 1028841895 /nfs/dbraw/zinc/84/18/95/1028841895.db2.gz WGBARMBAGNZNTO-UHFFFAOYSA-N -1 3 344.798 4.430 20 0 EIADHM CC(C)N(Cc1csc(-c2cccc(C(=O)[O-])c2)n1)C1CCC1 ZINC000583570433 1028884052 /nfs/dbraw/zinc/88/40/52/1028884052.db2.gz QONZFVWMFWYCIW-UHFFFAOYSA-N -1 3 330.453 4.271 20 0 EIADHM CCCN(C(=O)c1cc([O-])ccc1Cl)[C@H]1CCCc2cccnc21 ZINC000347151742 1028890387 /nfs/dbraw/zinc/89/03/87/1028890387.db2.gz GETQWVUXANFWOM-KRWDZBQOSA-N -1 3 344.842 4.370 20 0 EIADHM CCCOc1ccc(CN[C@H](CC(=O)[O-])c2cccc(Cl)c2)cc1 ZINC000583788840 1029176659 /nfs/dbraw/zinc/17/66/59/1029176659.db2.gz RVZLJDCGRKUPMZ-GOSISDBHSA-N -1 3 347.842 4.434 20 0 EIADHM CCC1(CC)[C@H](OC)C[C@@H]1N(C)Cc1cccc(C(=O)[O-])c1Cl ZINC000583877690 1029312578 /nfs/dbraw/zinc/31/25/78/1029312578.db2.gz VHBVXGZHTDHYCV-LSDHHAIUSA-N -1 3 339.863 4.064 20 0 EIADHM CCC1(CC)[C@@H](OC)C[C@@H]1N(C)Cc1cccc(C(=O)[O-])c1Cl ZINC000583877688 1029314088 /nfs/dbraw/zinc/31/40/88/1029314088.db2.gz VHBVXGZHTDHYCV-GJZGRUSLSA-N -1 3 339.863 4.064 20 0 EIADHM CC(C)(C)OC(=O)CCc1cccc(NCc2cc([O-])cc(F)c2)c1 ZINC000475292573 1029504439 /nfs/dbraw/zinc/50/44/39/1029504439.db2.gz TVESDPKLTKEXMZ-UHFFFAOYSA-N -1 3 345.414 4.418 20 0 EIADHM O=C([O-])c1ccc(CN2CCC(c3ccccc3)CC2)cc1Cl ZINC000565102379 1029593875 /nfs/dbraw/zinc/59/38/75/1029593875.db2.gz FIMSTTYUSPFPAW-UHFFFAOYSA-N -1 3 329.827 4.418 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@H]3C[C@@H]3C3CCCCC3)nc2)n1 ZINC000301377127 1029719587 /nfs/dbraw/zinc/71/95/87/1029719587.db2.gz XZKZORNCRAPYBP-SJORKVTESA-N -1 3 338.455 4.187 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@@H]3C[C@H]3C3CCCCC3)nc2)n1 ZINC000301377124 1029720046 /nfs/dbraw/zinc/72/00/46/1029720046.db2.gz XZKZORNCRAPYBP-DLBZAZTESA-N -1 3 338.455 4.187 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@H]3CCCCC3(C)C)nc2)n1 ZINC000301615022 1029772379 /nfs/dbraw/zinc/77/23/79/1029772379.db2.gz IQDYDCRKPXOVPW-HNNXBMFYSA-N -1 3 326.444 4.187 20 0 EIADHM CC(C)Oc1ccc(S(=O)(=O)[N-]c2ccccc2C(C)C)cc1 ZINC000096659306 1030018477 /nfs/dbraw/zinc/01/84/77/1030018477.db2.gz DTTZXKGCFKCBPX-UHFFFAOYSA-N -1 3 333.453 4.398 20 0 EIADHM C[C@H](Cc1cncc2ccccc21)C(=O)Nc1cc(Cl)ccc1[O-] ZINC000487530018 1030087826 /nfs/dbraw/zinc/08/78/26/1030087826.db2.gz BMCIZNQIJQYWJW-GFCCVEGCSA-N -1 3 340.810 4.411 20 0 EIADHM CC(C)CCn1ncc(NC(=O)Cc2ccc([O-])c(F)c2)c1C(C)C ZINC000451168876 1030296782 /nfs/dbraw/zinc/29/67/82/1030296782.db2.gz KNAYEVSHRFPCFY-UHFFFAOYSA-N -1 3 347.434 4.079 20 0 EIADHM COc1cc(NC(=O)CCCc2ccc([O-])c(F)c2)ccc1Cl ZINC000447712968 1030303054 /nfs/dbraw/zinc/30/30/54/1030303054.db2.gz FOWFZHWDYRDTGS-UHFFFAOYSA-N -1 3 337.778 4.155 20 0 EIADHM COc1ccc(C(=O)N(C)[C@@H](c2ccc(F)cc2)C(C)C)c([O-])c1 ZINC000447859974 1030384678 /nfs/dbraw/zinc/38/46/78/1030384678.db2.gz BDAGVEKTUYLWIH-GOSISDBHSA-N -1 3 331.387 4.009 20 0 EIADHM CCCN(Cc1ccc(OC)cc1)C(=O)c1cc([O-])ccc1Cl ZINC000685598808 1030554743 /nfs/dbraw/zinc/55/47/43/1030554743.db2.gz KZLXXROENAUIKN-UHFFFAOYSA-N -1 3 333.815 4.107 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)NCc1cc2c(s1)CCCC2 ZINC000527294011 1030616143 /nfs/dbraw/zinc/61/61/43/1030616143.db2.gz HRQPMTKMTJKVRW-UHFFFAOYSA-N -1 3 347.455 4.111 20 0 EIADHM Cc1cccc([N-]S(=O)(=O)c2cc(C)c(F)cc2F)c1Cl ZINC000530763332 1030696119 /nfs/dbraw/zinc/69/61/19/1030696119.db2.gz DNZGCOYQXVKJPL-UHFFFAOYSA-N -1 3 331.771 4.036 20 0 EIADHM O=C(Nc1cc(-c2cccc(Cl)c2)[nH]n1)c1cc([O-])ccc1Cl ZINC000685675735 1030699334 /nfs/dbraw/zinc/69/93/34/1030699334.db2.gz KWLXNOPRVFSULB-UHFFFAOYSA-N -1 3 348.189 4.341 20 0 EIADHM Cc1cscc1-c1noc(C(=O)[N-]c2ccc(Cl)c(F)c2)n1 ZINC000685688673 1030733481 /nfs/dbraw/zinc/73/34/81/1030733481.db2.gz ACBMRBWMMDJWIU-UHFFFAOYSA-N -1 3 337.763 4.151 20 0 EIADHM O=C(Nc1cc(F)ccc1[O-])c1ccc(-n2cnc3ccccc32)cc1 ZINC000531373386 1031161150 /nfs/dbraw/zinc/16/11/50/1031161150.db2.gz WHENDHRJDWWNJL-UHFFFAOYSA-N -1 3 347.349 4.123 20 0 EIADHM C[C@H]1CC[C@@H](c2noc(-c3cc(Cc4ccccc4)ccc3[O-])n2)O1 ZINC000528234501 1031281418 /nfs/dbraw/zinc/28/14/18/1031281418.db2.gz KQXZRTJFRUADCG-UGSOOPFHSA-N -1 3 336.391 4.273 20 0 EIADHM CC(C)c1nc(C(=O)[N-]c2nc(-c3ccsc3)ns2)cs1 ZINC000109112068 1031295713 /nfs/dbraw/zinc/29/57/13/1031295713.db2.gz PRRSYHXKPACZPC-UHFFFAOYSA-N -1 3 336.467 4.099 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1cnc(Cc2ccccc2)s1 ZINC000531518356 1031329116 /nfs/dbraw/zinc/32/91/16/1031329116.db2.gz JRWBTOMXVWNCDR-UHFFFAOYSA-N -1 3 344.823 4.345 20 0 EIADHM CCCc1cc(=O)[n-]c(C(=Cc2ncc(CSC)s2)CC)n1 ZINC000453021568 1031499260 /nfs/dbraw/zinc/49/92/60/1031499260.db2.gz FTEWQPVMFRTHKE-XFFZJAGNSA-N -1 3 335.498 4.405 20 0 EIADHM CC(C)(C)Oc1cccc(CCC(=O)Nc2cc(Cl)ccc2[O-])n1 ZINC000531833127 1031681091 /nfs/dbraw/zinc/68/10/91/1031681091.db2.gz IMQMLXMJUVRLRG-UHFFFAOYSA-N -1 3 348.830 4.189 20 0 EIADHM CC(C)(C)c1cnc(SCc2noc(-c3ccccc3[O-])n2)o1 ZINC000130316623 1031833347 /nfs/dbraw/zinc/83/33/47/1031833347.db2.gz SLDQNBNHMLCNBS-UHFFFAOYSA-N -1 3 331.397 4.020 20 0 EIADHM Cc1ccc([C@@H](NCc2cc(=O)[n-]c(C3CC3)n2)c2ccccc2)cc1 ZINC000459355636 1031891511 /nfs/dbraw/zinc/89/15/11/1031891511.db2.gz XCRSAOSPMWRDGR-NRFANRHFSA-N -1 3 345.446 4.247 20 0 EIADHM [O-]c1cccc(CN(CCCO)[C@H]2CCCc3ccccc32)c1Cl ZINC000508821601 1034293749 /nfs/dbraw/zinc/29/37/49/1034293749.db2.gz HJMMHJDREGLALB-SFHVURJKSA-N -1 3 345.870 4.308 20 0 EIADHM Cc1c(Cl)cc(F)c([N-]C(=O)c2noc3c2C[C@H](C)CC3)c1F ZINC000433858244 1034968868 /nfs/dbraw/zinc/96/88/68/1034968868.db2.gz IUSVIKHJRAFOQN-SSDOTTSWSA-N -1 3 340.757 4.292 20 0 EIADHM O=C(Nc1cc(C(F)(F)F)ccc1O)c1cc([O-])ccc1Cl ZINC000490678349 1035597864 /nfs/dbraw/zinc/59/78/64/1035597864.db2.gz WFIIEHPAZGUTRA-UHFFFAOYSA-N -1 3 331.677 4.022 20 0 EIADHM O=C([O-])c1ccc(CN[C@@H](c2ccc(Cl)cc2)C2CCC2)nc1 ZINC000905724506 1035875065 /nfs/dbraw/zinc/87/50/65/1035875065.db2.gz KXPBZSZCWYBPRL-QGZVFWFLSA-N -1 3 330.815 4.064 20 0 EIADHM O=C(c1ccccc1[O-])N1CCC[C@@H]1c1cccc(Br)c1 ZINC000195703494 1035883529 /nfs/dbraw/zinc/88/35/29/1035883529.db2.gz XOYORUXJRJGJPH-OAHLLOKOSA-N -1 3 346.224 4.132 20 0 EIADHM C[C@H]1C[C@@H]1c1ccc(CNCCc2cc3ccc(C(=O)[O-])cc3o2)o1 ZINC000905804006 1035897968 /nfs/dbraw/zinc/89/79/68/1035897968.db2.gz OZTGEQAJBJZFIW-SJCJKPOMSA-N -1 3 339.391 4.180 20 0 EIADHM COc1cccc(C(=O)CCCC(=O)Nc2cc(Cl)ccc2[O-])c1 ZINC000485506134 1035965720 /nfs/dbraw/zinc/96/57/20/1035965720.db2.gz QHZROMZPKZHTID-UHFFFAOYSA-N -1 3 347.798 4.046 20 0 EIADHM O=C(CO[C@H]1CCCc2ccccc21)Nc1c([O-])cccc1Cl ZINC000571699432 1036133379 /nfs/dbraw/zinc/13/33/79/1036133379.db2.gz DSTJURHDCAVVGA-INIZCTEOSA-N -1 3 331.799 4.078 20 0 EIADHM O=S(=O)([N-]c1ccccc1F)c1ccccc1-c1ccccc1 ZINC000485798738 1036280521 /nfs/dbraw/zinc/28/05/21/1036280521.db2.gz GNAQTIDTSGWYIT-UHFFFAOYSA-N -1 3 327.380 4.294 20 0 EIADHM O=c1cc(C=Cc2ccc(Cl)cc2Cl)nc(-c2ccncc2)[n-]1 ZINC000486003413 1036417498 /nfs/dbraw/zinc/41/74/98/1036417498.db2.gz SAOBWFYIKONUHW-DUXPYHPUSA-N -1 3 344.201 4.309 20 0 EIADHM O=C(Nc1ccccc1)c1cccc(COC(=O)c2ccc([O-])cc2)c1 ZINC000060786982 1036454653 /nfs/dbraw/zinc/45/46/53/1036454653.db2.gz MPOMDEGNHHTCEX-UHFFFAOYSA-N -1 3 347.370 4.002 20 0 EIADHM Cc1nc(C(C)C)ccc1C(=O)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000486096674 1036481385 /nfs/dbraw/zinc/48/13/85/1036481385.db2.gz OFKIPILLZILJAA-UHFFFAOYSA-N -1 3 338.329 4.490 20 0 EIADHM O=c1cc(C=Cc2cc(Cl)cc(Cl)c2)nc(-c2ccncc2)[n-]1 ZINC000486106151 1036488218 /nfs/dbraw/zinc/48/82/18/1036488218.db2.gz YOMJKXNSQDKOMS-UPHRSURJSA-N -1 3 344.201 4.309 20 0 EIADHM O=C(Nc1cc(Br)ccc1[O-])c1c[nH]c2cccc(F)c21 ZINC000156925774 1036500455 /nfs/dbraw/zinc/50/04/55/1036500455.db2.gz HTZGYHAVBTVTIG-UHFFFAOYSA-N -1 3 349.159 4.027 20 0 EIADHM CO[C@@H](C)c1cccc([N-]S(=O)(=O)c2c(C)cc(C)cc2C)c1 ZINC000588833389 1036563612 /nfs/dbraw/zinc/56/36/12/1036563612.db2.gz LSUZPZVSGRFRED-HNNXBMFYSA-N -1 3 333.453 4.120 20 0 EIADHM CSCC1CCC(NC(=O)c2cc([O-])cc(C(F)(F)F)c2)CC1 ZINC000598738868 1036767627 /nfs/dbraw/zinc/76/76/27/1036767627.db2.gz XXBBEOWHZIWQHP-UHFFFAOYSA-N -1 3 347.402 4.063 20 0 EIADHM CC(C)(C)c1ccc(-c2nc([N-]C(=O)c3ccc(Cl)o3)n[nH]2)cc1 ZINC000603562093 1036890257 /nfs/dbraw/zinc/89/02/57/1036890257.db2.gz RGEYNMQLVKZQIU-UHFFFAOYSA-N -1 3 344.802 4.268 20 0 EIADHM CCc1ccc([C@H](NC(=O)c2cc(=O)c3ccccc3[n-]2)C(C)C)cc1 ZINC000503088022 1036897429 /nfs/dbraw/zinc/89/74/29/1036897429.db2.gz RKQIIFIBZCJBLH-OAQYLSRUSA-N -1 3 348.446 4.218 20 0 EIADHM COc1ccc(NC(=O)c2cc([O-])ccc2Cl)c(C(F)(F)F)c1 ZINC000503122020 1036919280 /nfs/dbraw/zinc/91/92/80/1036919280.db2.gz YDPYARHZHWKVAA-UHFFFAOYSA-N -1 3 345.704 4.325 20 0 EIADHM CSc1ccc([O-])c(C(=O)N2CCSC[C@H]2c2ccccc2)c1 ZINC000668812263 1037309717 /nfs/dbraw/zinc/30/97/17/1037309717.db2.gz KBJLNKXUEOCLNV-INIZCTEOSA-N -1 3 345.489 4.044 20 0 EIADHM O=C([N-]c1c(F)cccc1F)c1cnc(-c2ccccc2F)s1 ZINC000067296284 1037365100 /nfs/dbraw/zinc/36/51/00/1037365100.db2.gz RNWCLKBIIHSSIL-UHFFFAOYSA-N -1 3 334.322 4.480 20 0 EIADHM CC1(c2ccccc2)CCN(C(=O)c2cc([O-])ccc2Cl)CC1 ZINC000488373269 1037552342 /nfs/dbraw/zinc/55/23/42/1037552342.db2.gz BWNVSFVITIXYSD-UHFFFAOYSA-N -1 3 329.827 4.240 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2ccc3nn(C(C)C)cc3c2)c(C)c1 ZINC000605615200 1037842507 /nfs/dbraw/zinc/84/25/07/1037842507.db2.gz SIXJMBFMJQRWOO-UHFFFAOYSA-N -1 3 343.452 4.035 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1ccc(N2CCCC2)c(F)c1 ZINC000592854525 1037875422 /nfs/dbraw/zinc/87/54/22/1037875422.db2.gz SIIVJFQOSNGAOX-UHFFFAOYSA-N -1 3 334.778 4.037 20 0 EIADHM CC(C)C[C@H](NC(=O)NCc1ccc([O-])c(F)c1)c1cccs1 ZINC000606649575 1038207014 /nfs/dbraw/zinc/20/70/14/1038207014.db2.gz BAIPYYLJEVTQAX-AWEZNQCLSA-N -1 3 336.432 4.179 20 0 EIADHM CCCN(C(=O)NCc1ccc([O-])c(F)c1)[C@@H]1CCc2ccccc21 ZINC000606720315 1038229714 /nfs/dbraw/zinc/22/97/14/1038229714.db2.gz QHYRKFXDBXUXJY-GOSISDBHSA-N -1 3 342.414 4.140 20 0 EIADHM Cc1cc([C@H](C)N2CC[C@H](c3c(F)cccc3F)C2)oc1C(=O)[O-] ZINC000574524880 1038290384 /nfs/dbraw/zinc/29/03/84/1038290384.db2.gz KDLIARKEFABJAP-RYUDHWBXSA-N -1 3 335.350 4.115 20 0 EIADHM C[C@H](CS(=O)(=O)[N-]c1ccccc1C(F)F)c1ccccc1 ZINC000424069427 1038467920 /nfs/dbraw/zinc/46/79/20/1038467920.db2.gz PQARCUQTIVXWFC-GFCCVEGCSA-N -1 3 325.380 4.170 20 0 EIADHM CC[C@@H](c1ccncc1)N(CC)C(=O)c1cc(SC)ccc1[O-] ZINC000669052217 1038470098 /nfs/dbraw/zinc/47/00/98/1038470098.db2.gz BQYOZFOWORMJKS-INIZCTEOSA-N -1 3 330.453 4.123 20 0 EIADHM CC[C@@H](c1ccccc1)S(=O)(=O)c1nc(C)c(-c2ccccc2)[n-]1 ZINC000490438994 1038637490 /nfs/dbraw/zinc/63/74/90/1038637490.db2.gz AHZUMXXPWHDAEO-KRWDZBQOSA-N -1 3 340.448 4.310 20 0 EIADHM CC[C@@H](c1ccccc1)S(=O)(=O)c1nc(-c2ccccc2)c(C)[n-]1 ZINC000490438994 1038637718 /nfs/dbraw/zinc/63/77/18/1038637718.db2.gz AHZUMXXPWHDAEO-KRWDZBQOSA-N -1 3 340.448 4.310 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1cccc(-c2cscn2)c1 ZINC000608354501 1038801235 /nfs/dbraw/zinc/80/12/35/1038801235.db2.gz IAAFVFVZSNHXPZ-UHFFFAOYSA-N -1 3 330.796 4.421 20 0 EIADHM CC(C)Oc1ccc([N-]S(=O)(=O)c2cccc(C(C)C)c2)cc1 ZINC000460452165 1038884127 /nfs/dbraw/zinc/88/41/27/1038884127.db2.gz WEZAXAUCHJRDPN-UHFFFAOYSA-N -1 3 333.453 4.398 20 0 EIADHM CCc1cc(=O)[n-]c(CN[C@H](CC(C)C)c2ccc(Cl)cc2)n1 ZINC000539295384 1038943445 /nfs/dbraw/zinc/94/34/45/1038943445.db2.gz LIYHPVYKKXOAER-MRXNPFEDSA-N -1 3 333.863 4.275 20 0 EIADHM CC(=O)c1cccc(NC(=O)[C@H]2C[C@@H]2c2cccc3ccccc32)c1[O-] ZINC000552069842 1039092882 /nfs/dbraw/zinc/09/28/82/1039092882.db2.gz MFZPNVHAMXJGSM-MOPGFXCFSA-N -1 3 345.398 4.490 20 0 EIADHM CC[C@H](C)Oc1ccc(-c2nc3ccc(Cl)cc3c(=O)[n-]2)cc1 ZINC000481201847 1039113421 /nfs/dbraw/zinc/11/34/21/1039113421.db2.gz URTHNFAWTHVALK-NSHDSACASA-N -1 3 328.799 4.421 20 0 EIADHM CC(C)[C@@H](CCc1ccccc1)C(=O)NCc1ccc([O-])c(F)c1 ZINC000481253683 1039185495 /nfs/dbraw/zinc/18/54/95/1039185495.db2.gz FWQUWIVVDHZEMR-QGZVFWFLSA-N -1 3 329.415 4.053 20 0 EIADHM O=C(Nc1ccc(Cl)cc1[O-])c1cccc([C@H]2CCCOC2)c1 ZINC000534307595 1039307261 /nfs/dbraw/zinc/30/72/61/1039307261.db2.gz ONYKCXSIPFZLGM-AWEZNQCLSA-N -1 3 331.799 4.192 20 0 EIADHM CSc1cnn(-c2ccccc2)c1[N-]C(=O)c1ccc(Cl)o1 ZINC000150719216 1039308617 /nfs/dbraw/zinc/30/86/17/1039308617.db2.gz IYTAMCNHEZNNMO-UHFFFAOYSA-N -1 3 333.800 4.093 20 0 EIADHM CC(=O)c1cccc(NC(=O)C[C@@H](C)c2ccc(F)cc2F)c1[O-] ZINC000552286025 1039338976 /nfs/dbraw/zinc/33/89/76/1039338976.db2.gz JCVSXELFRSBWRE-SNVBAGLBSA-N -1 3 333.334 4.005 20 0 EIADHM Cc1cccc(C(=O)Nc2ccc(Br)cc2[O-])c1Cl ZINC000121837496 1039507677 /nfs/dbraw/zinc/50/76/77/1039507677.db2.gz YMKHBPSINKJTCR-UHFFFAOYSA-N -1 3 340.604 4.369 20 0 EIADHM COc1ccc2cccc(CC(=O)Nc3cc(Cl)ccc3[O-])c2c1 ZINC000514068596 1039547170 /nfs/dbraw/zinc/54/71/70/1039547170.db2.gz MGTIPVONFGMZLE-UHFFFAOYSA-N -1 3 341.794 4.389 20 0 EIADHM CC(C)[C@H](CNC(=O)c1cc([O-])ccc1Cl)Cc1ccccc1 ZINC000505428358 1039577490 /nfs/dbraw/zinc/57/74/90/1039577490.db2.gz RCYMXXMRXFSXRB-HNNXBMFYSA-N -1 3 331.843 4.290 20 0 EIADHM Cc1c(NCC(C)(C)C)cccc1C(=O)NCc1ccc([O-])c(F)c1 ZINC000478282713 1039630381 /nfs/dbraw/zinc/63/03/81/1039630381.db2.gz PYVZISDYURQPQM-UHFFFAOYSA-N -1 3 344.430 4.228 20 0 EIADHM CC(C)(C)c1nc2cc(NC(=O)c3cc([O-])ccc3Cl)ccc2[nH]1 ZINC000555844553 1039708500 /nfs/dbraw/zinc/70/85/00/1039708500.db2.gz PDMWGHJGPZLWDW-UHFFFAOYSA-N -1 3 343.814 4.472 20 0 EIADHM O=C([N-]c1cc(Cl)ccn1)c1sc(Cl)nc1C(F)(F)F ZINC001272284227 1039727738 /nfs/dbraw/zinc/72/77/38/1039727738.db2.gz YZQGHWHZWMYKDQ-UHFFFAOYSA-N -1 3 342.129 4.116 20 0 EIADHM CCn1c2cc(F)ccc2nc1-c1cc([O-])cc(Br)c1 ZINC000700868097 1039754367 /nfs/dbraw/zinc/75/43/67/1039754367.db2.gz ZCIFQGBIBWRBDM-UHFFFAOYSA-N -1 3 335.176 4.330 20 0 EIADHM O=C(Nc1c([O-])cccc1Cl)c1csc(Cc2ccccc2)n1 ZINC000552781458 1039818138 /nfs/dbraw/zinc/81/81/38/1039818138.db2.gz GBZBQGNBVHTSPD-UHFFFAOYSA-N -1 3 344.823 4.345 20 0 EIADHM COc1cc(NC(=O)CCCc2ccc([O-])c(F)c2)c(C)cc1C ZINC000478552379 1039824422 /nfs/dbraw/zinc/82/44/22/1039824422.db2.gz HIPWLEVFFZYDMU-UHFFFAOYSA-N -1 3 331.387 4.118 20 0 EIADHM CCOc1cc(CNc2cccc(N(C)C)c2C)cc(Cl)c1[O-] ZINC000550957147 1039838238 /nfs/dbraw/zinc/83/82/38/1039838238.db2.gz JZMBFCONAGKEEG-UHFFFAOYSA-N -1 3 334.847 4.431 20 0 EIADHM Cc1cc(C)c(C(=O)Nc2ccc(Br)cc2[O-])c(C)c1 ZINC000534903191 1039846559 /nfs/dbraw/zinc/84/65/59/1039846559.db2.gz VKNDRCWZHNJXGV-UHFFFAOYSA-N -1 3 334.213 4.332 20 0 EIADHM CC(C)[C@@H]1N(C(=O)CCCc2ccc([O-])c(F)c2)CC12CCCC2 ZINC000457152420 1039855020 /nfs/dbraw/zinc/85/50/20/1039855020.db2.gz XJRHZNXNSXYTJY-IBGZPJMESA-N -1 3 333.447 4.281 20 0 EIADHM CCCCCc1ccc(NC(=O)c2cc(=O)[n-]c(C3CC3)n2)cc1 ZINC000552916585 1039867330 /nfs/dbraw/zinc/86/73/30/1039867330.db2.gz WPTFLNXXISFGFR-UHFFFAOYSA-N -1 3 325.412 4.045 20 0 EIADHM Nc1ccc(Nc2cc(Br)cc(F)c2[O-])cc1Cl ZINC001212121559 1039890698 /nfs/dbraw/zinc/89/06/98/1039890698.db2.gz LWPCEWAIBNXTIG-UHFFFAOYSA-N -1 3 331.572 4.273 20 0 EIADHM CCCc1cc(=O)[n-]c(C(=Cc2ccc(Br)cc2)CC)n1 ZINC000435339935 1040296694 /nfs/dbraw/zinc/29/66/94/1040296694.db2.gz ZDZGTTGBGKVSNL-JLHYYAGUSA-N -1 3 347.256 4.436 20 0 EIADHM CCCc1cc(=O)[n-]c(C(=Cc2ccc(OC(C)C)cc2)CC)n1 ZINC000435341113 1040298169 /nfs/dbraw/zinc/29/81/69/1040298169.db2.gz STSYTZMVWRDKLH-FOWTUZBSSA-N -1 3 326.440 4.460 20 0 EIADHM [O-]c1cccc(CN[C@H]2CCCc3sccc32)c1Br ZINC000315500027 1040352154 /nfs/dbraw/zinc/35/21/54/1040352154.db2.gz GUCTZBSRBBRSAT-LBPRGKRZSA-N -1 3 338.270 4.383 20 0 EIADHM O=c1cc(C(F)(F)F)nc(CNc2cccc3ccsc32)[n-]1 ZINC000537776928 1040829900 /nfs/dbraw/zinc/82/99/00/1040829900.db2.gz RPHQMVCPHCGFMC-UHFFFAOYSA-N -1 3 325.315 4.028 20 0 EIADHM CC[C@H](C)[C@H](C)N(Cc1coc(-c2ccc(C(=O)[O-])cc2)n1)C1CC1 ZINC000567359166 1041243779 /nfs/dbraw/zinc/24/37/79/1041243779.db2.gz MEOSWMYEMVIALV-KBPBESRZSA-N -1 3 342.439 4.439 20 0 EIADHM CCc1ncc(CN[C@H](CC(=O)[O-])c2ccc(C(C)C)cc2)s1 ZINC000904001690 1041247086 /nfs/dbraw/zinc/24/70/86/1041247086.db2.gz DGSANNMLPFYBGT-MRXNPFEDSA-N -1 3 332.469 4.135 20 0 EIADHM Cc1cccc(C(=O)Nc2ccc(F)cc2OCC(F)(F)F)c1[O-] ZINC000436548071 1041325794 /nfs/dbraw/zinc/32/57/94/1041325794.db2.gz LVBXBIUGWUUJKE-UHFFFAOYSA-N -1 3 343.276 4.033 20 0 EIADHM O=C(c1ccccc1[O-])N(Cc1ccc(F)cc1F)C1CCCC1 ZINC000436557669 1041330182 /nfs/dbraw/zinc/33/01/82/1041330182.db2.gz VDKMZWVQJXIVTB-UHFFFAOYSA-N -1 3 331.362 4.255 20 0 EIADHM Cc1nc(C)c(-c2csc(NC(=O)c3ccc(C)cc3[O-])n2)s1 ZINC000436558765 1041340252 /nfs/dbraw/zinc/34/02/52/1041340252.db2.gz YZGKTQLNVDSXIG-UHFFFAOYSA-N -1 3 345.449 4.150 20 0 EIADHM CC(C)c1ccc(C(=O)N(Cc2cc[nH]n2)Cc2ccccc2)c([O-])c1 ZINC000436560159 1041342110 /nfs/dbraw/zinc/34/21/10/1041342110.db2.gz BTEFXDNWVPAOBU-UHFFFAOYSA-N -1 3 349.434 4.081 20 0 EIADHM CCSc1ccc([C@@H](C)NC(=O)c2ccc(OC)cc2[O-])cc1 ZINC000436563575 1041344883 /nfs/dbraw/zinc/34/48/83/1041344883.db2.gz NKQPPEZLVINMLW-GFCCVEGCSA-N -1 3 331.437 4.004 20 0 EIADHM CC(C)c1ccc(C(=O)N2C[C@H](c3ccccc3)OC[C@@H]2C)c([O-])c1 ZINC000436569301 1041349975 /nfs/dbraw/zinc/34/99/75/1041349975.db2.gz CIVOQBGDOYEUQX-MGPUTAFESA-N -1 3 339.435 4.118 20 0 EIADHM Cc1ccc(CN(C)C(=O)c2cc(Cc3ccccc3)ccc2[O-])o1 ZINC000436594805 1041354466 /nfs/dbraw/zinc/35/44/66/1041354466.db2.gz IZANVMGNJYUJEZ-UHFFFAOYSA-N -1 3 335.403 4.157 20 0 EIADHM COc1cccc(C=C2CCN(C(=O)c3ccc(C)cc3[O-])CC2)c1 ZINC000436580697 1041357391 /nfs/dbraw/zinc/35/73/91/1041357391.db2.gz HHYDWKFBEYDWHH-UHFFFAOYSA-N -1 3 337.419 4.029 20 0 EIADHM Cc1ccc(C(=O)N2CCC(=Cc3ccccc3F)CC2)c([O-])c1 ZINC000436588440 1041364113 /nfs/dbraw/zinc/36/41/13/1041364113.db2.gz TVYNEUAYLYNRMV-UHFFFAOYSA-N -1 3 325.383 4.159 20 0 EIADHM CCN(CCOc1ccccc1C)[C@@H](C)c1cc(C)c(C(=O)[O-])o1 ZINC000516091841 1041400489 /nfs/dbraw/zinc/40/04/89/1041400489.db2.gz VMQZRYRJLOXZBR-HNNXBMFYSA-N -1 3 331.412 4.057 20 0 EIADHM O=c1cc(-c2nc(-c3c(Cl)cccc3Cl)no2)nc(C2CC2)[n-]1 ZINC000904306357 1041426813 /nfs/dbraw/zinc/42/68/13/1041426813.db2.gz TWTDXQCBOSBAOB-UHFFFAOYSA-N -1 3 349.177 4.083 20 0 EIADHM CCc1cccc2c(C3CCN(C(=O)c4ccccc4[O-])CC3)c[nH]c21 ZINC000436696104 1041427140 /nfs/dbraw/zinc/42/71/40/1041427140.db2.gz HSOQWUPESLYDCY-UHFFFAOYSA-N -1 3 348.446 4.456 20 0 EIADHM CCOCCOc1ccc(Cl)cc1NC(=O)c1cc(C)ccc1[O-] ZINC000436702244 1041433469 /nfs/dbraw/zinc/43/34/69/1041433469.db2.gz HMOCTKLQOZLXHN-UHFFFAOYSA-N -1 3 349.814 4.022 20 0 EIADHM CC[C@@H](C)Oc1ccc(-c2nc3cc(F)c(F)cc3c(=O)[n-]2)cc1 ZINC000463216193 1041440148 /nfs/dbraw/zinc/44/01/48/1041440148.db2.gz WXXVXLXSWQEINR-SNVBAGLBSA-N -1 3 330.334 4.458 20 0 EIADHM Cc1nc(-c2ccccc2)sc1CNC(=O)c1ccc(C)cc1[O-] ZINC000436750755 1041463413 /nfs/dbraw/zinc/46/34/13/1041463413.db2.gz YIZMRPRGSUGVBL-UHFFFAOYSA-N -1 3 338.432 4.063 20 0 EIADHM CCc1ccc(C(=O)N(CC)[C@H](C)Cc2ccc(OC)cc2)c([O-])c1 ZINC000436820289 1041500403 /nfs/dbraw/zinc/50/04/03/1041500403.db2.gz GHYMWJRAXPQTOU-OAHLLOKOSA-N -1 3 341.451 4.057 20 0 EIADHM CCc1ccc(C(=O)Nc2ccc(Oc3nccc(C)n3)cc2)c([O-])c1 ZINC000436826585 1041503761 /nfs/dbraw/zinc/50/37/61/1041503761.db2.gz ARYAAYTZLSGUMV-UHFFFAOYSA-N -1 3 349.390 4.098 20 0 EIADHM CCc1ccc(-c2nc(Cc3c[nH]c4cccc(C)c34)no2)c([O-])c1 ZINC000436862463 1041521704 /nfs/dbraw/zinc/52/17/04/1041521704.db2.gz HIOPMWPFEMONAJ-UHFFFAOYSA-N -1 3 333.391 4.385 20 0 EIADHM COc1ccc(C(=O)N(Cc2ccccc2Cl)CC2CC2)c([O-])c1 ZINC000436862719 1041522980 /nfs/dbraw/zinc/52/29/80/1041522980.db2.gz GFJMXHWQFSSLNK-UHFFFAOYSA-N -1 3 345.826 4.107 20 0 EIADHM CCc1ccc(-c2nc(CCn3ccc4ccccc43)no2)c([O-])c1 ZINC000436871579 1041530212 /nfs/dbraw/zinc/53/02/12/1041530212.db2.gz QOUJVBWOLJBRMI-UHFFFAOYSA-N -1 3 333.391 4.202 20 0 EIADHM O=C(c1ccc(O)cc1[O-])N1CCC(c2cccc3ccccc32)CC1 ZINC000436887605 1041544400 /nfs/dbraw/zinc/54/44/00/1041544400.db2.gz WZRLRCLADZDEMQ-UHFFFAOYSA-N -1 3 347.414 4.271 20 0 EIADHM Cc1ccc(-c2nc(Cc3noc(-c4ccccc4[O-])n3)cs2)cc1 ZINC000436892194 1041545846 /nfs/dbraw/zinc/54/58/46/1041545846.db2.gz IOAPAZABMFGCDS-UHFFFAOYSA-N -1 3 349.415 4.465 20 0 EIADHM COCc1cccc(-c2noc(-c3cc4ccccc4cc3[O-])n2)c1 ZINC000436906012 1041547059 /nfs/dbraw/zinc/54/70/59/1041547059.db2.gz ABYXBKYRTHUDNW-UHFFFAOYSA-N -1 3 332.359 4.409 20 0 EIADHM Cc1oc([C@@H](C)N2CCC(Cc3ccccc3F)CC2)cc1C(=O)[O-] ZINC000520416438 1041552210 /nfs/dbraw/zinc/55/22/10/1041552210.db2.gz CPSQTGRZKURXLR-CYBMUJFWSA-N -1 3 345.414 4.441 20 0 EIADHM Cc1cc([O-])ccc1-c1nc(=O)c2c3c(sc2[nH]1)CCCCC3 ZINC000436921385 1041557023 /nfs/dbraw/zinc/55/70/23/1041557023.db2.gz JSKOKAVOYRINMG-UHFFFAOYSA-N -1 3 326.421 4.347 20 0 EIADHM Cc1ccc(-c2nc(CCc3ccc(OC(F)F)cc3)no2)c([O-])c1 ZINC000436942249 1041568695 /nfs/dbraw/zinc/56/86/95/1041568695.db2.gz UQYIZTSYYQMSOV-UHFFFAOYSA-N -1 3 346.333 4.137 20 0 EIADHM CC(C)c1ccc(C(=O)N2CC=C(c3ccccc3F)C2)c([O-])c1 ZINC000436959773 1041576555 /nfs/dbraw/zinc/57/65/55/1041576555.db2.gz HTNHTCMSJHJSQV-UHFFFAOYSA-N -1 3 325.383 4.194 20 0 EIADHM [O-]c1cc(F)cc(CN2CCC[C@H]2c2nc3cc(Cl)ccc3[nH]2)c1 ZINC000438254031 1042106109 /nfs/dbraw/zinc/10/61/09/1042106109.db2.gz BKCOXEAMTMKUCA-KRWDZBQOSA-N -1 3 345.805 4.398 20 0 EIADHM CCc1ccc(NCc2nc(C(F)(F)F)cc(=O)[n-]2)cc1Cl ZINC000506202150 1042121261 /nfs/dbraw/zinc/12/12/61/1042121261.db2.gz BHMCOBJHJAWWSY-UHFFFAOYSA-N -1 3 331.725 4.029 20 0 EIADHM CC(=O)c1cccc(NC(=O)C2(c3ccccc3F)CCCC2)c1[O-] ZINC000517908223 1042267495 /nfs/dbraw/zinc/26/74/95/1042267495.db2.gz VLTJHHMVAVCWNN-UHFFFAOYSA-N -1 3 341.382 4.184 20 0 EIADHM Cc1cccc([O-])c1C(=O)N1CCC[C@@H]1c1nc2ccccc2s1 ZINC000623592594 1042275339 /nfs/dbraw/zinc/27/53/39/1042275339.db2.gz TYZCZPUZKWXKGH-CQSZACIVSA-N -1 3 338.432 4.288 20 0 EIADHM CC1(C)CCCC[C@@H]1NCc1coc(-c2ccc(C(=O)[O-])cc2)n1 ZINC000518200641 1042407057 /nfs/dbraw/zinc/40/70/57/1042407057.db2.gz LLPOKSIVHMHEIF-INIZCTEOSA-N -1 3 328.412 4.098 20 0 EIADHM CC(=O)c1ccc(C(=O)N[C@H](C)CC(C)(C)c2ccccc2)cc1[O-] ZINC000439059405 1042478246 /nfs/dbraw/zinc/47/82/46/1042478246.db2.gz NLEROAUIPSUGOW-CQSZACIVSA-N -1 3 339.435 4.081 20 0 EIADHM CCc1ccc([O-])c(C(=O)N2CC[C@@H](c3ccc(Cl)cc3)C2)c1 ZINC000518457690 1042530228 /nfs/dbraw/zinc/53/02/28/1042530228.db2.gz JFWZENBKFZSELX-OAHLLOKOSA-N -1 3 329.827 4.238 20 0 EIADHM COCCCCN(Cc1ccccc1)Cc1cccc([O-])c1Cl ZINC000507789671 1042947004 /nfs/dbraw/zinc/94/70/04/1042947004.db2.gz USMYYVSKFSWLOP-UHFFFAOYSA-N -1 3 333.859 4.474 20 0 EIADHM Cc1cc(=O)[n-]c([C@@H](C)N2CC[C@H](Sc3cccc(Cl)c3)C2)n1 ZINC000429140698 1043078048 /nfs/dbraw/zinc/07/80/48/1043078048.db2.gz ZWECZSGEEWUALB-DOMZBBRYSA-N -1 3 349.887 4.072 20 0 EIADHM Cc1noc(C(F)F)c1C(=O)[N-]c1csc(-c2ccccc2)n1 ZINC000672332392 1043120913 /nfs/dbraw/zinc/12/09/13/1043120913.db2.gz JRTKGCBKYXYISH-UHFFFAOYSA-N -1 3 335.335 4.296 20 0 EIADHM O=C([N-]c1csc(-c2ccccc2)n1)c1cc(-c2ccco2)on1 ZINC000672333721 1043123335 /nfs/dbraw/zinc/12/33/35/1043123335.db2.gz FXYUNJJDWUOYMW-UHFFFAOYSA-N -1 3 337.360 4.310 20 0 EIADHM O=C(CSc1ccc2ccccc2c1)NCc1ccc([O-])c(F)c1 ZINC000132706034 1043187679 /nfs/dbraw/zinc/18/76/79/1043187679.db2.gz OUMYTUWIBNDMMG-UHFFFAOYSA-N -1 3 341.407 4.093 20 0 EIADHM CC(C)OCCOCc1cccc(NCc2cc([O-])cc(F)c2)c1 ZINC000185591334 1043200803 /nfs/dbraw/zinc/20/08/03/1043200803.db2.gz QUULLAXOBIRLRP-UHFFFAOYSA-N -1 3 333.403 4.085 20 0 EIADHM CC(C)OCc1ccccc1CNC(=O)c1cc([O-])c2ccccc2c1 ZINC000525921952 1043235488 /nfs/dbraw/zinc/23/54/88/1043235488.db2.gz TYLGONYCMPCINQ-UHFFFAOYSA-N -1 3 349.430 4.400 20 0 EIADHM COc1cccc(C2=CCN(C(=O)c3cc([O-])c4ccccc4c3)C2)c1 ZINC000525931719 1043236559 /nfs/dbraw/zinc/23/65/59/1043236559.db2.gz PRCQABWJCIGPGR-UHFFFAOYSA-N -1 3 345.398 4.093 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N(C[C@H]1CCCO1)C1CCCC1 ZINC000525935077 1043237309 /nfs/dbraw/zinc/23/73/09/1043237309.db2.gz UDIVSJQLTOZUHR-GOSISDBHSA-N -1 3 339.435 4.109 20 0 EIADHM O=C(N[C@@H]1C[C@@H]1c1c(F)cccc1F)c1cc([O-])c2ccccc2c1 ZINC000526893951 1043244393 /nfs/dbraw/zinc/24/43/93/1043244393.db2.gz NSTPYEGRLQJECL-WMLDXEAASA-N -1 3 339.341 4.110 20 0 EIADHM C[C@@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1cc([O-])c2ccccc2c1 ZINC000526919319 1043245998 /nfs/dbraw/zinc/24/59/98/1043245998.db2.gz MITLKYZLRHXBNO-IAQYHMDHSA-N -1 3 337.341 4.348 20 0 EIADHM COc1ccc([C@H](NC(=O)c2cc([O-])c3ccccc3c2)C2CC2)cc1 ZINC000526910312 1043246469 /nfs/dbraw/zinc/24/64/69/1043246469.db2.gz ZDQAQEWFARWQCG-OAQYLSRUSA-N -1 3 347.414 4.435 20 0 EIADHM Cc1ccc2c(c1)N(C(=O)c1cc([O-])c3ccccc3c1)C[C@@H](C)O2 ZINC000526928191 1043246677 /nfs/dbraw/zinc/24/66/77/1043246677.db2.gz LURIFXSVKZFEKH-CQSZACIVSA-N -1 3 333.387 4.282 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N1CC[C@H](c2ccc(F)cc2)C1 ZINC000527031868 1043249672 /nfs/dbraw/zinc/24/96/72/1043249672.db2.gz DZVKVIXNBJBQLQ-INIZCTEOSA-N -1 3 335.378 4.314 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N1CC[C@H](Cc2ccc(F)cc2)C1 ZINC000527164092 1043250931 /nfs/dbraw/zinc/25/09/31/1043250931.db2.gz XVFAVSKIFVZIQJ-MRXNPFEDSA-N -1 3 349.405 4.389 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)N1CCC[C@H]1c1cccc(Cl)c1 ZINC000163688145 1043258217 /nfs/dbraw/zinc/25/82/17/1043258217.db2.gz APRMBOILLXPZSX-INIZCTEOSA-N -1 3 348.805 4.231 20 0 EIADHM O=C(Nc1ccc(N2CCCCC2)cn1)c1cc([O-])c2ccccc2c1 ZINC000527450789 1043260775 /nfs/dbraw/zinc/26/07/75/1043260775.db2.gz YJNALGMRSVPHJH-UHFFFAOYSA-N -1 3 347.418 4.183 20 0 EIADHM C[C@H]1C[C@@H](CCNC(=O)c2c[n-]c3ccccc3c2=O)CC(C)(C)C1 ZINC001128609583 1043414826 /nfs/dbraw/zinc/41/48/26/1043414826.db2.gz ZSAGKENWMUIUFA-LSDHHAIUSA-N -1 3 340.467 4.110 20 0 EIADHM CC(C)c1ccc(/C=C/CC(=O)NCc2ccc([O-])c(F)c2)cc1 ZINC000494305347 1043415804 /nfs/dbraw/zinc/41/58/04/1043415804.db2.gz AJFXGBKLDHPPEF-ONEGZZNKSA-N -1 3 327.399 4.374 20 0 EIADHM [O-]c1c(F)cc(F)cc1Nc1c(F)cccc1OC[C@@H]1CCCO1 ZINC001212491071 1043584418 /nfs/dbraw/zinc/58/44/18/1043584418.db2.gz GTNGOBBVQSXOCY-NSHDSACASA-N -1 3 339.313 4.111 20 0 EIADHM O=C(OCc1csc(-c2ccoc2)n1)c1cc(Cl)c(Cl)[n-]1 ZINC000731071972 1043684893 /nfs/dbraw/zinc/68/48/93/1043684893.db2.gz SVXHXYDYDHQGQC-UHFFFAOYSA-N -1 3 343.191 4.395 20 0 EIADHM CSc1cc(O)ccc1[N-]C(=O)c1cnc(-c2ccco2)s1 ZINC000191201553 1043796176 /nfs/dbraw/zinc/79/61/76/1043796176.db2.gz IURAGEJDFVNKSO-UHFFFAOYSA-N -1 3 332.406 4.083 20 0 EIADHM O=C(Nc1ncccc1[O-])c1[nH]ccc1-c1c(Cl)cccc1Cl ZINC000442891216 1043885786 /nfs/dbraw/zinc/88/57/86/1043885786.db2.gz KBJSFYKIBIJAHV-UHFFFAOYSA-N -1 3 348.189 4.341 20 0 EIADHM CCCCc1nc(CO[N-]C(=O)CCCc2ccccc2)cs1 ZINC000732804793 1044010595 /nfs/dbraw/zinc/01/05/95/1044010595.db2.gz XAUUOXAZWAOKPQ-UHFFFAOYSA-N -1 3 332.469 4.056 20 0 EIADHM O=C([N-]c1nc(-c2ccc(F)cc2)ns1)c1cc2ccccc2o1 ZINC000732942564 1044048244 /nfs/dbraw/zinc/04/82/44/1044048244.db2.gz ONVYLGMQYPGILU-UHFFFAOYSA-N -1 3 339.351 4.343 20 0 EIADHM C[C@@H](Oc1c([O-])cc(Cl)cc1F)c1ccc(Br)nc1 ZINC001234448457 1044054286 /nfs/dbraw/zinc/05/42/86/1044054286.db2.gz SHQFRAICNKHOFV-SSDOTTSWSA-N -1 3 346.583 4.482 20 0 EIADHM C[C@@H]1CCCCCN1Cc1csc(-c2cccc(C(=O)[O-])c2)n1 ZINC000522008794 1044152628 /nfs/dbraw/zinc/15/26/28/1044152628.db2.gz WFZWAJRTANUFQO-CYBMUJFWSA-N -1 3 330.453 4.273 20 0 EIADHM COc1cc(Cl)ccc1S(=O)(=O)[N-]c1cc(C)ccc1Cl ZINC000675548991 1044380136 /nfs/dbraw/zinc/38/01/36/1044380136.db2.gz DCDYIZVDKNGZNR-UHFFFAOYSA-N -1 3 346.235 4.111 20 0 EIADHM Cc1csc(N(C)C(=O)c2cc(Cc3ccccc3)ccc2[O-])n1 ZINC000094126530 1044528902 /nfs/dbraw/zinc/52/89/02/1044528902.db2.gz BWFAXPPOAZNSTM-UHFFFAOYSA-N -1 3 338.432 4.025 20 0 EIADHM Cc1cccc2sc(C(=O)[N-]c3nc(C4CC4)no3)c(Cl)c21 ZINC000734874513 1044705469 /nfs/dbraw/zinc/70/54/69/1044705469.db2.gz GQKVPWBZENHNNQ-UHFFFAOYSA-N -1 3 333.800 4.376 20 0 EIADHM Cc1ccccc1C(C)(C)[N-]C(=O)C(F)(F)c1c(F)cccc1F ZINC001129213074 1044747031 /nfs/dbraw/zinc/74/70/31/1044747031.db2.gz IVBZYSBLTZTHIE-UHFFFAOYSA-N -1 3 339.332 4.417 20 0 EIADHM S=c1nc(-c2ccccn2)[n-]n1CN1CCC[C@@H]1C1CCCCC1 ZINC000735296397 1044788159 /nfs/dbraw/zinc/78/81/59/1044788159.db2.gz TWIRWIARNADDHR-MRXNPFEDSA-N -1 3 343.500 4.005 20 0 EIADHM C[C@@H](c1ccccc1Cl)N(C)C(=O)c1cc(=O)c2ccccc2[n-]1 ZINC000053457802 1044813086 /nfs/dbraw/zinc/81/30/86/1044813086.db2.gz AVZQHKVPBTWICB-LBPRGKRZSA-N -1 3 340.810 4.015 20 0 EIADHM C[C@H](OC(=O)c1cc2ccsc2[n-]1)c1nnc(-c2cccs2)o1 ZINC000914890864 1044852391 /nfs/dbraw/zinc/85/23/91/1044852391.db2.gz IQPITQRJQOIAKK-QMMMGPOBSA-N -1 3 345.405 4.259 20 0 EIADHM C[C@H](OC(=O)c1cc2ccsc2[n-]1)c1nnc(-c2ccccc2)o1 ZINC000914890118 1044852803 /nfs/dbraw/zinc/85/28/03/1044852803.db2.gz CCQRXOINUFGSSJ-JTQLQIEISA-N -1 3 339.376 4.197 20 0 EIADHM COc1ccc(S(=O)(=O)[N-]c2c(C)cccc2C(C)C)c(C)c1 ZINC000096659381 1044886321 /nfs/dbraw/zinc/88/63/21/1044886321.db2.gz WMWGUKJAJPYUCL-UHFFFAOYSA-N -1 3 333.453 4.236 20 0 EIADHM Cc1cc(Br)cc(NC(=O)c2cc([O-])ccc2Cl)c1 ZINC000232070520 1044887420 /nfs/dbraw/zinc/88/74/20/1044887420.db2.gz KFZCUSWNRXLISZ-UHFFFAOYSA-N -1 3 340.604 4.369 20 0 EIADHM Cc1c(Br)cccc1NC(=O)c1cc([O-])ccc1Cl ZINC000232214597 1044899708 /nfs/dbraw/zinc/89/97/08/1044899708.db2.gz VMZSRKFPJWGHIN-UHFFFAOYSA-N -1 3 340.604 4.369 20 0 EIADHM CC(C)([N-]C(=O)C(F)(F)c1ccc(F)cc1)c1cccc(F)c1 ZINC000736502554 1044948740 /nfs/dbraw/zinc/94/87/40/1044948740.db2.gz QKPWTIPOUVAFBT-UHFFFAOYSA-N -1 3 325.305 4.108 20 0 EIADHM O=C(Cc1cccc2ccccc21)[N-]OCc1ccc2c(c1)CCC2 ZINC000738294750 1045056860 /nfs/dbraw/zinc/05/68/60/1045056860.db2.gz RKDABDVFBMQCAH-UHFFFAOYSA-N -1 3 331.415 4.119 20 0 EIADHM C[C@H](NC(=O)NCc1ccc([O-])c(F)c1)c1csc2ccccc21 ZINC000739007042 1045114011 /nfs/dbraw/zinc/11/40/11/1045114011.db2.gz SRPAPZFAWDYZDL-NSHDSACASA-N -1 3 344.411 4.306 20 0 EIADHM CCc1ocnc1C(=O)[N-]c1cccc(Cl)c1SC(F)F ZINC000739547730 1045158814 /nfs/dbraw/zinc/15/88/14/1045158814.db2.gz XYWJZIYMUHNASF-UHFFFAOYSA-N -1 3 332.759 4.457 20 0 EIADHM Cc1ccc(NCc2c(F)ccc([O-])c2F)cc1OCC(F)F ZINC000509428680 1045160803 /nfs/dbraw/zinc/16/08/03/1045160803.db2.gz FAUKDKFZZVUBHK-UHFFFAOYSA-N -1 3 329.293 4.235 20 0 EIADHM CC(C)(C(=O)[O-])[C@H]1CCCN(Cc2cc(Cl)cc(Cl)c2)C1 ZINC000135051267 1045195949 /nfs/dbraw/zinc/19/59/49/1045195949.db2.gz FMBZFHNAACPOMC-LBPRGKRZSA-N -1 3 330.255 4.316 20 0 EIADHM CC(C)(C)Sc1ccc(-c2noc(-c3ccccc3[O-])n2)cn1 ZINC000762340419 1045196974 /nfs/dbraw/zinc/19/69/74/1045196974.db2.gz BBXUPDRYAYAKFP-UHFFFAOYSA-N -1 3 327.409 4.395 20 0 EIADHM Cc1nc2ccc(Nc3c(Cl)c(F)[n-]c(=O)c3Cl)cc2[nH]1 ZINC001213071201 1045204735 /nfs/dbraw/zinc/20/47/35/1045204735.db2.gz FBYPTKJGHBMSAT-UHFFFAOYSA-N -1 3 327.146 4.161 20 0 EIADHM Cc1cc(NC(=O)c2cc([O-])ccc2Cl)ccc1Br ZINC000235877774 1045344836 /nfs/dbraw/zinc/34/48/36/1045344836.db2.gz VYZAFZGEJGSACI-UHFFFAOYSA-N -1 3 340.604 4.369 20 0 EIADHM CCC(CC)c1nnc([N-]C(=O)c2nc(Cl)sc2C)s1 ZINC000762841443 1045357078 /nfs/dbraw/zinc/35/70/78/1045357078.db2.gz MZUAKPWSAKKZFF-UHFFFAOYSA-N -1 3 330.866 4.112 20 0 EIADHM O=C(Nc1ccc(F)c(Br)c1)c1cc([O-])ccc1Cl ZINC000236558122 1045359425 /nfs/dbraw/zinc/35/94/25/1045359425.db2.gz AQQAZGDQTDWDLS-UHFFFAOYSA-N -1 3 344.567 4.200 20 0 EIADHM Cc1ccc([N-]S(=O)(=O)c2ccccc2C)cc1C(F)(F)F ZINC000316668326 1045452868 /nfs/dbraw/zinc/45/28/68/1045452868.db2.gz RRGOTIRUKVCZIM-UHFFFAOYSA-N -1 3 329.343 4.123 20 0 EIADHM CC(C)(C)[C@H]1CN(C(=O)c2nnc3ccccc3c2[O-])c2ccccc21 ZINC000768108543 1045718322 /nfs/dbraw/zinc/71/83/22/1045718322.db2.gz QLGRLGAZWFYAOQ-HNNXBMFYSA-N -1 3 347.418 4.126 20 0 EIADHM CC[C@](C)(NC(=O)c1cc2sccc2c([O-])c1)c1nc(C)cs1 ZINC000791369697 1045727738 /nfs/dbraw/zinc/72/77/38/1045727738.db2.gz BRYWCVVRWJXLLY-KRWDZBQOSA-N -1 3 346.477 4.427 20 0 EIADHM COc1cc(Cl)ccc1CNC(=O)c1cc2sccc2c([O-])c1 ZINC000791360480 1045731899 /nfs/dbraw/zinc/73/18/99/1045731899.db2.gz MNQATVRPZXHUAP-UHFFFAOYSA-N -1 3 347.823 4.199 20 0 EIADHM Cc1ccnc(C(=O)[N-]c2cccc(Cl)c2SC(F)F)n1 ZINC000791559683 1045767604 /nfs/dbraw/zinc/76/76/04/1045767604.db2.gz XTLIABRUGZEIGU-UHFFFAOYSA-N -1 3 329.759 4.005 20 0 EIADHM [O-]C(=NO[C@H]1CCCCO1)Nc1ccc(OCC2CCCCC2)cc1 ZINC000763264933 1045801923 /nfs/dbraw/zinc/80/19/23/1045801923.db2.gz AJGUWCPDUDZYAM-SFHVURJKSA-N -1 3 348.443 4.225 20 0 EIADHM O=C([N-]O[C@H]1CCCCO1)Nc1ccc(OCC2CCCCC2)cc1 ZINC000763264933 1045801933 /nfs/dbraw/zinc/80/19/33/1045801933.db2.gz AJGUWCPDUDZYAM-SFHVURJKSA-N -1 3 348.443 4.225 20 0 EIADHM [O-]c1ccc(Nc2cccc([C@@H]3CN4C=CSC4=N3)c2)c(F)c1F ZINC001212013884 1045834918 /nfs/dbraw/zinc/83/49/18/1045834918.db2.gz OBBCGVMNDRYIEV-ZDUSSCGKSA-N -1 3 345.374 4.345 20 0 EIADHM COC(=O)c1cccc2c(Nc3ccc([O-])c(F)c3F)cccc12 ZINC001212013619 1045835657 /nfs/dbraw/zinc/83/56/57/1045835657.db2.gz AJFGOIWJEUZSFB-UHFFFAOYSA-N -1 3 329.302 4.354 20 0 EIADHM COc1cc(F)cc(Br)c1Nc1ccc([O-])c(F)c1F ZINC001212014096 1045835679 /nfs/dbraw/zinc/83/56/79/1045835679.db2.gz ZISHRDYNCFNFFY-UHFFFAOYSA-N -1 3 348.118 4.324 20 0 EIADHM CC(=O)c1cccc(Br)c1Nc1ccc([O-])c(F)c1F ZINC001212016303 1045838969 /nfs/dbraw/zinc/83/89/69/1045838969.db2.gz JLTSVHDYODUTNY-UHFFFAOYSA-N -1 3 342.139 4.379 20 0 EIADHM CCOC(=O)CCc1ccc(Nc2ccc([O-])c(F)c2F)cc1F ZINC001212016463 1045839993 /nfs/dbraw/zinc/83/99/93/1045839993.db2.gz RBPCJYDERWHYFR-UHFFFAOYSA-N -1 3 339.313 4.049 20 0 EIADHM O=C(NCc1ccnc2ccccc12)c1cc([O-])c2ccccc2c1 ZINC000792211938 1045882923 /nfs/dbraw/zinc/88/29/23/1045882923.db2.gz NRHYKIMRPWIXDF-UHFFFAOYSA-N -1 3 328.371 4.024 20 0 EIADHM [O-]c1cccc(Nc2cccc(OC(F)F)c2)c1Br ZINC001212066697 1045899428 /nfs/dbraw/zinc/89/94/28/1045899428.db2.gz YDVHMJLRZVSMRO-UHFFFAOYSA-N -1 3 330.128 4.500 20 0 EIADHM COc1ccc(N(C(=O)c2cccc(C)c2[O-])[C@@H](C)C2CC2)cc1 ZINC000124597269 1046251428 /nfs/dbraw/zinc/25/14/28/1046251428.db2.gz VOIXCLUSLZZTAN-AWEZNQCLSA-N -1 3 325.408 4.155 20 0 EIADHM O=C([O-])CC[C@@H]1CCCN(Cc2cc(-c3ccc(Cl)cc3)no2)C1 ZINC000263086191 1046252824 /nfs/dbraw/zinc/25/28/24/1046252824.db2.gz IKDUWQCSXJJVGO-ZDUSSCGKSA-N -1 3 348.830 4.072 20 0 EIADHM COc1ccc2oc([C@@H](C)NCc3ccc(C(=O)[O-])cc3)c(C)c2c1 ZINC000263382985 1046277505 /nfs/dbraw/zinc/27/75/05/1046277505.db2.gz CFASTWZZYRWTQQ-CYBMUJFWSA-N -1 3 339.391 4.299 20 0 EIADHM O=C([O-])[C@@]12CCC[C@H]1CN(Cc1ccc(Cl)c(C(F)(F)F)c1)C2 ZINC000263502097 1046296686 /nfs/dbraw/zinc/29/66/86/1046296686.db2.gz KZWMUFMHFMORNS-XHDPSFHLSA-N -1 3 347.764 4.046 20 0 EIADHM CC[C@H](NCc1cccc(C(=O)[O-])c1)c1ccccc1OC(F)F ZINC000263491577 1046298151 /nfs/dbraw/zinc/29/81/51/1046298151.db2.gz RKSSSDHEEZQBJV-HNNXBMFYSA-N -1 3 335.350 4.227 20 0 EIADHM O=C(Nc1ccc(Br)cc1[O-])c1cc(Cl)ccc1F ZINC000125986508 1046407668 /nfs/dbraw/zinc/40/76/68/1046407668.db2.gz FMNCGNQUJNPWKK-UHFFFAOYSA-N -1 3 344.567 4.200 20 0 EIADHM CC(C)OC(=O)c1ccc(OC(=O)c2cc3ccsc3[n-]2)cc1 ZINC000917048696 1046584622 /nfs/dbraw/zinc/58/46/22/1046584622.db2.gz KABPQUZDGKIXCR-UHFFFAOYSA-N -1 3 329.377 4.014 20 0 EIADHM Cc1ccc2c(c1)CC[C@@H]2NCc1cccc([O-])c1Br ZINC000459396017 1046616789 /nfs/dbraw/zinc/61/67/89/1046616789.db2.gz QCXIQOFFUPDTJJ-HNNXBMFYSA-N -1 3 332.241 4.240 20 0 EIADHM COc1ccc([O-])c(C(=O)N(C)c2ccc(-c3ccccc3)cc2)c1 ZINC000536723701 1046735311 /nfs/dbraw/zinc/73/53/11/1046735311.db2.gz YEOGSHSJZAGFPF-UHFFFAOYSA-N -1 3 333.387 4.344 20 0 EIADHM C[C@@H](OC(=O)c1cc2occc2[n-]1)C(=O)C12CC3CC(CC(C3)C1)C2 ZINC000786029502 1046796327 /nfs/dbraw/zinc/79/63/27/1046796327.db2.gz DVDHXUKOXOCCLK-JIEKGTPASA-N -1 3 341.407 4.092 20 0 EIADHM O=C(OCc1cc(Cl)nc2ccccc12)c1cc2occc2[n-]1 ZINC000786027332 1046797752 /nfs/dbraw/zinc/79/77/52/1046797752.db2.gz AVKLIGJNMJWTPC-UHFFFAOYSA-N -1 3 326.739 4.320 20 0 EIADHM O=C(OCc1cccc(OCC(F)(F)F)c1)c1cc2occc2[n-]1 ZINC000786031090 1046804259 /nfs/dbraw/zinc/80/42/59/1046804259.db2.gz LNAATQNTANSQDB-UHFFFAOYSA-N -1 3 339.269 4.059 20 0 EIADHM CC(C)(C)c1cnc(COC(=O)c2cc3sccc3c([O-])c2)o1 ZINC000786140541 1046811846 /nfs/dbraw/zinc/81/18/46/1046811846.db2.gz CIYCWANLFHURKO-UHFFFAOYSA-N -1 3 331.393 4.249 20 0 EIADHM Cc1ccc(C(=O)COC(=O)c2cc3sccc3c([O-])c2)s1 ZINC000786140390 1046812353 /nfs/dbraw/zinc/81/23/53/1046812353.db2.gz OKXIUJSYPMDRKM-UHFFFAOYSA-N -1 3 332.402 4.017 20 0 EIADHM C[C@@H](OC(=O)c1cc2sccc2c([O-])c1)C(=O)c1ccccc1 ZINC000786134301 1046815094 /nfs/dbraw/zinc/81/50/94/1046815094.db2.gz RFQHIVKSRQWCDI-LLVKDONJSA-N -1 3 326.373 4.035 20 0 EIADHM O=C(CCC(=O)c1csc2ccccc12)Nc1cccc([O-])c1F ZINC000128347973 1046831281 /nfs/dbraw/zinc/83/12/81/1046831281.db2.gz XOKAWWZEAGBSNW-UHFFFAOYSA-N -1 3 343.379 4.348 20 0 EIADHM O=C(Nc1ccc([O-])c(C(F)(F)F)c1)[C@@H]1C[C@H]1c1ccc(F)cc1 ZINC000536891760 1046850356 /nfs/dbraw/zinc/85/03/56/1046850356.db2.gz SOTHJEYPHRNURK-QWHCGFSZSA-N -1 3 339.288 4.292 20 0 EIADHM Cc1ccc(N[C@@H](c2ccc(F)cc2)C(C)C)cc1-c1nnn[n-]1 ZINC001170067826 1046910876 /nfs/dbraw/zinc/91/08/76/1046910876.db2.gz XHFPDIJYYFVOQE-QGZVFWFLSA-N -1 3 325.391 4.123 20 0 EIADHM Cc1ccc(N[C@@H](c2ccc(F)cc2)C(C)C)cc1-c1nn[n-]n1 ZINC001170067826 1046910893 /nfs/dbraw/zinc/91/08/93/1046910893.db2.gz XHFPDIJYYFVOQE-QGZVFWFLSA-N -1 3 325.391 4.123 20 0 EIADHM Cc1ccccc1-c1cc(=NC(=O)c2c[nH]cc2-c2ccccc2)[nH][n-]1 ZINC000537118437 1046947934 /nfs/dbraw/zinc/94/79/34/1046947934.db2.gz MADQLQXCPSPHED-UHFFFAOYSA-N -1 3 342.402 4.054 20 0 EIADHM Cc1ccccc1-c1cc(=NC(=O)[C@@H]2CCSc3ccccc32)[nH][n-]1 ZINC000537120448 1046948862 /nfs/dbraw/zinc/94/88/62/1046948862.db2.gz OOFZJMKFBKDMLZ-MRXNPFEDSA-N -1 3 349.459 4.025 20 0 EIADHM C[C@@H]1CC[C@@H](c2ccccc2)N(C(=O)NCc2ccc([O-])c(F)c2)C1 ZINC000497800973 1047086474 /nfs/dbraw/zinc/08/64/74/1047086474.db2.gz WJTFDMVIGCSITN-KDOFPFPSSA-N -1 3 342.414 4.214 20 0 EIADHM CCCOc1ccccc1[N-]S(=O)(=O)/C=C\c1ccc(C)cc1 ZINC000917727448 1047089137 /nfs/dbraw/zinc/08/91/37/1047089137.db2.gz LOFUWSRWKWISTB-OWBHPGMISA-N -1 3 331.437 4.196 20 0 EIADHM CCCOc1ccccc1[N-]S(=O)(=O)/C=C/c1ccc(C)cc1 ZINC000917727449 1047090014 /nfs/dbraw/zinc/09/00/14/1047090014.db2.gz LOFUWSRWKWISTB-WYMLVPIESA-N -1 3 331.437 4.196 20 0 EIADHM C[C@@H](Cc1cccc(C(F)(F)F)c1)C(=O)Nc1cccc([O-])c1F ZINC000128854412 1047125505 /nfs/dbraw/zinc/12/55/05/1047125505.db2.gz QWAXXUMFEVXNCC-JTQLQIEISA-N -1 3 341.304 4.367 20 0 EIADHM O=C(N=c1cc(-c2ccccc2)[n-][nH]1)c1cccc(Cl)c1Cl ZINC000497868769 1047145738 /nfs/dbraw/zinc/14/57/38/1047145738.db2.gz NWDXSVBQRHGSOK-UHFFFAOYSA-N -1 3 332.190 4.058 20 0 EIADHM O=C(NCCc1ccc(Cl)s1)c1cc2sccc2c([O-])c1 ZINC000788282824 1047156295 /nfs/dbraw/zinc/15/62/95/1047156295.db2.gz SQDSYRUHRLUIDO-UHFFFAOYSA-N -1 3 337.853 4.294 20 0 EIADHM Cc1cc(O[C@H](C)C(=O)Nc2cccc([O-])c2F)ccc1C(C)C ZINC000129097927 1047293742 /nfs/dbraw/zinc/29/37/42/1047293742.db2.gz VPSCBIIUPWWHSX-CYBMUJFWSA-N -1 3 331.387 4.369 20 0 EIADHM O=C([N-]c1nnc(C2CCCCC2)s1)c1scnc1C1CC1 ZINC000760310072 1047308837 /nfs/dbraw/zinc/30/88/37/1047308837.db2.gz BZKKSSAJNUKJHP-UHFFFAOYSA-N -1 3 334.470 4.172 20 0 EIADHM CC(C)(C)C(=O)OCSc1nnc([N-]c2ccccc2F)s1 ZINC000788805625 1047309884 /nfs/dbraw/zinc/30/98/84/1047309884.db2.gz OCIPKYRIOUKEQV-UHFFFAOYSA-N -1 3 341.433 4.060 20 0 EIADHM O=C([N-]c1nnc(C2CCCCC2)s1)c1csc(C2CC2)n1 ZINC000747378562 1047434104 /nfs/dbraw/zinc/43/41/04/1047434104.db2.gz XLBDWTUIAUEYGQ-UHFFFAOYSA-N -1 3 334.470 4.172 20 0 EIADHM O=C(Nc1cccc([O-])c1F)c1ccc(Sc2ccccn2)cc1 ZINC000129726081 1047494975 /nfs/dbraw/zinc/49/49/75/1047494975.db2.gz ZTKXWOJEJPWPFK-UHFFFAOYSA-N -1 3 340.379 4.330 20 0 EIADHM O=C([N-]c1nnc(-c2ccc(Cl)cc2)s1)c1ccc(F)s1 ZINC001127438589 1047496654 /nfs/dbraw/zinc/49/66/54/1047496654.db2.gz UZMCPGGRTPWQGP-UHFFFAOYSA-N -1 3 339.804 4.311 20 0 EIADHM C[C@H]1C[C@@H](c2ccc(F)cc2)CN1C(=O)c1cc([O-])ccc1Cl ZINC000556266313 1047645249 /nfs/dbraw/zinc/64/52/49/1047645249.db2.gz LFWLLEKFFDDUJN-WCQYABFASA-N -1 3 333.790 4.203 20 0 EIADHM C[C@@H]1CN(C(=O)c2cc([O-])ccc2Cl)CC[C@H]1c1ccccc1 ZINC000556352499 1047700071 /nfs/dbraw/zinc/70/00/71/1047700071.db2.gz AYRJFNZFXOXZCR-CZUORRHYSA-N -1 3 329.827 4.311 20 0 EIADHM O=C(COC(=O)c1cc2ccsc2[n-]1)c1cc2ccccc2o1 ZINC000918940197 1047704827 /nfs/dbraw/zinc/70/48/27/1047704827.db2.gz ZJGPHFJUBBAZFZ-UHFFFAOYSA-N -1 3 325.345 4.015 20 0 EIADHM Cc1c2ccc(F)cc2sc1C(=O)NCc1ccc([O-])c(F)c1 ZINC000498572036 1047752568 /nfs/dbraw/zinc/75/25/68/1047752568.db2.gz UDMYCZWVRHUDOV-UHFFFAOYSA-N -1 3 333.359 4.124 20 0 EIADHM O=C(Nc1ccc2cccc(Cl)c2n1)c1cc([O-])ccc1Cl ZINC000498717453 1047825104 /nfs/dbraw/zinc/82/51/04/1047825104.db2.gz QBRDAZQVAWEGKV-UHFFFAOYSA-N -1 3 333.174 4.500 20 0 EIADHM COC(C)(C)[C@@H](C)[N-]C(=O)C(F)(F)c1cccc(Cl)c1Cl ZINC001134162453 1047889349 /nfs/dbraw/zinc/88/93/49/1047889349.db2.gz DBDLWVNMWRPTEI-MRVPVSSYSA-N -1 3 340.197 4.015 20 0 EIADHM O=S(=O)(/C=C/c1ccccc1Cl)[N-]c1cc(F)cc(F)c1F ZINC000814212153 1047890635 /nfs/dbraw/zinc/89/06/35/1047890635.db2.gz GLTFYLWPQCRFCC-AATRIKPKSA-N -1 3 347.745 4.170 20 0 EIADHM CSC(C)(C)CNC(=O)c1cc(CCc2ccccc2)ccc1[O-] ZINC001137032696 1048089979 /nfs/dbraw/zinc/08/99/79/1048089979.db2.gz XFMATEXOUCZTBV-UHFFFAOYSA-N -1 3 343.492 4.049 20 0 EIADHM CC(=O)c1cccc(NC(=O)[C@H](C)Oc2cccc(C(C)C)c2)c1[O-] ZINC000556894098 1048119870 /nfs/dbraw/zinc/11/98/70/1048119870.db2.gz MGHARFXGNRQYEF-AWEZNQCLSA-N -1 3 341.407 4.124 20 0 EIADHM CC(=O)c1cccc(NC(=O)[C@H](C)CSc2ccc(F)cc2)c1[O-] ZINC000556891517 1048133655 /nfs/dbraw/zinc/13/36/55/1048133655.db2.gz BOWVCHGJBHVRSK-LLVKDONJSA-N -1 3 347.411 4.101 20 0 EIADHM Cc1ccsc1-c1nsc([N-]C(=O)c2ccc(F)cc2F)n1 ZINC000131791705 1048148632 /nfs/dbraw/zinc/14/86/32/1048148632.db2.gz OQBCKMAJXCGRHT-UHFFFAOYSA-N -1 3 337.376 4.106 20 0 EIADHM CCc1cccc(C(=O)N2CCc3ccc(C(F)(F)F)cc3C2)c1[O-] ZINC001171112598 1048238652 /nfs/dbraw/zinc/23/86/52/1048238652.db2.gz KNBOTQYAOIJGNT-UHFFFAOYSA-N -1 3 349.352 4.172 20 0 EIADHM [O-]c1cccc(CNC[C@H](O)c2c(Cl)cccc2Cl)c1Cl ZINC000815125311 1048338426 /nfs/dbraw/zinc/33/84/26/1048338426.db2.gz CVBZPBMGUIGUFX-ZDUSSCGKSA-N -1 3 346.641 4.176 20 0 EIADHM C[C@H](NCc1cccc([O-])c1Cl)[C@@H](O)c1c(F)cccc1Cl ZINC000815128264 1048342126 /nfs/dbraw/zinc/34/21/26/1048342126.db2.gz UIMTXNVCWIRFGH-XXFAHNHDSA-N -1 3 344.213 4.050 20 0 EIADHM CC(C)(C)[C@@H]1CCCC[C@@H]1CNC(=O)c1cc(=O)c2ccccc2[n-]1 ZINC000920043547 1048394366 /nfs/dbraw/zinc/39/43/66/1048394366.db2.gz RZACEXPFRIMYJZ-GDBMZVCRSA-N -1 3 340.467 4.110 20 0 EIADHM CC(C)(C)[C@H]1CCCC[C@@H]1CNC(=O)c1c[n-]c2ccccc2c1=O ZINC000920040019 1048402026 /nfs/dbraw/zinc/40/20/26/1048402026.db2.gz NDBGUERBVDEYBO-PBHICJAKSA-N -1 3 340.467 4.110 20 0 EIADHM Cc1ccc(C2=CCN(C(=O)c3cc([O-])ccc3Cl)CC2)cc1 ZINC000809976587 1048587211 /nfs/dbraw/zinc/58/72/11/1048587211.db2.gz QRQBRUHDEKICHI-UHFFFAOYSA-N -1 3 327.811 4.284 20 0 EIADHM Cc1sc2[n-]c([C@@H](C)OC(=O)[C@@H]3C[C@H]3C3CCC3)nc(=O)c2c1C ZINC000845222525 1048616647 /nfs/dbraw/zinc/61/66/47/1048616647.db2.gz FGBBETIFOUHWPW-JIMOISOXSA-N -1 3 346.452 4.054 20 0 EIADHM Cc1ccc(-c2csc(NC(=O)c3c(C)cccc3[O-])n2)s1 ZINC001144368710 1048619960 /nfs/dbraw/zinc/61/99/60/1048619960.db2.gz KPUZKQZCWPNEKC-UHFFFAOYSA-N -1 3 330.434 4.446 20 0 EIADHM Cc1sc2[n-]c([C@@H](C)OC(=O)[C@H]3CC[C@H](C)CC3)nc(=O)c2c1C ZINC000845422300 1048662186 /nfs/dbraw/zinc/66/21/86/1048662186.db2.gz XWGATUAWDDPEOZ-IRUJWGPZSA-N -1 3 348.468 4.444 20 0 EIADHM Cc1c(Cl)cccc1NC(=O)c1c[n-]c2cc(F)c(F)cc2c1=O ZINC001135396853 1048701030 /nfs/dbraw/zinc/70/10/30/1048701030.db2.gz UZYHHWMBXRCGEB-UHFFFAOYSA-N -1 3 348.736 4.020 20 0 EIADHM O=C(Cc1ccc([O-])c(F)c1)NC1c2ccccc2Oc2ccccc21 ZINC001144633401 1048766668 /nfs/dbraw/zinc/76/66/68/1048766668.db2.gz SYLYSPZOUAWBBZ-UHFFFAOYSA-N -1 3 349.361 4.085 20 0 EIADHM [O-]c1cc(F)c(CN2CCC3(C=Cc4ccccc43)CC2)cc1F ZINC001144647634 1048769400 /nfs/dbraw/zinc/76/94/00/1048769400.db2.gz JUFNUKSHSJEOAU-UHFFFAOYSA-N -1 3 327.374 4.231 20 0 EIADHM [O-]c1cc(F)c(CN2CCC3(CCc4ccccc4O3)CC2)cc1F ZINC001144659440 1048791578 /nfs/dbraw/zinc/79/15/78/1048791578.db2.gz JATGBGVXZPSQKK-UHFFFAOYSA-N -1 3 345.389 4.030 20 0 EIADHM O=C(N[C@H]1CC2(CCC2)Oc2ccccc21)c1cc([O-])ccc1Cl ZINC000810523274 1048805439 /nfs/dbraw/zinc/80/54/39/1048805439.db2.gz GMAIDJLWFURAGV-INIZCTEOSA-N -1 3 343.810 4.222 20 0 EIADHM CC1(C)C[C@@H](NCc2c(F)ccc([O-])c2F)c2cc(F)ccc2O1 ZINC000846053224 1048807662 /nfs/dbraw/zinc/80/76/62/1048807662.db2.gz TWFAAHIKMMRCBY-CQSZACIVSA-N -1 3 337.341 4.202 20 0 EIADHM O=C(OCc1cc(Cl)ccn1)c1cc2cc(Cl)sc2[n-]1 ZINC000810567337 1048814352 /nfs/dbraw/zinc/81/43/52/1048814352.db2.gz ZURFGIKJNSYJPH-UHFFFAOYSA-N -1 3 327.192 4.288 20 0 EIADHM CCOc1cccc2cc([C@H](C)NC(=O)c3ccc(C)cc3[O-])oc21 ZINC001135662815 1048853325 /nfs/dbraw/zinc/85/33/25/1048853325.db2.gz YYKJTSPQDLJPCE-ZDUSSCGKSA-N -1 3 339.391 4.337 20 0 EIADHM Cc1ccc(C(F)(F)C(=O)[N-][C@H](c2ccccc2)C(F)F)cc1 ZINC000817223953 1048909986 /nfs/dbraw/zinc/90/99/86/1048909986.db2.gz FXMVMBLRLOTRMN-CQSZACIVSA-N -1 3 325.305 4.209 20 0 EIADHM O=C(NCCc1cccc(F)c1)c1cc(Cc2ccccc2)ccc1[O-] ZINC001135862037 1048931652 /nfs/dbraw/zinc/93/16/52/1048931652.db2.gz CCKWVGNNIQHSTD-UHFFFAOYSA-N -1 3 349.405 4.095 20 0 EIADHM CCc1cccc(C(=O)NC(c2ccccc2)c2ccccc2)c1[O-] ZINC001135921135 1048968730 /nfs/dbraw/zinc/96/87/30/1048968730.db2.gz GFZBHEQSGVOJLV-UHFFFAOYSA-N -1 3 331.415 4.474 20 0 EIADHM O=c1nc(COc2ccccc2)[n-]c2sc(-c3ccccc3)cc21 ZINC000077491256 1049030588 /nfs/dbraw/zinc/03/05/88/1049030588.db2.gz PLONPOVHPHXPLK-UHFFFAOYSA-N -1 3 334.400 4.231 20 0 EIADHM O=C(O[C@@H]1CCC[C@H]1n1cccn1)c1cc2cc(Cl)sc2[n-]1 ZINC000817757119 1049038787 /nfs/dbraw/zinc/03/87/87/1049038787.db2.gz JDYZYNHNQZDNHU-VXGBXAGGSA-N -1 3 335.816 4.030 20 0 EIADHM Nc1ccc(C(=O)Nc2cccc(COC3CCCCC3)c2)c([O-])c1 ZINC000817927709 1049061005 /nfs/dbraw/zinc/06/10/05/1049061005.db2.gz QITFOSYAARILTB-UHFFFAOYSA-N -1 3 340.423 4.076 20 0 EIADHM CCC(CC)[C@@H](NC(=O)c1nnc2ccccc2c1[O-])c1ccccc1 ZINC001147520189 1049178834 /nfs/dbraw/zinc/17/88/34/1049178834.db2.gz XBRWONCZLUVPLK-GOSISDBHSA-N -1 3 349.434 4.243 20 0 EIADHM Cc1scc(C(=O)Nc2ccc(C(=O)OC(C)(C)C)cc2[O-])c1C ZINC001147530707 1049182082 /nfs/dbraw/zinc/18/20/82/1049182082.db2.gz KQGYDHYDIMWALP-UHFFFAOYSA-N -1 3 347.436 4.278 20 0 EIADHM CCCCN(C(=O)c1nnc2ccccc2c1[O-])[C@@H]1CCC[C@@H](C)C1 ZINC000818801928 1049204947 /nfs/dbraw/zinc/20/49/47/1049204947.db2.gz HTNHMYVTZMREEK-HUUCEWRRSA-N -1 3 341.455 4.156 20 0 EIADHM O=C(NC[C@H]1CCCc2ccccc21)c1cc2sccc2c([O-])c1 ZINC001136167175 1049215958 /nfs/dbraw/zinc/21/59/58/1049215958.db2.gz KCVIPORNAJWTMM-CQSZACIVSA-N -1 3 337.444 4.457 20 0 EIADHM CSc1ccc([O-])c(C(=O)N[C@H](C(F)F)C2CCCCC2)c1 ZINC001148014375 1049250798 /nfs/dbraw/zinc/25/07/98/1049250798.db2.gz FVSKGLOMNUQFCK-AWEZNQCLSA-N -1 3 329.412 4.058 20 0 EIADHM CCCCOc1ccc(OC)cc1NC(=O)c1cccc(C)c1[O-] ZINC001136193419 1049263211 /nfs/dbraw/zinc/26/32/11/1049263211.db2.gz SRBZKSRJPNPCHI-UHFFFAOYSA-N -1 3 329.396 4.140 20 0 EIADHM CCc1ccc([O-])c(C(=O)N2C[C@H](C)C[C@@H]2c2cccc(F)c2)c1 ZINC001148097860 1049263583 /nfs/dbraw/zinc/26/35/83/1049263583.db2.gz XEUVMJPRIGKGJG-FZKQIMNGSA-N -1 3 327.399 4.317 20 0 EIADHM O=C(C[C@@H](Cc1ccccc1)c1ccccc1)[N-]OC/C=C\Cl ZINC000812403919 1049449906 /nfs/dbraw/zinc/44/99/06/1049449906.db2.gz UEVLTMNSTFGJAW-RYKGSNAESA-N -1 3 329.827 4.203 20 0 EIADHM CSc1ccc([O-])c(C(=O)NCc2ccccc2OCC(C)C)c1 ZINC001136366269 1049542396 /nfs/dbraw/zinc/54/23/96/1049542396.db2.gz AYDNJJWWSGTOGP-UHFFFAOYSA-N -1 3 345.464 4.079 20 0 EIADHM CC(C)c1cccc(S(=O)(=O)[N-]c2cnc(Cl)cc2Cl)c1 ZINC000820798743 1049561638 /nfs/dbraw/zinc/56/16/38/1049561638.db2.gz ICSIDJGHNVZNNY-UHFFFAOYSA-N -1 3 345.251 4.313 20 0 EIADHM Cc1cccc(C)c1OC[C@H](C)NC(=O)c1cc([O-])c2ccccc2c1 ZINC001136384492 1049566213 /nfs/dbraw/zinc/56/62/13/1049566213.db2.gz LXWGNMDXZTYCRX-INIZCTEOSA-N -1 3 349.430 4.360 20 0 EIADHM C[C@H](NCc1cc(Cl)cc([N+](=O)[O-])c1[O-])c1ccccc1Cl ZINC000237570894 1049618131 /nfs/dbraw/zinc/61/81/31/1049618131.db2.gz HGRQWZJAFPELDC-VIFPVBQESA-N -1 3 341.194 4.458 20 0 EIADHM CCCN(CC(=O)Nc1ccccc1C)Cc1cccc(Cl)c1[O-] ZINC000179567096 1049678149 /nfs/dbraw/zinc/67/81/49/1049678149.db2.gz MLFLNACWCNEXBV-UHFFFAOYSA-N -1 3 346.858 4.205 20 0 EIADHM O=C(NCC1CCSCC1)c1cc(Oc2ccccc2)ccc1[O-] ZINC001136731591 1049856274 /nfs/dbraw/zinc/85/62/74/1049856274.db2.gz BVOPKDNYVRNRAI-UHFFFAOYSA-N -1 3 343.448 4.058 20 0 EIADHM CSc1ccc([O-])c(C(=O)N2CCc3ccc(F)cc3[C@@H](C)C2)c1 ZINC000616567222 1049907376 /nfs/dbraw/zinc/90/73/76/1049907376.db2.gz LNJCTQRTYKAKCW-LBPRGKRZSA-N -1 3 345.439 4.055 20 0 EIADHM CC(C)CCc1nnc([N-]C(=O)c2cnc(C(C)(C)C)s2)s1 ZINC000617097079 1049949434 /nfs/dbraw/zinc/94/94/34/1049949434.db2.gz GEAQFHKSQAFRQS-UHFFFAOYSA-N -1 3 338.502 4.133 20 0 EIADHM Cc1nc([C@@H](C)N2CC[C@@](C)(C(=O)[O-])C2)oc1-c1ccc(Cl)cc1 ZINC000263571521 1049995323 /nfs/dbraw/zinc/99/53/23/1049995323.db2.gz JMOUNCCPEQSCDO-KZULUSFZSA-N -1 3 348.830 4.161 20 0 EIADHM [O-]c1cncc(-c2nc(-c3cc(Cl)ccc3C(F)(F)F)no2)c1 ZINC001212708309 1050329576 /nfs/dbraw/zinc/32/95/76/1050329576.db2.gz CZZVSLJREPMZPD-UHFFFAOYSA-N -1 3 341.676 4.176 20 0 EIADHM [O-]c1cncc(-c2nc(-c3ccccc3OCc3ccccc3)no2)c1 ZINC001212708843 1050330787 /nfs/dbraw/zinc/33/07/87/1050330787.db2.gz RWZWTAWVRXYFRB-UHFFFAOYSA-N -1 3 345.358 4.083 20 0 EIADHM Cc1sc2[n-]c([C@H](C)OC(=O)[C@@H]3C[C@@]3(C)C(C)C)nc(=O)c2c1C ZINC000775071708 1050462973 /nfs/dbraw/zinc/46/29/73/1050462973.db2.gz KDUHINWYHXEKLD-RSNWOKGLSA-N -1 3 348.468 4.300 20 0 EIADHM O=S(=O)(CCc1cccc2ccccc21)[N-]c1cc(F)cc(F)c1 ZINC001187607886 1050578861 /nfs/dbraw/zinc/57/88/61/1050578861.db2.gz JORMIGHKZGEGKN-UHFFFAOYSA-N -1 3 347.386 4.102 20 0 EIADHM O=C([N-]c1cc(-c2ccccn2)no1)Nc1ccc(F)c(Cl)c1 ZINC001187672509 1050592147 /nfs/dbraw/zinc/59/21/47/1050592147.db2.gz YBRUPXKCTWJUNV-UHFFFAOYSA-N -1 3 332.722 4.173 20 0 EIADHM CCCCCCc1ccc(NC(=O)c2[n-]nnc2C(F)(F)F)cc1 ZINC001187763835 1050620640 /nfs/dbraw/zinc/62/06/40/1050620640.db2.gz SEBLOLJAGPWAJA-UHFFFAOYSA-N -1 3 340.349 4.199 20 0 EIADHM CCCCCCc1ccc(NC(=O)c2nn[n-]c2C(F)(F)F)cc1 ZINC001187763835 1050620645 /nfs/dbraw/zinc/62/06/45/1050620645.db2.gz SEBLOLJAGPWAJA-UHFFFAOYSA-N -1 3 340.349 4.199 20 0 EIADHM [O-]c1cccc(CNCc2ccc3occc3c2)c1Br ZINC001179111219 1050635507 /nfs/dbraw/zinc/63/55/07/1050635507.db2.gz UWEMYVPFXCPLQH-UHFFFAOYSA-N -1 3 332.197 4.191 20 0 EIADHM O=C(NC(CCC(F)(F)F)CCC(F)(F)F)c1ccccc1[O-] ZINC000619126558 1050653269 /nfs/dbraw/zinc/65/32/69/1050653269.db2.gz YPDKRBXEZIEOSN-UHFFFAOYSA-N -1 3 343.267 4.176 20 0 EIADHM COc1ccc2cc(Nc3cc(=O)n(-c4ccccc4)[n-]3)ccc2c1 ZINC001174030494 1050712025 /nfs/dbraw/zinc/71/20/25/1050712025.db2.gz GTDZWWBLELMGCP-UHFFFAOYSA-N -1 3 331.375 4.483 20 0 EIADHM O=C(Nc1cc(Br)ccc1[O-])c1ccccc1C(F)F ZINC001188283988 1050741014 /nfs/dbraw/zinc/74/10/14/1050741014.db2.gz FOMFPPKGZOEPOM-UHFFFAOYSA-N -1 3 342.139 4.345 20 0 EIADHM CC1CCN(C(=O)c2ccc(Nc3c(F)cc([O-])cc3F)cc2)CC1 ZINC001174159961 1050801446 /nfs/dbraw/zinc/80/14/46/1050801446.db2.gz MNILEXVHWZYONB-UHFFFAOYSA-N -1 3 346.377 4.286 20 0 EIADHM CCC1(C[N-]S(=O)(=O)c2cccc(Cl)c2F)CCCCC1 ZINC001188978775 1050889205 /nfs/dbraw/zinc/88/92/05/1050889205.db2.gz OCYRRXRBXSPQRR-UHFFFAOYSA-N -1 3 333.856 4.118 20 0 EIADHM Cc1ccc(N2CCN(Cc3cccc([O-])c3Cl)[C@@H](C)C2)cc1C ZINC001180166459 1050909526 /nfs/dbraw/zinc/90/95/26/1050909526.db2.gz PBCVGLFGNFEMEQ-INIZCTEOSA-N -1 3 344.886 4.373 20 0 EIADHM O=c1cc(Nc2ccc(C(F)(F)F)cc2F)[n-]n1-c1ccccc1 ZINC001174399506 1050918641 /nfs/dbraw/zinc/91/86/41/1050918641.db2.gz NYZWRNSRFVYNIM-UHFFFAOYSA-N -1 3 337.276 4.479 20 0 EIADHM CC(C)c1ccc(C(=O)N[C@H]2Cc3ccc(Cl)cc3C2)c([O-])c1 ZINC001180252715 1050936196 /nfs/dbraw/zinc/93/61/96/1050936196.db2.gz ORGUDLRZWWHIEO-INIZCTEOSA-N -1 3 329.827 4.066 20 0 EIADHM O=S(=O)([N-]c1cc(F)ccc1F)c1ccc(F)c2ccccc21 ZINC001189347512 1050960372 /nfs/dbraw/zinc/96/03/72/1050960372.db2.gz IMMCRKZPGWYLFT-UHFFFAOYSA-N -1 3 337.322 4.058 20 0 EIADHM O=C(Nc1cc(Cl)cc2c[nH]nc21)c1cc2sccc2c([O-])c1 ZINC001180391237 1050975712 /nfs/dbraw/zinc/97/57/12/1050975712.db2.gz JFSJTOGOPIHQES-UHFFFAOYSA-N -1 3 343.795 4.389 20 0 EIADHM O=c1cc(Nc2cc(F)ccc2C(F)(F)F)[n-]n1-c1ccccc1 ZINC001174484743 1050991337 /nfs/dbraw/zinc/99/13/37/1050991337.db2.gz PODZTXLMTWZCIF-UHFFFAOYSA-N -1 3 337.276 4.479 20 0 EIADHM O=C(Nc1ccc(F)c([O-])c1)NC(c1ccccc1)c1ccccc1 ZINC001189539510 1051014166 /nfs/dbraw/zinc/01/41/66/1051014166.db2.gz IVWZNVWALNCLGJ-UHFFFAOYSA-N -1 3 336.366 4.442 20 0 EIADHM O=C(Nc1ccccc1C(F)F)c1cccc(OC(F)(F)F)c1[O-] ZINC001189766818 1051056861 /nfs/dbraw/zinc/05/68/61/1051056861.db2.gz SQERPJNOUAJQBQ-UHFFFAOYSA-N -1 3 347.239 4.481 20 0 EIADHM COc1cccc([C@H]2C[C@H](C)CN2Cc2c(F)ccc([O-])c2F)c1 ZINC001180834936 1051086064 /nfs/dbraw/zinc/08/60/64/1051086064.db2.gz INCCVGNRINLFHU-YVEFUNNKSA-N -1 3 333.378 4.262 20 0 EIADHM COc1cccc(F)c1[N-]c1nc2cc(Br)ccc2o1 ZINC001174990292 1051281639 /nfs/dbraw/zinc/28/16/39/1051281639.db2.gz FVKNOUZNDKVTQA-UHFFFAOYSA-N -1 3 337.148 4.482 20 0 EIADHM O=C(Cc1cccc(C(F)(F)F)c1Cl)Nc1ccc(F)c([O-])c1 ZINC001181711928 1051283614 /nfs/dbraw/zinc/28/36/14/1051283614.db2.gz DQSBAWRFEUIWMC-UHFFFAOYSA-N -1 3 347.695 4.385 20 0 EIADHM Cc1ccc(C(=O)N(Cc2cccnc2)Cc2ccccc2C)c([O-])c1 ZINC000154690437 1051325610 /nfs/dbraw/zinc/32/56/10/1051325610.db2.gz OGYZJEWMBUHADM-UHFFFAOYSA-N -1 3 346.430 4.247 20 0 EIADHM O=S(=O)([N-]CC1(C2CCC2)CCC1)c1cc(Cl)ccc1Cl ZINC001191065665 1051336892 /nfs/dbraw/zinc/33/68/92/1051336892.db2.gz SVDHLJCJQXLSNR-UHFFFAOYSA-N -1 3 348.295 4.242 20 0 EIADHM COc1c(F)cc(Nc2c(F)cc([O-])cc2F)cc1Br ZINC001175099444 1051345218 /nfs/dbraw/zinc/34/52/18/1051345218.db2.gz HDQZMTWQYZLPOZ-UHFFFAOYSA-N -1 3 348.118 4.324 20 0 EIADHM O=C(c1ccncc1)c1ccc(Nc2c(F)cc([O-])cc2F)cc1 ZINC001175099563 1051346143 /nfs/dbraw/zinc/34/61/43/1051346143.db2.gz MXPCJEPKYGDOLT-UHFFFAOYSA-N -1 3 326.302 4.040 20 0 EIADHM Cc1cc(Br)cc(Nc2c(F)cc([O-])cc2F)c1N ZINC001175100589 1051347425 /nfs/dbraw/zinc/34/74/25/1051347425.db2.gz XDSTWJTVKHJGHK-UHFFFAOYSA-N -1 3 329.144 4.067 20 0 EIADHM [O-]c1cc(F)c(Nc2ccccc2-c2nc(CO)cs2)c(F)c1 ZINC001175102460 1051350500 /nfs/dbraw/zinc/35/05/00/1051350500.db2.gz LSIZPUJTGXXGOG-UHFFFAOYSA-N -1 3 334.347 4.030 20 0 EIADHM Cc1cc(Nc2c(F)ccc([O-])c2F)nc(C)c1Br ZINC001175260853 1051499048 /nfs/dbraw/zinc/49/90/48/1051499048.db2.gz DKUMMJVHJZBZFC-UHFFFAOYSA-N -1 3 329.144 4.188 20 0 EIADHM [O-]c1ccc(F)c(Nc2c(F)cc(F)cc2Br)c1F ZINC001175264273 1051500001 /nfs/dbraw/zinc/50/00/01/1051500001.db2.gz FLUHXGJJFYPQJX-UHFFFAOYSA-N -1 3 336.082 4.455 20 0 EIADHM [O-]c1ccc(F)c(Nc2cccnc2OCc2ccccc2)c1F ZINC001175264051 1051500259 /nfs/dbraw/zinc/50/02/59/1051500259.db2.gz QUHRGFHDIVYIRR-UHFFFAOYSA-N -1 3 328.318 4.388 20 0 EIADHM CC(C)(C)c1cc(Nc2c(F)ccc([O-])c2F)n(-c2cccnc2)n1 ZINC001175265901 1051503722 /nfs/dbraw/zinc/50/37/22/1051503722.db2.gz MHULBDDSADGHOF-UHFFFAOYSA-N -1 3 344.365 4.292 20 0 EIADHM CCOC(=O)c1cc(Nc2c(F)ccc([O-])c2F)ccc1Cl ZINC001175267813 1051505251 /nfs/dbraw/zinc/50/52/51/1051505251.db2.gz ILBKIBYIWCWXNQ-UHFFFAOYSA-N -1 3 327.714 4.244 20 0 EIADHM CNc1ccc(Br)cc1Nc1c(F)ccc([O-])c1F ZINC001175270739 1051509434 /nfs/dbraw/zinc/50/94/34/1051509434.db2.gz IJNPIGNRSYKHOZ-UHFFFAOYSA-N -1 3 329.144 4.218 20 0 EIADHM CN(C)[C@H]1CCOc2c(Nc3ccc(C(=O)[O-])c(Cl)c3)cccc21 ZINC001175319796 1051531185 /nfs/dbraw/zinc/53/11/85/1051531185.db2.gz AEKCYAAJECVLPM-INIZCTEOSA-N -1 3 346.814 4.167 20 0 EIADHM CCOc1ccc(C)cc1S(=O)(=O)[N-]c1c(C)cccc1Cl ZINC001191780770 1051545670 /nfs/dbraw/zinc/54/56/70/1051545670.db2.gz UKHXFRQAOBMYQS-UHFFFAOYSA-N -1 3 339.844 4.156 20 0 EIADHM Cc1noc(C2CC2)c1[N-]C(=O)c1csc(Cc2ccccc2)n1 ZINC000156738288 1051560273 /nfs/dbraw/zinc/56/02/73/1051560273.db2.gz GFFFVTCEKMGKQZ-UHFFFAOYSA-N -1 3 339.420 4.160 20 0 EIADHM FC(F)(F)Sc1ccccc1Nc1ccc(-c2nn[n-]n2)cc1 ZINC001175428995 1051586318 /nfs/dbraw/zinc/58/63/18/1051586318.db2.gz DWEFXZQFKMRAJR-UHFFFAOYSA-N -1 3 337.330 4.222 20 0 EIADHM COc1ccc(-c2cccc(Nc3ccc(-c4nn[n-]n4)cc3)c2)cc1 ZINC001175429821 1051587795 /nfs/dbraw/zinc/58/77/95/1051587795.db2.gz PXWIQLBCUUSJKA-UHFFFAOYSA-N -1 3 343.390 4.286 20 0 EIADHM O=C([N-]c1nc2ccc(Cl)cn2n1)c1cc(Cl)sc1Cl ZINC000157095200 1051597341 /nfs/dbraw/zinc/59/73/41/1051597341.db2.gz HGLUITRPVHUWNB-UHFFFAOYSA-N -1 3 347.614 4.003 20 0 EIADHM CN(Cc1cnc(Cl)s1)C(=O)c1ccc(C(C)(C)C)cc1[O-] ZINC001192313794 1051689465 /nfs/dbraw/zinc/68/94/65/1051689465.db2.gz IPLTYYJYNYHUMQ-UHFFFAOYSA-N -1 3 338.860 4.072 20 0 EIADHM CC(C)(C)c1ccc(C(=O)N2CC[C@@H](c3ccccc3F)C2)c([O-])c1 ZINC001192327127 1051691028 /nfs/dbraw/zinc/69/10/28/1051691028.db2.gz PQDXBWBGEKQJNE-CQSZACIVSA-N -1 3 341.426 4.459 20 0 EIADHM CC(C)(C)c1ccc(C(=O)N2CC[C@H](c3ccccc3F)C2)c([O-])c1 ZINC001192327126 1051692400 /nfs/dbraw/zinc/69/24/00/1051692400.db2.gz PQDXBWBGEKQJNE-AWEZNQCLSA-N -1 3 341.426 4.459 20 0 EIADHM CC(C)(C)c1ccc(C(=O)N[C@H](c2cncc(F)c2)C2CC2)c([O-])c1 ZINC001192339957 1051693789 /nfs/dbraw/zinc/69/37/89/1051693789.db2.gz MUTHHTDLUULVBO-SFHVURJKSA-N -1 3 342.414 4.105 20 0 EIADHM Cc1nc(NC(=O)[C@H](C)c2cccc(Oc3ccccc3)c2)cc(=O)[n-]1 ZINC001182737604 1051694287 /nfs/dbraw/zinc/69/42/87/1051694287.db2.gz SRWHQGKHXYKSDN-CYBMUJFWSA-N -1 3 349.390 4.025 20 0 EIADHM Cc1n[nH]c2cc(Nc3cc(Br)cc(F)c3[O-])ccc12 ZINC001175663025 1051719682 /nfs/dbraw/zinc/71/96/82/1051719682.db2.gz OODDRBDXSVKAHR-UHFFFAOYSA-N -1 3 336.164 4.222 20 0 EIADHM Cc1[nH]nc2cc(Nc3ccc(F)c(Br)c3[O-])ccc12 ZINC001175662714 1051720001 /nfs/dbraw/zinc/72/00/01/1051720001.db2.gz BGURQSWNZHPKRM-UHFFFAOYSA-N -1 3 336.164 4.222 20 0 EIADHM O=C(Nc1ccc(F)c([O-])c1)c1ccc(Oc2ccc(O)cc2)cc1 ZINC001192450785 1051736410 /nfs/dbraw/zinc/73/64/10/1051736410.db2.gz BPXQZKUODGNRKM-UHFFFAOYSA-N -1 3 339.322 4.282 20 0 EIADHM CC(C)c1ccc2c(c1)[C@H](NC(=O)c1c([O-])cccc1O)CCC2 ZINC001183110576 1051789972 /nfs/dbraw/zinc/78/99/72/1051789972.db2.gz CMBVWYFDEDPJRL-MRXNPFEDSA-N -1 3 325.408 4.029 20 0 EIADHM CC[C@@H](NC(=O)c1cc([O-])cc(C(F)(F)F)c1)c1nc(C)cs1 ZINC000621856777 1051979974 /nfs/dbraw/zinc/97/99/74/1051979974.db2.gz DEBKLEXPQLXPRB-GFCCVEGCSA-N -1 3 344.358 4.057 20 0 EIADHM Cc1ccccc1C(C)(C)NC(=O)c1ccc([O-])cc1C(F)(F)F ZINC001193759750 1051994869 /nfs/dbraw/zinc/99/48/69/1051994869.db2.gz XZGDAYWFSPTHEY-UHFFFAOYSA-N -1 3 337.341 4.385 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2cccc(F)c2F)c2ccccc12 ZINC001193825586 1052007477 /nfs/dbraw/zinc/00/74/77/1052007477.db2.gz YIANKUHBSLQLDK-UHFFFAOYSA-N -1 3 333.359 4.227 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2c(C)cccc2F)c2ccccc12 ZINC001193856849 1052014335 /nfs/dbraw/zinc/01/43/35/1052014335.db2.gz HDSZKFHKUASJIE-UHFFFAOYSA-N -1 3 329.396 4.397 20 0 EIADHM Cc1cc(O)cc([O-])c1C(=O)Nc1ccc(-c2cccc(O)c2)cc1 ZINC001193938548 1052023781 /nfs/dbraw/zinc/02/37/81/1052023781.db2.gz QANWUGSFRQXZSI-UHFFFAOYSA-N -1 3 335.359 4.031 20 0 EIADHM [O-]c1cc(Cl)cnc1Nc1cccc2c1cnn2[C@@H]1CCCCO1 ZINC001176319472 1052025220 /nfs/dbraw/zinc/02/52/20/1052025220.db2.gz QYXJXQSZZZBVGY-INIZCTEOSA-N -1 3 344.802 4.233 20 0 EIADHM Cc1c2cc(F)ccc2oc1S(=O)(=O)[N-]C(C)(C)CC(C)(C)C ZINC001184524712 1052025544 /nfs/dbraw/zinc/02/55/44/1052025544.db2.gz VCZGWALQDINCHM-UHFFFAOYSA-N -1 3 341.448 4.373 20 0 EIADHM CCCC[C@@H](CC)COC(=O)NCc1cc(Cl)c([O-])c(OC)c1 ZINC001193983557 1052039206 /nfs/dbraw/zinc/03/92/06/1052039206.db2.gz JCMFNBWKZRRNPP-GFCCVEGCSA-N -1 3 343.851 4.497 20 0 EIADHM Cc1cccc(C(C)(C)C)c1NC(=O)Nc1cc(=O)[n-]c(C2CC2)n1 ZINC001184574041 1052045499 /nfs/dbraw/zinc/04/54/99/1052045499.db2.gz QCSYPRCAZIARMU-UHFFFAOYSA-N -1 3 340.427 4.310 20 0 EIADHM C[C@H](NCc1cccc([O-])c1Cl)c1ccccc1OC(F)F ZINC000294159956 1052058024 /nfs/dbraw/zinc/05/80/24/1052058024.db2.gz PJDSRPLSVKOWJV-JTQLQIEISA-N -1 3 327.758 4.498 20 0 EIADHM CC(C)COc1ccc(CN[C@H](CC(=O)[O-])c2cccs2)cc1 ZINC000671162186 1052074563 /nfs/dbraw/zinc/07/45/63/1052074563.db2.gz NIVVVQLEWOJQRI-MRXNPFEDSA-N -1 3 333.453 4.089 20 0 EIADHM CN(C(=O)c1cc([O-])cc(C(F)(F)F)c1)C1CCC(F)(F)CC1 ZINC000622054946 1052090001 /nfs/dbraw/zinc/09/00/01/1052090001.db2.gz UYERHDLTKQKBRI-UHFFFAOYSA-N -1 3 337.288 4.061 20 0 EIADHM O=C(NC1CCC2(CC2(F)F)CC1)c1cc([O-])cc(C(F)(F)F)c1 ZINC000622175511 1052144336 /nfs/dbraw/zinc/14/43/36/1052144336.db2.gz LUUAXLYIHBPKHW-UHFFFAOYSA-N -1 3 349.299 4.109 20 0 EIADHM O=C(Nc1ccc(F)c(F)c1)Nc1cc(Br)ccc1[O-] ZINC001185089784 1052163837 /nfs/dbraw/zinc/16/38/37/1052163837.db2.gz LTZHUBZWBXVEKY-UHFFFAOYSA-N -1 3 343.127 4.077 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)Nc1cccc2c1CCCC2 ZINC000622289670 1052184618 /nfs/dbraw/zinc/18/46/18/1052184618.db2.gz AATGNGQHJFDKAB-UHFFFAOYSA-N -1 3 327.399 4.372 20 0 EIADHM CCc1cccc(C(=O)N(C)Cc2cccc(C(F)(F)F)c2)c1[O-] ZINC000622315221 1052202413 /nfs/dbraw/zinc/20/24/13/1052202413.db2.gz UXAWNMWLVCVQPL-UHFFFAOYSA-N -1 3 337.341 4.246 20 0 EIADHM Cc1ccc(F)c(NC(=O)Nc2ccc([O-])c(Br)c2)c1 ZINC001185255180 1052203757 /nfs/dbraw/zinc/20/37/57/1052203757.db2.gz ITJKDXWOGZAOMM-UHFFFAOYSA-N -1 3 339.164 4.246 20 0 EIADHM Cc1ccc([O-])c(CN[C@H](C)c2cc(F)c(Cl)cc2Cl)n1 ZINC001177098565 1052229521 /nfs/dbraw/zinc/22/95/21/1052229521.db2.gz NHYBMEFJSDLXEC-SECBINFHSA-N -1 3 329.202 4.392 20 0 EIADHM O=C(Cc1ccc([O-])c(F)c1)N(Cc1ccccc1)C1CCCCC1 ZINC000622363344 1052232329 /nfs/dbraw/zinc/23/23/29/1052232329.db2.gz JDKUHMHHCYTRGE-UHFFFAOYSA-N -1 3 341.426 4.435 20 0 EIADHM O=C(Cc1ccc([O-])c(F)c1)Nc1ccccc1CCC(F)(F)F ZINC000622427331 1052263297 /nfs/dbraw/zinc/26/32/97/1052263297.db2.gz RSEMBWUDXMFLDB-UHFFFAOYSA-N -1 3 341.304 4.207 20 0 EIADHM Cc1ccc(CN(C)C(=O)c2cc([O-])cc(C(F)(F)F)c2)cc1C ZINC000622671580 1052382516 /nfs/dbraw/zinc/38/25/16/1052382516.db2.gz SQFYVHJCNNYKGI-UHFFFAOYSA-N -1 3 337.341 4.300 20 0 EIADHM COc1ccc2c(c1)C[C@H](C(C)C)CN2C(=O)c1cc(C)ccc1[O-] ZINC000622728524 1052396442 /nfs/dbraw/zinc/39/64/42/1052396442.db2.gz DUHOFWRRMPFHMA-INIZCTEOSA-N -1 3 339.435 4.184 20 0 EIADHM Cc1ccc(C(=O)Nc2cc(Cl)ccc2OC(F)F)c([O-])c1 ZINC000622733805 1052400406 /nfs/dbraw/zinc/40/04/06/1052400406.db2.gz PTXVWJGMYSUMME-UHFFFAOYSA-N -1 3 327.714 4.208 20 0 EIADHM Cc1noc(C)c1[N-]C(=O)c1cnc(-c2ccccc2Cl)s1 ZINC000623286662 1052615707 /nfs/dbraw/zinc/61/57/07/1052615707.db2.gz JXXJQFQXSFEIGM-UHFFFAOYSA-N -1 3 333.800 4.321 20 0 EIADHM CO[C@@H](C)c1nc(C)c(C(=O)[N-]c2c(F)cc(Cl)cc2F)s1 ZINC000180363403 1052796242 /nfs/dbraw/zinc/79/62/42/1052796242.db2.gz SXZCKZIUNARBAG-ZETCQYMHSA-N -1 3 346.786 4.343 20 0 EIADHM C[C@@H](NCc1cc(=O)oc2cc([O-])c(Cl)cc12)c1ccccc1 ZINC000794561684 1053082068 /nfs/dbraw/zinc/08/20/68/1053082068.db2.gz IPEIPJIZDZYSRH-LLVKDONJSA-N -1 3 329.783 4.003 20 0 EIADHM Cc1cc(NC(=O)c2cnc(C(F)(F)F)[n-]2)cc(C(F)(F)F)c1 ZINC001194782576 1053089653 /nfs/dbraw/zinc/08/96/53/1053089653.db2.gz USXJXSLRUXCISV-UHFFFAOYSA-N -1 3 337.223 4.008 20 0 EIADHM Cc1ccc(-n2cc(C=Cc3nccc(=O)[n-]3)c(C(C)(C)C)n2)cc1 ZINC000764436930 1053103033 /nfs/dbraw/zinc/10/30/33/1053103033.db2.gz XXYYGHPLSSVKJO-YFHOEESVSA-N -1 3 334.423 4.144 20 0 EIADHM Cc1cc(=O)[n-]c(CS[C@@H](C)c2cccc(Br)c2)n1 ZINC000764655904 1053248571 /nfs/dbraw/zinc/24/85/71/1053248571.db2.gz YTTRAENGZOKWDG-JTQLQIEISA-N -1 3 339.258 4.248 20 0 EIADHM CCN(C)c1ccc([N-]S(=O)(=O)c2cccc(C(C)C)c2)cc1 ZINC001195169037 1053314257 /nfs/dbraw/zinc/31/42/57/1053314257.db2.gz GFESFIKFGZIYJR-UHFFFAOYSA-N -1 3 332.469 4.067 20 0 EIADHM O=S(=O)([N-]CC1CCC=CCC1)c1cc(Cl)ccc1Cl ZINC001195207412 1053330706 /nfs/dbraw/zinc/33/07/06/1053330706.db2.gz IROWTNFPKFCIFN-UHFFFAOYSA-N -1 3 334.268 4.018 20 0 EIADHM COc1ccc(NC(=S)Nc2ccc(C(F)(F)F)cc2[O-])cc1 ZINC001195704747 1053464578 /nfs/dbraw/zinc/46/45/78/1053464578.db2.gz LEILJPRRXZLOET-UHFFFAOYSA-N -1 3 342.342 4.229 20 0 EIADHM O=C([N-]Cc1ccc(C(F)F)cc1)C(F)(F)c1ccc(F)cc1 ZINC000765344132 1053510430 /nfs/dbraw/zinc/51/04/30/1053510430.db2.gz HUDQDZCLNNCQBL-UHFFFAOYSA-N -1 3 329.268 4.172 20 0 EIADHM Cc1sc2[n-]c([C@@H](C)OC(=O)[C@@H](C)CC(C)C)nc(=O)c2c1C ZINC000765527003 1053620358 /nfs/dbraw/zinc/62/03/58/1053620358.db2.gz IJZWDHPWWHWSLC-GXSJLCMTSA-N -1 3 336.457 4.300 20 0 EIADHM COc1ccc(Cl)cc1NC(=O)c1cc([O-])c2ccccc2c1 ZINC000471574440 1053623834 /nfs/dbraw/zinc/62/38/34/1053623834.db2.gz PZSAKHPSAROOKM-UHFFFAOYSA-N -1 3 327.767 4.460 20 0 EIADHM O=S(=O)([N-]c1ccccc1F)c1ccc2cc(Cl)ccc2c1 ZINC001196413201 1053667316 /nfs/dbraw/zinc/66/73/16/1053667316.db2.gz ZBCWHQMHZCHFNO-UHFFFAOYSA-N -1 3 335.787 4.433 20 0 EIADHM O=C(Nc1cccnc1N1CCCCC1)c1cc([O-])c2ccccc2c1 ZINC000471784977 1053722300 /nfs/dbraw/zinc/72/23/00/1053722300.db2.gz CJWHUDAXLCKRIR-UHFFFAOYSA-N -1 3 347.418 4.183 20 0 EIADHM COc1cc(C)c(S(=O)(=O)[N-]c2c(C)cccc2C2CC2)c(C)c1 ZINC001196886798 1053788921 /nfs/dbraw/zinc/78/89/21/1053788921.db2.gz YTTJEGZMLWHJGY-UHFFFAOYSA-N -1 3 345.464 4.299 20 0 EIADHM O=C(c1cc2sccc2c([O-])c1)N1CCn2c(cc3ccccc32)C1 ZINC000794927918 1053796653 /nfs/dbraw/zinc/79/66/53/1053796653.db2.gz GRXBVUZEQVQMKP-UHFFFAOYSA-N -1 3 348.427 4.218 20 0 EIADHM CC(C)c1ccc([C@H](C)N2CC[C@](C)([N-]C(=O)C(F)(F)F)C2)cc1 ZINC001197168149 1053847836 /nfs/dbraw/zinc/84/78/36/1053847836.db2.gz QFAKUHHXLRQCMP-GUYCJALGSA-N -1 3 342.405 4.014 20 0 EIADHM O=S(=O)([N-]c1ccc(-c2ccccc2)cc1F)c1ccsc1 ZINC000671658076 1053920631 /nfs/dbraw/zinc/92/06/31/1053920631.db2.gz YGZJLZIGGODLEV-UHFFFAOYSA-N -1 3 333.409 4.355 20 0 EIADHM O=C(CCC(=O)c1ccc2ccccc2c1)[N-]OCc1ccccc1 ZINC000010319484 1053930622 /nfs/dbraw/zinc/93/06/22/1053930622.db2.gz XJXNXHZNRZQCPM-UHFFFAOYSA-N -1 3 333.387 4.051 20 0 EIADHM [O-]c1ccc(NC(=S)NCc2ccc(Cl)cc2)cc1Cl ZINC001197577565 1053931039 /nfs/dbraw/zinc/93/10/39/1053931039.db2.gz CSIMDSUKZFKSGD-UHFFFAOYSA-N -1 3 327.236 4.186 20 0 EIADHM Cc1cccc([N-]S(=O)(=O)Cc2cccc(Cl)c2Cl)c1F ZINC001197744345 1053988172 /nfs/dbraw/zinc/98/81/72/1053988172.db2.gz DHVSYZORXYXDFZ-UHFFFAOYSA-N -1 3 348.226 4.383 20 0 EIADHM CC(C)Oc1ccc(-c2ccccc2C(=O)Nc2ncccc2[O-])cc1 ZINC001197956258 1054036608 /nfs/dbraw/zinc/03/66/08/1054036608.db2.gz PZSUAPKQGRBLFG-UHFFFAOYSA-N -1 3 348.402 4.494 20 0 EIADHM CC[C@@H](/N=C/c1cc(Br)ccc1[O-])c1nccs1 ZINC000078022749 1054167349 /nfs/dbraw/zinc/16/73/49/1054167349.db2.gz XMIHMSWMRKGAHV-FNQVVVRFSA-N -1 3 325.231 4.181 20 0 EIADHM C[C@H](CC(=O)[N-]OCCCC(F)(F)F)c1c[nH]c2ccccc21 ZINC000871215392 1054170016 /nfs/dbraw/zinc/17/00/16/1054170016.db2.gz AIJZVFNYMJXXQW-LLVKDONJSA-N -1 3 328.334 4.052 20 0 EIADHM O=C(Nc1cccc(-c2ncc[nH]2)c1)c1cc([O-])c2ccccc2c1 ZINC000472026170 1054208594 /nfs/dbraw/zinc/20/85/94/1054208594.db2.gz RSWYMSMPOYSUGK-UHFFFAOYSA-N -1 3 329.359 4.188 20 0 EIADHM Cc1cccc(NC(=S)Nc2ccc([O-])c(Br)c2)c1 ZINC001198681922 1054234658 /nfs/dbraw/zinc/23/46/58/1054234658.db2.gz GFWWLNYASWWBPQ-UHFFFAOYSA-N -1 3 337.242 4.272 20 0 EIADHM Cc1ccc(OCCCC(=O)[N-]OC2CCCCC2)c(Cl)c1 ZINC000857493417 1054278778 /nfs/dbraw/zinc/27/87/78/1054278778.db2.gz ZDSZROKTPCVQEV-UHFFFAOYSA-N -1 3 325.836 4.188 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N(Cc1ccc(O)cc1)CC1CC1 ZINC000472351756 1054284657 /nfs/dbraw/zinc/28/46/57/1054284657.db2.gz RDGVHEWTHXEXGL-UHFFFAOYSA-N -1 3 347.414 4.303 20 0 EIADHM CC(=O)c1cccc(Cl)c1[N-]S(=O)(=O)c1ccc2occc2c1 ZINC001198870716 1054297902 /nfs/dbraw/zinc/29/79/02/1054297902.db2.gz RVJIGSHFPVYPBJ-UHFFFAOYSA-N -1 3 349.795 4.090 20 0 EIADHM O=C(OCc1cc(-c2ccccc2)on1)c1cc(Cl)c(Cl)[n-]1 ZINC000011810470 1054321320 /nfs/dbraw/zinc/32/13/20/1054321320.db2.gz HMKLLRWTIJOJCT-UHFFFAOYSA-N -1 3 337.162 4.334 20 0 EIADHM O=C(COC(=O)c1cc(Cl)c(Cl)[n-]1)c1cccc(Cl)c1 ZINC000011809037 1054322618 /nfs/dbraw/zinc/32/26/18/1054322618.db2.gz POERSSQJLMVESE-UHFFFAOYSA-N -1 3 332.570 4.015 20 0 EIADHM C[C@H](NCc1cccnc1OC1CCCC1)c1cccc([O-])c1F ZINC000872023262 1054337625 /nfs/dbraw/zinc/33/76/25/1054337625.db2.gz QVFRXUUSZIUMAG-ZDUSSCGKSA-N -1 3 330.403 4.099 20 0 EIADHM Cn1cc(NC(=O)c2cc([O-])c3ccccc3c2)c(-c2ccccc2)n1 ZINC000472482440 1054339825 /nfs/dbraw/zinc/33/98/25/1054339825.db2.gz DXYXHIOEBHKWRL-UHFFFAOYSA-N -1 3 343.386 4.198 20 0 EIADHM C[C@@H](NCc1ccc(N2CCC(C)CC2)nc1)c1cccc([O-])c1F ZINC000872024955 1054340977 /nfs/dbraw/zinc/34/09/77/1054340977.db2.gz FTXAYALRRRPVEM-OAHLLOKOSA-N -1 3 343.446 4.013 20 0 EIADHM Cc1ccc(F)c(C(=O)[N-]c2c3nsnc3ccc2Cl)c1F ZINC000776965174 1054360336 /nfs/dbraw/zinc/36/03/36/1054360336.db2.gz KTIUOSVIWCHNIS-UHFFFAOYSA-N -1 3 339.754 4.184 20 0 EIADHM C[C@@H](NCc1c(F)cccc1OC(F)F)c1cccc([O-])c1F ZINC000872049132 1054361272 /nfs/dbraw/zinc/36/12/72/1054361272.db2.gz PISQQZYKUUBQHC-SECBINFHSA-N -1 3 329.293 4.123 20 0 EIADHM Cc1nc(-c2ccco2)ccc1C(=O)Nc1ccc(Cl)cc1[O-] ZINC000339006827 1054362204 /nfs/dbraw/zinc/36/22/04/1054362204.db2.gz DEWWPBRWSHLJKJ-UHFFFAOYSA-N -1 3 328.755 4.261 20 0 EIADHM C[C@H](Nc1cccc(OC[C@H]2CCCO2)c1)c1cccc([O-])c1F ZINC000872057342 1054367553 /nfs/dbraw/zinc/36/75/53/1054367553.db2.gz XUXVCBSRQYHRJU-XJKSGUPXSA-N -1 3 331.387 4.262 20 0 EIADHM CC(C)Cn1ncc(N[C@H](C)c2cccc([O-])c2F)c1C(F)F ZINC000872060533 1054369997 /nfs/dbraw/zinc/36/99/97/1054369997.db2.gz QOJZCHVHMHYGPM-SNVBAGLBSA-N -1 3 327.350 4.495 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N1CCN(C2CC2)c2ccccc21 ZINC000472579832 1054373748 /nfs/dbraw/zinc/37/37/48/1054373748.db2.gz KYBZEMMQVGXRMY-UHFFFAOYSA-N -1 3 344.414 4.175 20 0 EIADHM C[C@@H](N[C@@H](C)c1cccc([O-])c1F)c1ccc(Br)cn1 ZINC000872067694 1054374562 /nfs/dbraw/zinc/37/45/62/1054374562.db2.gz BKCQEWDVLMPXPG-VHSXEESVSA-N -1 3 339.208 4.101 20 0 EIADHM O=C([O-])[C@]12CCC[C@H]1N(Cc1csc(C3CCCCC3)n1)CC2 ZINC000872169046 1054419845 /nfs/dbraw/zinc/41/98/45/1054419845.db2.gz GJCAPMGGTJMZKP-QAPCUYQASA-N -1 3 334.485 4.020 20 0 EIADHM O=C(Nc1cc([O-])cc(Cl)c1)c1cccn1Cc1ccccc1 ZINC001199778548 1054467332 /nfs/dbraw/zinc/46/73/32/1054467332.db2.gz MPAAUZABIATHIN-UHFFFAOYSA-N -1 3 326.783 4.148 20 0 EIADHM CCCC[C@H](C)C(=O)Nc1cccc(-c2nc(CC)cc(=O)[n-]2)c1 ZINC000282182448 1054502702 /nfs/dbraw/zinc/50/27/02/1054502702.db2.gz ORNSXBCCVIOGCG-ZDUSSCGKSA-N -1 3 327.428 4.176 20 0 EIADHM [O-]c1ccc(NC(=S)NC2CCCCCC2)cc1Br ZINC001199968854 1054506356 /nfs/dbraw/zinc/50/63/56/1054506356.db2.gz SMRZYXZOPSVBJG-UHFFFAOYSA-N -1 3 343.290 4.164 20 0 EIADHM CCc1ccc([O-])c(C(=O)N2C[C@H](C)C[C@@H]2c2ccccc2F)c1 ZINC001137070519 1054523290 /nfs/dbraw/zinc/52/32/90/1054523290.db2.gz DCQNNRMNLHXRMW-FZKQIMNGSA-N -1 3 327.399 4.317 20 0 EIADHM O=S(=O)([N-]c1cccc(F)c1F)c1ccc(Cl)c(Cl)c1 ZINC000060141113 1054662439 /nfs/dbraw/zinc/66/24/39/1054662439.db2.gz ARVGJXRUZWYWOA-UHFFFAOYSA-N -1 3 338.162 4.072 20 0 EIADHM Cc1ccc(NC(=O)c2cc([O-])ccc2Cl)cc1N1CCCC1 ZINC000874943593 1054745838 /nfs/dbraw/zinc/74/58/38/1054745838.db2.gz GBRVBBGCDREDEK-UHFFFAOYSA-N -1 3 330.815 4.207 20 0 EIADHM O=C(c1cc(=O)c2ccccc2[n-]1)N1CCC[C@@H]1CC1CCCCC1 ZINC000061570195 1054764900 /nfs/dbraw/zinc/76/49/00/1054764900.db2.gz BVFLYULPASGIAA-MRXNPFEDSA-N -1 3 338.451 4.103 20 0 EIADHM CCCCC1CCC(NC(=O)c2cc(=O)c3ccccc3[n-]2)CC1 ZINC000062517921 1054785667 /nfs/dbraw/zinc/78/56/67/1054785667.db2.gz OYWSFTPVSKSDLZ-UHFFFAOYSA-N -1 3 326.440 4.007 20 0 EIADHM O=C(Nc1ccccc1Br)Nc1c([O-])cccc1Cl ZINC001201978140 1054955370 /nfs/dbraw/zinc/95/53/70/1054955370.db2.gz GUOJFWMGOSELJM-UHFFFAOYSA-N -1 3 341.592 4.452 20 0 EIADHM C[C@H](NC(=O)Nc1ccc(Br)cc1[O-])c1ccccc1 ZINC001202505919 1055001374 /nfs/dbraw/zinc/00/13/74/1055001374.db2.gz AOKHBALBGITJTD-JTQLQIEISA-N -1 3 335.201 4.037 20 0 EIADHM Cc1cccc(C(=O)Cc2nc(=O)c3c4ccccc4sc3[n-]2)c1C ZINC000069579089 1055116552 /nfs/dbraw/zinc/11/65/52/1055116552.db2.gz QHOMIEUKPMVAIY-UHFFFAOYSA-N -1 3 348.427 4.180 20 0 EIADHM Cc1ccc([C@@H]2CCCN2Cc2nnc(-c3ccccc3[O-])o2)cc1 ZINC000877891792 1055145532 /nfs/dbraw/zinc/14/55/32/1055145532.db2.gz FPQDREONSQDGBP-KRWDZBQOSA-N -1 3 335.407 4.088 20 0 EIADHM CCN(Cc1nnc(-c2ccccc2[O-])o1)[C@@H](C)c1ccc(F)cc1 ZINC000877990611 1055171281 /nfs/dbraw/zinc/17/12/81/1055171281.db2.gz IBAFCSYWNNWQIG-ZDUSSCGKSA-N -1 3 341.386 4.164 20 0 EIADHM COc1cc(NC(=O)c2cc([O-])c3ccccc3c2)ccc1Cl ZINC000473247384 1055222310 /nfs/dbraw/zinc/22/23/10/1055222310.db2.gz YKLFRFVEMOQSES-UHFFFAOYSA-N -1 3 327.767 4.460 20 0 EIADHM CCC(C)(C)c1ccc(S(=O)(=O)[N-]c2cccnc2Cl)cc1 ZINC000107345073 1055225744 /nfs/dbraw/zinc/22/57/44/1055225744.db2.gz FGRBAWFVZUZAPF-UHFFFAOYSA-N -1 3 338.860 4.223 20 0 EIADHM O=C(N[C@H]1CCC[C@@H]1Cc1ccccc1)c1cc(=O)c2ccccc2[n-]1 ZINC000265709291 1055643831 /nfs/dbraw/zinc/64/38/31/1055643831.db2.gz UQFMMJQDEINGJE-AEFFLSMTSA-N -1 3 346.430 4.082 20 0 EIADHM O=C([O-])c1ccc(CN2CCC(CCc3ccc(F)cc3F)CC2)o1 ZINC000656191475 1056690285 /nfs/dbraw/zinc/69/02/85/1056690285.db2.gz LYBDUSSIYBAHIJ-UHFFFAOYSA-N -1 3 349.377 4.101 20 0 EIADHM Nc1ccc(Cl)cc1Nc1cc(Br)cc(F)c1[O-] ZINC001212441836 1056695036 /nfs/dbraw/zinc/69/50/36/1056695036.db2.gz XTVPUOZMYPBNSG-UHFFFAOYSA-N -1 3 331.572 4.273 20 0 EIADHM Cc1ccc(C)c([N-]S(=O)(=O)c2ccc(OC(F)(F)F)cc2)c1 ZINC000007052219 1056761419 /nfs/dbraw/zinc/76/14/19/1056761419.db2.gz DTANAOKTBITYPH-UHFFFAOYSA-N -1 3 345.342 4.003 20 0 EIADHM Cc1cc(=O)[n-]c(-c2cccc(OC(=O)c3cc4ccccc4o3)c2)n1 ZINC000744218825 1059334638 /nfs/dbraw/zinc/33/46/38/1059334638.db2.gz UDMMKRWYRHFSQH-UHFFFAOYSA-N -1 3 346.342 4.123 20 0 EIADHM O=C([N-]c1nnc(-c2ccc(Cl)cc2)s1)c1ccoc1Cl ZINC000192342314 1060204047 /nfs/dbraw/zinc/20/40/47/1060204047.db2.gz GERBOYGUTWWEQA-UHFFFAOYSA-N -1 3 340.191 4.357 20 0 EIADHM COc1c(Cl)ccc(Nc2cc(=O)n(-c3ccccc3)[n-]2)c1F ZINC001212582978 1060538398 /nfs/dbraw/zinc/53/83/98/1060538398.db2.gz DWFKNXCQJWXETE-UHFFFAOYSA-N -1 3 333.750 4.123 20 0 EIADHM COc1cccc(Cn2ncc(C)c2Nc2ccc(Cl)c([O-])c2)c1 ZINC001212590431 1060826154 /nfs/dbraw/zinc/82/61/54/1060826154.db2.gz MFPJMBYECHYEME-UHFFFAOYSA-N -1 3 343.814 4.351 20 0 EIADHM CC(C)(C)OC(=O)c1ccc(Nc2ccc(Cl)c([O-])c2)c(O)c1 ZINC001212594874 1060972152 /nfs/dbraw/zinc/97/21/52/1060972152.db2.gz AOTLPFMFOZLSNN-UHFFFAOYSA-N -1 3 335.787 4.450 20 0 EIADHM O=C(c1ccccc1[O-])N1CC[C@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000767138906 1061124034 /nfs/dbraw/zinc/12/40/34/1061124034.db2.gz QWGKHEWBFFTLPJ-ZDUSSCGKSA-N -1 3 335.325 4.041 20 0 EIADHM O=S(=O)([N-]c1cc(F)ccc1F)c1ccccc1-c1ccccc1 ZINC000071848675 215878478 /nfs/dbraw/zinc/87/84/78/215878478.db2.gz MGZDMTCDDKBFRQ-UHFFFAOYSA-N -1 3 345.370 4.433 20 0 EIADHM COc1cc(CNc2ccc(Cl)cc2)cc(Br)c1[O-] ZINC000019921023 212083786 /nfs/dbraw/zinc/08/37/86/212083786.db2.gz CLMZMQXPMNGASV-UHFFFAOYSA-N -1 3 342.620 4.429 20 0 EIADHM CCCc1cc(=O)[n-]c(C(=Cc2ccc(OC)c(OCC)c2)CC)n1 ZINC000193618650 1032164695 /nfs/dbraw/zinc/16/46/95/1032164695.db2.gz JYLASTWFIHJNDY-PTNGSMBKSA-N -1 3 342.439 4.080 20 0 EIADHM O=C([N-]c1nnc(Cc2ccccc2)s1)c1c(F)cccc1Cl ZINC000005549462 1032308238 /nfs/dbraw/zinc/30/82/38/1032308238.db2.gz GLNLDBIYAYKADW-UHFFFAOYSA-N -1 3 347.802 4.174 20 0 EIADHM O=C(Nc1ccc(Cl)cc1[O-])c1ccc(N2CCCC2)c(F)c1 ZINC000532838282 1032343204 /nfs/dbraw/zinc/34/32/04/1032343204.db2.gz XDUQZFIHKVTWMG-UHFFFAOYSA-N -1 3 334.778 4.037 20 0 EIADHM O=C(Nc1ccc(Cl)cc1[O-])c1ccc(N2CCCCCC2)nc1 ZINC000533159478 1032514454 /nfs/dbraw/zinc/51/44/54/1032514454.db2.gz DEKUUIUAEBFCNZ-UHFFFAOYSA-N -1 3 345.830 4.073 20 0 EIADHM O=C([O-])c1ccccc1C1CCN(Cc2ccc(Cl)cc2)CC1 ZINC000372650490 1032581801 /nfs/dbraw/zinc/58/18/01/1032581801.db2.gz PKRADRHPRSCKLJ-UHFFFAOYSA-N -1 3 329.827 4.418 20 0 EIADHM O=C1CCCCC[C@H]1Sc1nnc([N-]c2ccccc2F)s1 ZINC000029328625 1019018387 /nfs/dbraw/zinc/01/83/87/1019018387.db2.gz IMYDOUUZNAXNGO-CYBMUJFWSA-N -1 3 337.445 4.415 20 0 EIADHM CCc1cc(=O)[n-]c(CSCc2nc(-c3ccsc3)oc2C)n1 ZINC000125716261 1019630228 /nfs/dbraw/zinc/63/02/28/1019630228.db2.gz QEPBNAUOOAQMKW-UHFFFAOYSA-N -1 3 347.465 4.203 20 0 EIADHM CC(C)C1CCN(Cc2ccc(C(=O)[O-])cc2Br)CC1 ZINC000232541033 1019822161 /nfs/dbraw/zinc/82/21/61/1019822161.db2.gz VDSQADOZYCFLLV-UHFFFAOYSA-N -1 3 340.261 4.015 20 0 EIADHM O=S(=O)([N-]c1cccc(Cl)c1F)c1ccc(F)c(Cl)c1 ZINC000016100687 1020085978 /nfs/dbraw/zinc/08/59/78/1020085978.db2.gz YLUYRRUYHGLIHO-UHFFFAOYSA-N -1 3 338.162 4.072 20 0 EIADHM O=C1CCc2ccc(-c3nc4cc(C(F)(F)F)ccc4c(=O)[n-]3)cc21 ZINC000579895138 1020531590 /nfs/dbraw/zinc/53/15/90/1020531590.db2.gz HHZXXUQLADUHLB-UHFFFAOYSA-N -1 3 344.292 4.150 20 0 EIADHM CC1(C)C[C@@H](NC(=O)c2cc([O-])ccc2Cl)c2cc(F)ccc2O1 ZINC000652820053 1020566734 /nfs/dbraw/zinc/56/67/34/1020566734.db2.gz RTUPPWLSWMVSGS-OAHLLOKOSA-N -1 3 349.789 4.217 20 0 EIADHM Cc1ccnc(-c2cccc(NC(=O)c3cc([O-])ccc3Cl)c2)n1 ZINC000340414583 1020956622 /nfs/dbraw/zinc/95/66/22/1020956622.db2.gz ISUAZGJXNGBJBS-UHFFFAOYSA-N -1 3 339.782 4.063 20 0 EIADHM [O-]c1c(Cl)cccc1Nc1cc(F)ccc1OC[C@@H]1CCCO1 ZINC001210222077 1020959621 /nfs/dbraw/zinc/95/96/21/1020959621.db2.gz MTQYYAAFLMLRJM-LBPRGKRZSA-N -1 3 337.778 4.486 20 0 EIADHM O=c1nc(-c2ccc(Cl)cn2)[n-]c2scc(-c3ccccc3)c21 ZINC000086963621 1021049625 /nfs/dbraw/zinc/04/96/25/1021049625.db2.gz SKMJEKDIRKLVCK-UHFFFAOYSA-N -1 3 339.807 4.367 20 0 EIADHM O=C(Nc1ccc2c(cnn2C(F)F)c1)c1cc([O-])ccc1Cl ZINC000685793269 1021284981 /nfs/dbraw/zinc/28/49/81/1021284981.db2.gz BOQBXQDIOWOFBO-UHFFFAOYSA-N -1 3 337.713 4.043 20 0 EIADHM [O-]C(=NO[C@H]1CCCCO1)Nc1ccc2c(c1)oc1ccccc12 ZINC000156017639 1021645043 /nfs/dbraw/zinc/64/50/43/1021645043.db2.gz IZMQGZIZJVVHCM-KRWDZBQOSA-N -1 3 326.352 4.166 20 0 EIADHM O=C([N-]O[C@H]1CCCCO1)Nc1ccc2c(c1)oc1ccccc12 ZINC000156017639 1021645060 /nfs/dbraw/zinc/64/50/60/1021645060.db2.gz IZMQGZIZJVVHCM-KRWDZBQOSA-N -1 3 326.352 4.166 20 0 EIADHM O=C(Nc1nc2c(s1)CCCCCC2)c1cc([O-])ccc1Cl ZINC000431728958 1021675746 /nfs/dbraw/zinc/67/57/46/1021675746.db2.gz ZHPMYTZAGFIXCJ-UHFFFAOYSA-N -1 3 336.844 4.413 20 0 EIADHM [O-]c1cccc(Nc2cc(Br)cn3ccnc23)c1Cl ZINC001210851817 1021797911 /nfs/dbraw/zinc/79/79/11/1021797911.db2.gz MBKOLUALSSYNHX-UHFFFAOYSA-N -1 3 338.592 4.199 20 0 EIADHM O=C(c1cc([O-])ccc1Cl)N1CCC[C@@H](c2ccccc2)CC1 ZINC000431785614 1021843572 /nfs/dbraw/zinc/84/35/72/1021843572.db2.gz AMWIECMRQNOUBX-OAHLLOKOSA-N -1 3 329.827 4.456 20 0 EIADHM O=C([O-])c1coc(CN2CCC(CCc3ccc(F)cc3F)CC2)c1 ZINC000656191020 1021895668 /nfs/dbraw/zinc/89/56/68/1021895668.db2.gz AKSPJXPVLASUPF-UHFFFAOYSA-N -1 3 349.377 4.101 20 0 EIADHM Cc1ccc(CN[C@@H](CC(=O)[O-])c2cccc(C(F)(F)F)c2)cc1 ZINC000340677301 1021898783 /nfs/dbraw/zinc/89/87/83/1021898783.db2.gz LYHABBAFKSHCGI-INIZCTEOSA-N -1 3 337.341 4.319 20 0 EIADHM CCC[C@H]1[C@@H](C)CCCN1Cc1nc2cc(C(=O)[O-])ccc2n1CC ZINC000580560855 1022213628 /nfs/dbraw/zinc/21/36/28/1022213628.db2.gz AJMDRTIRFOUMPS-YOEHRIQHSA-N -1 3 343.471 4.155 20 0 EIADHM Cc1cc(C)cc(-c2cc(=NC(=O)c3ccccc3Cl)[nH][n-]2)c1 ZINC000512535020 1033041917 /nfs/dbraw/zinc/04/19/17/1033041917.db2.gz BOQLNMBJSJOTEA-UHFFFAOYSA-N -1 3 325.799 4.021 20 0 EIADHM Cc1cc(C(=O)[N-]c2nc(-c3cccs3)ns2)c(F)cc1F ZINC000182133772 1022311856 /nfs/dbraw/zinc/31/18/56/1022311856.db2.gz FDYUHZYTAYECJN-UHFFFAOYSA-N -1 3 337.376 4.106 20 0 EIADHM CCCc1cc(=O)[n-]c(C(=Cc2cnc(-c3ccccc3)nc2)CC)n1 ZINC000684034045 1022396392 /nfs/dbraw/zinc/39/63/92/1022396392.db2.gz VPBKPTFYFRAQFX-WJDWOHSUSA-N -1 3 346.434 4.130 20 0 EIADHM CCS[C@H]1CC[C@H](N(C)Cc2cc(C(=O)[O-])ccc2Cl)C1 ZINC000580777963 1022487669 /nfs/dbraw/zinc/48/76/69/1022487669.db2.gz AUHBBCROVOBRBZ-KBPBESRZSA-N -1 3 327.877 4.144 20 0 EIADHM Cc1cc(C)cc(-c2nnc(S[C@@H](C)c3nc(C)cc(=O)[n-]3)o2)c1 ZINC000155905565 1022668153 /nfs/dbraw/zinc/66/81/53/1022668153.db2.gz KAXJZQGQPFFVCT-LBPRGKRZSA-N -1 3 342.424 4.011 20 0 EIADHM [O-]C(=NO[C@@H]1CCCCO1)Nc1cccc(COC2CCCCC2)c1 ZINC000155907138 1022674402 /nfs/dbraw/zinc/67/44/02/1022674402.db2.gz FAPJOXNEAVKXJI-GOSISDBHSA-N -1 3 348.443 4.116 20 0 EIADHM O=C([N-]O[C@@H]1CCCCO1)Nc1cccc(COC2CCCCC2)c1 ZINC000155907138 1022674414 /nfs/dbraw/zinc/67/44/14/1022674414.db2.gz FAPJOXNEAVKXJI-GOSISDBHSA-N -1 3 348.443 4.116 20 0 EIADHM [O-]c1cccc(CN2CCC[C@H]2c2ccc(O)cc2)c1Br ZINC000656425320 1022880371 /nfs/dbraw/zinc/88/03/71/1022880371.db2.gz PHWIERHLHLNGOX-HNNXBMFYSA-N -1 3 348.240 4.197 20 0 EIADHM Cc1cc(S(=O)(=O)[N-]c2ccc(OC(C)C)c(C)c2)ccc1F ZINC000525533560 1022889852 /nfs/dbraw/zinc/88/98/52/1022889852.db2.gz KYBNKUQAPDWIHN-UHFFFAOYSA-N -1 3 337.416 4.031 20 0 EIADHM CCC(C)(C)c1ccc(S(=O)(=O)[N-]c2ccc(C)c(O)c2C)cc1 ZINC000467078478 1022973825 /nfs/dbraw/zinc/97/38/25/1022973825.db2.gz IKLRSLDOPCGZFX-UHFFFAOYSA-N -1 3 347.480 4.497 20 0 EIADHM Cc1noc(C2CC2)c1[N-]C(=O)c1ccc(C(F)(F)F)nc1Cl ZINC000185188873 1023019344 /nfs/dbraw/zinc/01/93/44/1023019344.db2.gz WDXNSVIXMTZTEJ-UHFFFAOYSA-N -1 3 345.708 4.180 20 0 EIADHM CC(C)[C@@H](CNC(=O)c1cc(=O)c2ccccc2[n-]1)Cc1ccccc1 ZINC000276259481 1023277840 /nfs/dbraw/zinc/27/78/40/1023277840.db2.gz RQZRUYPKPOKPBR-QGZVFWFLSA-N -1 3 348.446 4.185 20 0 EIADHM C[C@@H](CC(=O)[O-])NCc1nc(-c2cc(Cl)ccc2Cl)cs1 ZINC000414639695 1023307266 /nfs/dbraw/zinc/30/72/66/1023307266.db2.gz QJJHUYQMOIWIFY-QMMMGPOBSA-N -1 3 345.251 4.070 20 0 EIADHM Cc1cc2cc(CN[C@H]3C[C@H](C(=O)[O-])c4ccccc43)oc2cc1C ZINC000417631274 1023383067 /nfs/dbraw/zinc/38/30/67/1023383067.db2.gz RYURYVBQMXINDT-OALUTQOASA-N -1 3 335.403 4.452 20 0 EIADHM CCCCOc1ccccc1CN[C@@H]1C[C@@H](C(=O)[O-])c2ccccc21 ZINC000417628650 1023387652 /nfs/dbraw/zinc/38/76/52/1023387652.db2.gz PPJFWSBOGPMKKR-RTBURBONSA-N -1 3 339.435 4.268 20 0 EIADHM C[C@H](CCC[C@H](C)NCc1csc(-c2ccsc2)n1)C(=O)[O-] ZINC000388324374 1023456416 /nfs/dbraw/zinc/45/64/16/1023456416.db2.gz DWLKVSLUGRHQBB-NEPJUHHUSA-N -1 3 338.498 4.241 20 0 EIADHM O=C([O-])[C@@H]1CCN(Cc2cccc(Cl)c2Cl)[C@@H]2CCCC[C@@H]12 ZINC000656763462 1023503079 /nfs/dbraw/zinc/50/30/79/1023503079.db2.gz FXSVXTQIAHTRIQ-GZBFAFLISA-N -1 3 342.266 4.459 20 0 EIADHM O=C([O-])[C@@H]1CCN(Cc2cccc(Cl)c2Cl)[C@H]2CCCC[C@H]12 ZINC000656763463 1023503456 /nfs/dbraw/zinc/50/34/56/1023503456.db2.gz FXSVXTQIAHTRIQ-NFAWXSAZSA-N -1 3 342.266 4.459 20 0 EIADHM O=C([O-])[C@@H](c1cccc(Cl)c1Cl)N1CCC[C@H](CCF)C1 ZINC000656764664 1023504920 /nfs/dbraw/zinc/50/49/20/1023504920.db2.gz ZYJUMLLCBUDPIX-QMTHXVAHSA-N -1 3 334.218 4.191 20 0 EIADHM O=C([O-])c1ccc(CN2CCCCC[C@H]2/C=C\c2cccs2)nc1 ZINC000581731560 1023655768 /nfs/dbraw/zinc/65/57/68/1023655768.db2.gz GGIHUXSNQJHNLH-IBSYWUHOSA-N -1 3 342.464 4.299 20 0 EIADHM Cc1cc(=O)[n-]c(-c2cccc(OC(=O)C3C[C@@H](C)C[C@H](C)C3)c2)n1 ZINC000780391299 1023765587 /nfs/dbraw/zinc/76/55/87/1023765587.db2.gz UNVFFJQGDKHOIV-STQMWFEESA-N -1 3 340.423 4.135 20 0 EIADHM O=C(Cc1csc2ccc(Cl)cc12)[N-]OCCC(F)(F)F ZINC000162741390 1023778202 /nfs/dbraw/zinc/77/82/02/1023778202.db2.gz CUTDOBVHMZZQMG-UHFFFAOYSA-N -1 3 337.750 4.097 20 0 EIADHM CC(C)(C)OCc1cccc(CNCc2c(F)ccc([O-])c2F)c1 ZINC000510487339 1023846985 /nfs/dbraw/zinc/84/69/85/1023846985.db2.gz AQGDWIQXGSYLJH-UHFFFAOYSA-N -1 3 335.394 4.275 20 0 EIADHM Cc1cc(Nc2cc(Br)cc(F)c2[O-])cc(O)c1F ZINC001216082134 1023893327 /nfs/dbraw/zinc/89/33/27/1023893327.db2.gz DOVOGALXHGYFBB-UHFFFAOYSA-N -1 3 330.128 4.191 20 0 EIADHM O=C([N-]c1cccc(Cl)c1SCC(F)F)c1ncccc1F ZINC001126088816 1024147580 /nfs/dbraw/zinc/14/75/80/1024147580.db2.gz RUTYPUHLYVELOQ-UHFFFAOYSA-N -1 3 346.761 4.484 20 0 EIADHM CC(C)(CC1CCCCCC1)NC(=O)c1cc(=O)c2ccccc2[n-]1 ZINC000548393835 1024165914 /nfs/dbraw/zinc/16/59/14/1024165914.db2.gz OOTFFIVSSRNKIR-UHFFFAOYSA-N -1 3 340.467 4.397 20 0 EIADHM CC(C)c1c(C(=O)Nc2cccc([O-])c2F)cnn1-c1ccccc1 ZINC000535658185 1024394344 /nfs/dbraw/zinc/39/43/44/1024394344.db2.gz LJDSLSVPXXLXNZ-UHFFFAOYSA-N -1 3 339.370 4.093 20 0 EIADHM C[C@@H]1CO[C@@H](c2ccccc2Cl)CN1Cc1cc([O-])cc(F)c1 ZINC000473142203 1024457958 /nfs/dbraw/zinc/45/79/58/1024457958.db2.gz PSQLKEQAGVBEHU-KZULUSFZSA-N -1 3 335.806 4.147 20 0 EIADHM C[C@@H](NCc1cccc([O-])c1Cl)c1cccc(OC(F)F)c1 ZINC000293974256 1024734208 /nfs/dbraw/zinc/73/42/08/1024734208.db2.gz DFGVBXPMCQHOJO-SNVBAGLBSA-N -1 3 327.758 4.498 20 0 EIADHM O=C(Nc1ccc(COCc2ccccc2)cc1)c1c([O-])cccc1O ZINC000092122977 1024738635 /nfs/dbraw/zinc/73/86/35/1024738635.db2.gz BMXIHNPFDSHPTQ-UHFFFAOYSA-N -1 3 349.386 4.067 20 0 EIADHM COc1ccc(C(=O)N2CCC(c3ccc(Cl)cc3)CC2)c([O-])c1 ZINC000185279361 1024997812 /nfs/dbraw/zinc/99/78/12/1024997812.db2.gz GMFCQNWWTJOYTO-UHFFFAOYSA-N -1 3 345.826 4.074 20 0 EIADHM O=C([O-])C[C@@H](NCc1cccc(C(F)(F)F)c1)c1ccsc1 ZINC000277053329 1025014413 /nfs/dbraw/zinc/01/44/13/1025014413.db2.gz SOTQKXGANMPLLN-CYBMUJFWSA-N -1 3 329.343 4.073 20 0 EIADHM Cc1cc(=O)[n-]c([C@H](C)SCc2ccc(Br)cc2)n1 ZINC000610861041 1025076991 /nfs/dbraw/zinc/07/69/91/1025076991.db2.gz REZHXDPTXLCRFV-JTQLQIEISA-N -1 3 339.258 4.248 20 0 EIADHM O=C([N-]c1csnc1-c1ccccc1)c1coc2c1C(=O)CCC2 ZINC001126237440 1025143544 /nfs/dbraw/zinc/14/35/44/1025143544.db2.gz SIEZVMXTFSTXRL-UHFFFAOYSA-N -1 3 338.388 4.174 20 0 EIADHM Cc1coc(-c2cc([N-]S(=O)(=O)c3ccc(C)cc3)ccc2C)n1 ZINC000150804303 1025211686 /nfs/dbraw/zinc/21/16/86/1025211686.db2.gz QKEHFELXHLTKSR-UHFFFAOYSA-N -1 3 342.420 4.068 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1occc1COc1ccccc1 ZINC000067139115 1025226279 /nfs/dbraw/zinc/22/62/79/1025226279.db2.gz CEGAOTTUMWGWER-UHFFFAOYSA-N -1 3 343.766 4.470 20 0 EIADHM Cc1csc(C2(NC(=O)c3cc([O-])ccc3Cl)CCCC2)n1 ZINC000277288914 1025498114 /nfs/dbraw/zinc/49/81/14/1025498114.db2.gz AATNUQIBZADSHD-UHFFFAOYSA-N -1 3 336.844 4.010 20 0 EIADHM O=C(CSc1ccc(F)c(F)c1)Nc1cc(Cl)ccc1[O-] ZINC000303419087 1025522637 /nfs/dbraw/zinc/52/26/37/1025522637.db2.gz UFKKSRXFNOZZHL-UHFFFAOYSA-N -1 3 329.755 4.055 20 0 EIADHM Cc1ccc(-c2nc(CN[C@H](C)CCCCC(=O)[O-])cs2)cc1 ZINC000426633024 1025819777 /nfs/dbraw/zinc/81/97/77/1025819777.db2.gz ATXZPPUOBQFNGR-CQSZACIVSA-N -1 3 332.469 4.242 20 0 EIADHM CC(C)(C)c1cc(C(=O)[N-]c2csnc2-c2ccccc2)no1 ZINC001126306446 1025829256 /nfs/dbraw/zinc/82/92/56/1025829256.db2.gz PXSSZNLKGPYYCP-UHFFFAOYSA-N -1 3 327.409 4.348 20 0 EIADHM CC(C)c1ccc(C2(C(=O)NCc3ncccc3[O-])CCCC2)cc1 ZINC000473629774 1025927779 /nfs/dbraw/zinc/92/77/79/1025927779.db2.gz KTTHHLCSIDRPKE-UHFFFAOYSA-N -1 3 338.451 4.039 20 0 EIADHM O=C(Cc1ccc(OC(F)(F)F)cc1)Nc1cc(Cl)ccc1[O-] ZINC000111210277 1026098070 /nfs/dbraw/zinc/09/80/70/1026098070.db2.gz GSEDVADBGQMGJN-UHFFFAOYSA-N -1 3 345.704 4.125 20 0 EIADHM CC1(C)CC[C@H](NC(=O)c2c[n-]c3ccccc3c2=O)c2ccccc21 ZINC000344280759 1026211648 /nfs/dbraw/zinc/21/16/48/1026211648.db2.gz IZSYWSGZYREMEW-IBGZPJMESA-N -1 3 346.430 4.071 20 0 EIADHM C[C@H](c1ncc(-c2ccc(Cl)cc2)o1)N1CCC[C@](C)(C(=O)[O-])C1 ZINC000563277258 1026310929 /nfs/dbraw/zinc/31/09/29/1026310929.db2.gz NMKYEBYKMSHFBU-XIKOKIGWSA-N -1 3 348.830 4.243 20 0 EIADHM CO[C@H](c1ccccc1Cl)[C@H](C)NCc1c(F)ccc([O-])c1F ZINC000512216078 1026490490 /nfs/dbraw/zinc/49/04/90/1026490490.db2.gz ADUDVOGXVIOVFR-BTDLBPIBSA-N -1 3 341.785 4.190 20 0 EIADHM O=C([O-])C[C@@H](NCc1cc(Cl)cc2cccnc21)c1ccsc1 ZINC000426689522 1026492082 /nfs/dbraw/zinc/49/20/82/1026492082.db2.gz ZFXOMRYNDJQMML-OAHLLOKOSA-N -1 3 346.839 4.255 20 0 EIADHM COc1ccc([C@@H](CCC(=O)[O-])NCc2ccccc2Cl)cc1 ZINC000426724843 1026505214 /nfs/dbraw/zinc/50/52/14/1026505214.db2.gz WHIKIUAKMYYRFG-QGZVFWFLSA-N -1 3 333.815 4.044 20 0 EIADHM CCSc1cccc(CN[C@@H](C(=O)[O-])c2cccc(Cl)c2)c1 ZINC000426737083 1026518428 /nfs/dbraw/zinc/51/84/28/1026518428.db2.gz LSSLPPBMUFZNBO-MRXNPFEDSA-N -1 3 335.856 4.368 20 0 EIADHM CC(C)c1ccc([C@@H](CC(=O)[O-])NCc2cc(F)cc(F)c2)cc1 ZINC000426805653 1026560238 /nfs/dbraw/zinc/56/02/38/1026560238.db2.gz DLBDAFXLXVXIQB-GOSISDBHSA-N -1 3 333.378 4.394 20 0 EIADHM CC(C)CCOc1ccc(CN[C@@H](C(=O)[O-])c2ccsc2)cc1 ZINC000426830629 1026592593 /nfs/dbraw/zinc/59/25/93/1026592593.db2.gz ZQLCUIOUJJDYGO-QGZVFWFLSA-N -1 3 333.453 4.089 20 0 EIADHM CC[C@@H](NC(=O)CCCc1ccc([O-])c(F)c1)c1ccc(OC)cc1 ZINC000344784816 1026595911 /nfs/dbraw/zinc/59/59/11/1026595911.db2.gz ZJPQBGQRHNHLFW-GOSISDBHSA-N -1 3 345.414 4.130 20 0 EIADHM CC(C)(C)c1nnc([N-]C(=O)c2scnc2C2CCCC2)s1 ZINC000184156522 1026600168 /nfs/dbraw/zinc/60/01/68/1026600168.db2.gz SPXROGANOACWTD-UHFFFAOYSA-N -1 3 336.486 4.202 20 0 EIADHM Cc1ccc([O-])c(C(=O)Nc2ccccc2-c2ncc3n2CCCC3)c1 ZINC000684864566 1026605297 /nfs/dbraw/zinc/60/52/97/1026605297.db2.gz QEVJFVZEEODGPO-UHFFFAOYSA-N -1 3 347.418 4.153 20 0 EIADHM COC(=O)c1cnc(S[C@H](C)c2ccc(Cl)cc2Cl)[n-]1 ZINC000432669834 1026698053 /nfs/dbraw/zinc/69/80/53/1026698053.db2.gz REKKAHSOYFQISC-SSDOTTSWSA-N -1 3 331.224 4.356 20 0 EIADHM O=C(Nc1ccc2c(c1)OC1(CCCC1)O2)c1cc([O-])ccc1Cl ZINC000277644288 1026711829 /nfs/dbraw/zinc/71/18/29/1026711829.db2.gz ZSDUEOIVTFCESL-UHFFFAOYSA-N -1 3 345.782 4.339 20 0 EIADHM CCCc1ccc(S(=O)(=O)[N-]c2ccc(OCC)cc2C)cc1 ZINC000511159099 1026789968 /nfs/dbraw/zinc/78/99/68/1026789968.db2.gz YEACJNNYOSWOGO-UHFFFAOYSA-N -1 3 333.453 4.147 20 0 EIADHM Cc1cc([N-]S(=O)(=O)c2c(C)cccc2F)c(Cl)cc1F ZINC000507570154 1026835713 /nfs/dbraw/zinc/83/57/13/1026835713.db2.gz YBOKFTKRLZOWLI-UHFFFAOYSA-N -1 3 331.771 4.036 20 0 EIADHM Cc1ccc(F)c(S(=O)(=O)[N-]c2cc(C)c(F)cc2Cl)c1 ZINC000507612532 1026854198 /nfs/dbraw/zinc/85/41/98/1026854198.db2.gz DQUKQTDFWRJTER-UHFFFAOYSA-N -1 3 331.771 4.036 20 0 EIADHM CC(C)c1ccc(CCCNC(=O)c2c[n-]c3ccccc3c2=O)cc1 ZINC000116828085 1026956625 /nfs/dbraw/zinc/95/66/25/1026956625.db2.gz BJOMCMBZTBTJGY-UHFFFAOYSA-N -1 3 348.446 4.014 20 0 EIADHM CC[C@H]1Cc2ccccc2CN1C(=O)CCCc1ccc([O-])c(F)c1 ZINC000469559073 1027078191 /nfs/dbraw/zinc/07/81/91/1027078191.db2.gz SVBMRZMEIGKDPO-SFHVURJKSA-N -1 3 341.426 4.218 20 0 EIADHM O=C(Nc1ccc([O-])c(C(F)(F)F)c1)c1cc2c(cccc2F)[nH]1 ZINC000440997194 1027179246 /nfs/dbraw/zinc/17/92/46/1027179246.db2.gz DPLDXTRQNMWNSJ-UHFFFAOYSA-N -1 3 338.260 4.284 20 0 EIADHM [O-]c1c(F)cc(Nc2ccnc(Cl)c2Br)cc1F ZINC001213373555 1027330796 /nfs/dbraw/zinc/33/07/96/1027330796.db2.gz LCXRUPFQCIJXAW-UHFFFAOYSA-N -1 3 335.535 4.225 20 0 EIADHM Cc1ccccc1C[C@H](C)N(C)Cc1cccc(C(=O)[O-])c1Cl ZINC000566361341 1027380237 /nfs/dbraw/zinc/38/02/37/1027380237.db2.gz JAOFRRAJMRFOMB-AWEZNQCLSA-N -1 3 331.843 4.410 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)N[C@@H]1CCC[C@@H](c2ccccc2)C1 ZINC000487486413 1027476806 /nfs/dbraw/zinc/47/68/06/1027476806.db2.gz POIJNTJMNCXWMY-IAGOWNOFSA-N -1 3 342.414 4.057 20 0 EIADHM COc1ccc(CN(Cc2ccccc2)C(=O)c2ccccc2[O-])cc1 ZINC000013831432 1027478106 /nfs/dbraw/zinc/47/81/06/1027478106.db2.gz CUAVLLRPSBUYNT-UHFFFAOYSA-N -1 3 347.414 4.243 20 0 EIADHM O=S(=O)(CCc1ccccc1)[N-]c1ccccc1-c1cccs1 ZINC000614774861 1027639022 /nfs/dbraw/zinc/63/90/22/1027639022.db2.gz DYDREPAJZZXHJV-UHFFFAOYSA-N -1 3 343.473 4.400 20 0 EIADHM CC(C)c1ccc([C@@H](C)CC(=O)Nc2ccc(-c3nnn[n-]3)cc2)cc1 ZINC000523152195 1027845600 /nfs/dbraw/zinc/84/56/00/1027845600.db2.gz TYNFWCLLMPLNHE-AWEZNQCLSA-N -1 3 349.438 4.122 20 0 EIADHM CC(C)c1ccc([C@@H](C)CC(=O)Nc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC000523152195 1027845604 /nfs/dbraw/zinc/84/56/04/1027845604.db2.gz TYNFWCLLMPLNHE-AWEZNQCLSA-N -1 3 349.438 4.122 20 0 EIADHM CC(C)c1ccc([C@@H](C)CC(=O)N=c2cc(-c3ccncc3)[n-][nH]2)cc1 ZINC000523409189 1028066181 /nfs/dbraw/zinc/06/61/81/1028066181.db2.gz MGRYWGSEWYNFET-HNNXBMFYSA-N -1 3 348.450 4.149 20 0 EIADHM CC(C)(C)[C@@H](NC(=O)NCc1ccc([O-])c(F)c1)c1ccc(F)cc1 ZINC000523467338 1028132337 /nfs/dbraw/zinc/13/23/37/1028132337.db2.gz SMMPKDATVBVQKT-KRWDZBQOSA-N -1 3 348.393 4.257 20 0 EIADHM CCOc1cc(-c2noc(-c3cc4ccccc4cc3[O-])n2)ccc1O ZINC000445424975 1028524992 /nfs/dbraw/zinc/52/49/92/1028524992.db2.gz AFOZQMURQBUPMY-UHFFFAOYSA-N -1 3 348.358 4.367 20 0 EIADHM CC[C@@H](c1ccccc1OC)N(C)C(=O)c1cc([O-])ccc1Cl ZINC000583337878 1028537257 /nfs/dbraw/zinc/53/72/57/1028537257.db2.gz OGNVPOSIHYULLA-INIZCTEOSA-N -1 3 333.815 4.278 20 0 EIADHM Cc1cccc(C(=O)Nc2ccc(N(C)C)cc2C(F)(F)F)c1[O-] ZINC000192601096 1028675917 /nfs/dbraw/zinc/67/59/17/1028675917.db2.gz ASDPFKPUGDZHRO-UHFFFAOYSA-N -1 3 338.329 4.038 20 0 EIADHM CC(C)c1ccc(-c2nc(-c3nnc(-c4ccccc4)o3)no2)c([O-])c1 ZINC000446010065 1029058560 /nfs/dbraw/zinc/05/85/60/1029058560.db2.gz IYYROFLTVMNQNU-UHFFFAOYSA-N -1 3 348.362 4.283 20 0 EIADHM C[C@@H]1CCC[C@H](CCN(CCC(=O)[O-])Cc2cccc(F)c2F)C1 ZINC000583758085 1029131946 /nfs/dbraw/zinc/13/19/46/1029131946.db2.gz SRGTZSJSYMWLFF-HUUCEWRRSA-N -1 3 339.426 4.458 20 0 EIADHM O=C(CCc1ccnc2ccccc12)Nc1cc(Cl)ccc1[O-] ZINC000522983854 1029147221 /nfs/dbraw/zinc/14/72/21/1029147221.db2.gz NBFFZZSNNPIWQB-UHFFFAOYSA-N -1 3 326.783 4.165 20 0 EIADHM O=C(Cc1nc(=O)c2c3ccccc3sc2[n-]1)c1cccc(F)c1 ZINC000446144724 1029176189 /nfs/dbraw/zinc/17/61/89/1029176189.db2.gz JFMZUISXKFIDHQ-UHFFFAOYSA-N -1 3 338.363 4.115 20 0 EIADHM CSc1ccc(O[C@@H](C)C(=O)Nc2cc(Cl)ccc2[O-])cc1 ZINC000524908506 1029321210 /nfs/dbraw/zinc/32/12/10/1029321210.db2.gz XXSYIBSHWNZTHS-JTQLQIEISA-N -1 3 337.828 4.174 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])[C@H]1CCCCN1Cc1ccccc1 ZINC000524916716 1029328348 /nfs/dbraw/zinc/32/83/48/1029328348.db2.gz PYGTZZLBWKSMJO-QGZVFWFLSA-N -1 3 344.842 4.039 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2ccc(CC(F)(F)F)cc2)c(C)c1 ZINC000525012903 1029400907 /nfs/dbraw/zinc/40/09/07/1029400907.db2.gz LNNDAVUXHUVMJK-UHFFFAOYSA-N -1 3 343.370 4.209 20 0 EIADHM Cc1oc(C2CC2)nc1C(=O)[N-]c1c(F)cc(Cl)c(C)c1F ZINC000343654367 1029642363 /nfs/dbraw/zinc/64/23/63/1029642363.db2.gz JTKMGSJIEHKMPE-UHFFFAOYSA-N -1 3 326.730 4.353 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(NC[C@@H]3C[C@H]3c3ccccc3)nc2)n1 ZINC000301226283 1029690799 /nfs/dbraw/zinc/69/07/99/1029690799.db2.gz BURYCQQSFBYXFS-WMZOPIPTSA-N -1 3 346.434 4.022 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N3CCC[C@H](C(C)C)CC3)nc2)n1 ZINC000301280398 1029699652 /nfs/dbraw/zinc/69/96/52/1029699652.db2.gz JUZRLAJKZHYICW-HNNXBMFYSA-N -1 3 340.471 4.069 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@@H]3CCC[C@@H](C)[C@@H]3C)nc2)n1 ZINC000301490391 1029742368 /nfs/dbraw/zinc/74/23/68/1029742368.db2.gz ARIORJDUXZHVSS-DVOMOZLQSA-N -1 3 326.444 4.043 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N(C)C3CCC(C)(C)CC3)nc2)n1 ZINC000301580986 1029765114 /nfs/dbraw/zinc/76/51/14/1029765114.db2.gz SYQKHLJJHWVHDR-UHFFFAOYSA-N -1 3 340.471 4.212 20 0 EIADHM CCc1cccc(C(=O)N2CC=C(c3c[nH]c4ccccc43)CC2)c1[O-] ZINC000081712896 1029810249 /nfs/dbraw/zinc/81/02/49/1029810249.db2.gz YFLFROYSSLFVGE-UHFFFAOYSA-N -1 3 346.430 4.365 20 0 EIADHM O=S(=O)(CCc1ccccc1)[N-]c1ccc(-c2ccco2)cc1F ZINC000447273487 1029940007 /nfs/dbraw/zinc/94/00/07/1029940007.db2.gz HZKHCOZFVYWDSZ-UHFFFAOYSA-N -1 3 345.395 4.070 20 0 EIADHM C[C@H]1CC(C(=O)[O-])C[C@H](C)N1CCc1cccc(Cl)c1Cl ZINC000530178123 1030199920 /nfs/dbraw/zinc/19/99/20/1030199920.db2.gz YNXDKCYWRUFMBH-QWRGUYRKSA-N -1 3 330.255 4.110 20 0 EIADHM [O-]c1cc(F)cc(CN[C@H](c2cccc(Cl)c2)c2ccccn2)c1 ZINC000185576458 1030202412 /nfs/dbraw/zinc/20/24/12/1030202412.db2.gz GVKOBFGVXKBFBN-LJQANCHMSA-N -1 3 342.801 4.459 20 0 EIADHM Cc1csc(S(=O)(=O)[N-][C@@H](CC(F)(F)F)c2ccccc2)c1 ZINC000451087732 1030231129 /nfs/dbraw/zinc/23/11/29/1030231129.db2.gz JCPMLVSHQZJWOJ-LBPRGKRZSA-N -1 3 349.399 4.029 20 0 EIADHM CC[C@H](NC(=O)NCc1ccc([O-])c(F)c1)c1cccc(Cl)c1 ZINC000303805139 1030344002 /nfs/dbraw/zinc/34/40/02/1030344002.db2.gz MINSLDZWPXOUHA-HNNXBMFYSA-N -1 3 336.794 4.135 20 0 EIADHM Cc1cc(=O)[n-]c([C@@H](C)N2CCC(=Cc3ccc(F)c(F)c3)CC2)n1 ZINC000447883238 1030395063 /nfs/dbraw/zinc/39/50/63/1030395063.db2.gz RXGQDDQJZOOKTH-CYBMUJFWSA-N -1 3 345.393 4.009 20 0 EIADHM CC(C)c1ccc(-c2nc(CN3CC[C@@](C)(C(=O)[O-])C3)cs2)cc1 ZINC000263113321 1030481670 /nfs/dbraw/zinc/48/16/70/1030481670.db2.gz JUZKDYFWRVTFRP-LJQANCHMSA-N -1 3 344.480 4.230 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)N[C@@H](c1ccccc1)C1CC1 ZINC000468409107 1030505991 /nfs/dbraw/zinc/50/59/91/1030505991.db2.gz RXXIUKSMIVRTDY-FQEVSTJZSA-N -1 3 327.399 4.122 20 0 EIADHM CN(Cc1cccc([O-])c1Cl)[C@@H]1CCCN(c2ccccc2)C1 ZINC000508645793 1030510213 /nfs/dbraw/zinc/51/02/13/1030510213.db2.gz PEJNVNZVPSJLDS-QGZVFWFLSA-N -1 3 330.859 4.146 20 0 EIADHM CC(C)(C)Oc1ccc(CNC(=O)c2cc([O-])ccc2Cl)cc1 ZINC000685643007 1030607215 /nfs/dbraw/zinc/60/72/15/1030607215.db2.gz AVOUMFTZGINOAY-UHFFFAOYSA-N -1 3 333.815 4.153 20 0 EIADHM CC(=O)c1ccc(-c2ccc(C(=O)Nc3cc(F)ccc3[O-])o2)cc1 ZINC000530656593 1030631132 /nfs/dbraw/zinc/63/11/32/1030631132.db2.gz ONJWKQGCUJBHEI-UHFFFAOYSA-N -1 3 339.322 4.246 20 0 EIADHM C[C@@H](CCC1CCCCC1)NC(=O)c1c[n-]c2ccccc2c1=O ZINC000115445486 1030677181 /nfs/dbraw/zinc/67/71/81/1030677181.db2.gz AINQEHLWYPVIDG-AWEZNQCLSA-N -1 3 326.440 4.007 20 0 EIADHM O=C(Nc1cc(Br)ccc1[O-])c1cnc2ccsc2c1 ZINC000530777478 1030707744 /nfs/dbraw/zinc/70/77/44/1030707744.db2.gz FDARXISJKDISBY-UHFFFAOYSA-N -1 3 349.209 4.017 20 0 EIADHM Cn1cc(CCC(=O)Nc2cc(Cl)ccc2[O-])c2ccccc21 ZINC000530802689 1030722944 /nfs/dbraw/zinc/72/29/44/1030722944.db2.gz XILHPMNDLSUCMR-UHFFFAOYSA-N -1 3 328.799 4.109 20 0 EIADHM C[C@@H]1[C@@H](CC(F)(F)F)C[C@H](C)N1C(=O)c1cc([O-])ccc1Cl ZINC000452230669 1030899179 /nfs/dbraw/zinc/89/91/79/1030899179.db2.gz KWISUTXDKXWHFR-IVZWLZJFSA-N -1 3 335.753 4.237 20 0 EIADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)C(C)(C)C3CCC3)c2)n1 ZINC000448723775 1030985874 /nfs/dbraw/zinc/98/58/74/1030985874.db2.gz IVGIASLZIWMPQK-UHFFFAOYSA-N -1 3 339.439 4.176 20 0 EIADHM CCC[C@@H]1CCCCN1Cc1ccc(C(=O)[O-])cc1Br ZINC000226736318 1031102583 /nfs/dbraw/zinc/10/25/83/1031102583.db2.gz CVDZESXHJWHKDC-CQSZACIVSA-N -1 3 340.261 4.302 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N1CCC[C@H](CC(F)(F)F)C1 ZINC000421953137 1031120535 /nfs/dbraw/zinc/12/05/35/1031120535.db2.gz FJADAQVGGFBTNI-GFCCVEGCSA-N -1 3 337.341 4.350 20 0 EIADHM O=C(Nc1cc(Br)ccc1[O-])c1cc2c(cccc2F)[nH]1 ZINC000531394184 1031169182 /nfs/dbraw/zinc/16/91/82/1031169182.db2.gz ZKLXTBQFTZWTBF-UHFFFAOYSA-N -1 3 349.159 4.027 20 0 EIADHM O=C(Nc1cc(Br)ccc1[O-])c1cc2ccccc2o1 ZINC000531394623 1031169680 /nfs/dbraw/zinc/16/96/80/1031169680.db2.gz IVNYCVPTFIOFCC-UHFFFAOYSA-N -1 3 332.153 4.153 20 0 EIADHM C[C@@H]1CC[C@H](c2noc(-c3cc(Cc4ccccc4)ccc3[O-])n2)O1 ZINC000528234494 1031282208 /nfs/dbraw/zinc/28/22/08/1031282208.db2.gz KQXZRTJFRUADCG-FZKQIMNGSA-N -1 3 336.391 4.273 20 0 EIADHM CCc1cc(C)c(C(=O)Nc2c([O-])ccc(Br)c2C)o1 ZINC000452763499 1031317787 /nfs/dbraw/zinc/31/77/87/1031317787.db2.gz ZGHGVAAWPIRGBH-UHFFFAOYSA-N -1 3 338.201 4.179 20 0 EIADHM Cc1cc(C)cc(OCC(=O)Nc2ccc([O-])c(C(F)(F)F)c2)c1 ZINC000531783463 1031597839 /nfs/dbraw/zinc/59/78/39/1031597839.db2.gz XRNGOKUZWCJVJK-UHFFFAOYSA-N -1 3 339.313 4.045 20 0 EIADHM Cc1nc(-c2ccsc2)ccc1C(=O)Nc1cccc([O-])c1F ZINC000128385363 1031739271 /nfs/dbraw/zinc/73/92/71/1031739271.db2.gz LJWIKSIJSFTJMI-UHFFFAOYSA-N -1 3 328.368 4.216 20 0 EIADHM CCC(=O)c1ccc(C(=O)Nc2cc(C(F)(F)F)ccc2[O-])cc1 ZINC000531873535 1031754272 /nfs/dbraw/zinc/75/42/72/1031754272.db2.gz IGVZQCKICDBNIL-UHFFFAOYSA-N -1 3 337.297 4.256 20 0 EIADHM CC(C)CCn1nc(CNCc2cc([O-])cc(F)c2)c2ccccc21 ZINC000449490028 1031803659 /nfs/dbraw/zinc/80/36/59/1031803659.db2.gz VVCNSHQOPDTLFR-UHFFFAOYSA-N -1 3 341.430 4.217 20 0 EIADHM O=C(Nc1cccc([O-])c1F)c1cc(-c2ccccn2)ccc1Cl ZINC000129778924 1031813416 /nfs/dbraw/zinc/81/34/16/1031813416.db2.gz XOTOCGYLZNVJIK-UHFFFAOYSA-N -1 3 342.757 4.499 20 0 EIADHM CCOc1cc(CN2CCC[C@H]2c2cc(C)no2)cc(Cl)c1[O-] ZINC000459332718 1031837677 /nfs/dbraw/zinc/83/76/77/1031837677.db2.gz WNVAWFWWXNOLTP-AWEZNQCLSA-N -1 3 336.819 4.078 20 0 EIADHM CO[C@@H](C)c1cccc(NCc2cccc([O-])c2Br)c1 ZINC000459344991 1031866752 /nfs/dbraw/zinc/86/67/52/1031866752.db2.gz CAFFEVDJAVEAQV-NSHDSACASA-N -1 3 336.229 4.474 20 0 EIADHM Cc1ccc([C@H](NCc2cc(=O)[n-]c(C3CC3)n2)c2ccccc2)cc1 ZINC000459355637 1031890456 /nfs/dbraw/zinc/89/04/56/1031890456.db2.gz XCRSAOSPMWRDGR-OAQYLSRUSA-N -1 3 345.446 4.247 20 0 EIADHM Cc1ccc(NC(=O)c2cccc(C)c2[O-])cc1NC(=O)C(C)(C)C ZINC000110460768 1033319375 /nfs/dbraw/zinc/31/93/75/1033319375.db2.gz SNKXLOKCSZBVPN-UHFFFAOYSA-N -1 3 340.423 4.246 20 0 EIADHM CC(C)C(=O)Nc1cccc(-c2nc3cc(Cl)ccc3c(=O)[n-]2)c1 ZINC000614111335 1033381153 /nfs/dbraw/zinc/38/11/53/1033381153.db2.gz NFBIYDMLEIUOFX-UHFFFAOYSA-N -1 3 341.798 4.250 20 0 EIADHM CCCOc1ccc(-c2nc3cc(Cl)ccc3c(=O)[n-]2)cc1OC ZINC000614110872 1033391048 /nfs/dbraw/zinc/39/10/48/1033391048.db2.gz XEVRTVFZAQHDSB-UHFFFAOYSA-N -1 3 344.798 4.453 20 0 EIADHM CC(=O)c1cc(F)c([N-]C(=O)c2sccc2C2CC2)c(F)c1F ZINC000432991919 1033587826 /nfs/dbraw/zinc/58/78/26/1033587826.db2.gz HLQAHSORMVYHMK-UHFFFAOYSA-N -1 3 339.338 4.498 20 0 EIADHM CCN(C(=O)c1c[n-]c2c(Cl)cccc2c1=O)[C@@H]1CCCC[C@@H]1C ZINC001143552794 1033773208 /nfs/dbraw/zinc/77/32/08/1033773208.db2.gz DZJJKWQWSXWQMN-BLLLJJGKSA-N -1 3 346.858 4.222 20 0 EIADHM C[C@H]1C[C@]1(NC(=O)c1cc([O-])ccc1Cl)c1ccc(Cl)cc1 ZINC000512787835 1033947119 /nfs/dbraw/zinc/94/71/19/1033947119.db2.gz LEHLEGABNLWLCO-DYZYQPBXSA-N -1 3 336.218 4.364 20 0 EIADHM COc1ccc(Cl)cc1-c1cc(=NC(=O)CCC2CCCC2)[nH][n-]1 ZINC000512855272 1034079734 /nfs/dbraw/zinc/07/97/34/1034079734.db2.gz MTAGBAONYCJLRJ-UHFFFAOYSA-N -1 3 347.846 4.070 20 0 EIADHM CCN(C(=O)c1cc([O-])ccc1Cl)[C@H](C)Cc1ccc(OC)cc1 ZINC000433344262 1034252017 /nfs/dbraw/zinc/25/20/17/1034252017.db2.gz RBBRYJXTJBDJKU-CYBMUJFWSA-N -1 3 347.842 4.148 20 0 EIADHM CC[C@](C)(O)CN(Cc1ccccc1)Cc1cccc([O-])c1Cl ZINC000513040964 1034350819 /nfs/dbraw/zinc/35/08/19/1034350819.db2.gz MDSJAXJVIQJVEZ-IBGZPJMESA-N -1 3 333.859 4.209 20 0 EIADHM C[C@H](S[C@H]1CCOC1)c1nc(=O)c2c(-c3ccco3)csc2[n-]1 ZINC000419352075 1034402493 /nfs/dbraw/zinc/40/24/93/1034402493.db2.gz AGNIUDXLUVAUHP-UWVGGRQHSA-N -1 3 348.449 4.240 20 0 EIADHM [O-]c1ccc(F)c(CNCc2ccc(F)cc2C(F)(F)F)c1F ZINC000509906607 1034513272 /nfs/dbraw/zinc/51/32/72/1034513272.db2.gz AUOUIIAPNAFGLB-UHFFFAOYSA-N -1 3 335.247 4.118 20 0 EIADHM O=C(CCCc1ccccc1)[N-]OCc1ccc(Br)cc1 ZINC000729263872 1034766256 /nfs/dbraw/zinc/76/62/56/1034766256.db2.gz ODCVMRXEYUACND-UHFFFAOYSA-N -1 3 348.240 4.020 20 0 EIADHM [O-]c1cccc(CN(Cc2ccc(F)cc2)C2CCOCC2)c1Cl ZINC000513232802 1034841875 /nfs/dbraw/zinc/84/18/75/1034841875.db2.gz SIBLWGDSQQYXIY-UHFFFAOYSA-N -1 3 349.833 4.366 20 0 EIADHM Cc1ccc([O-])c(NC(=O)c2c[nH]cc2-c2ccc(Cl)s2)n1 ZINC000345931000 1035333442 /nfs/dbraw/zinc/33/34/42/1035333442.db2.gz GGOQYSQARHKENN-UHFFFAOYSA-N -1 3 333.800 4.058 20 0 EIADHM O=c1cc(CSCc2csc(-c3ccoc3)n2)nc(C2CC2)[n-]1 ZINC000419417220 1035347461 /nfs/dbraw/zinc/34/74/61/1035347461.db2.gz XFTNEEXASNDVQQ-UHFFFAOYSA-N -1 3 345.449 4.210 20 0 EIADHM C[C@@]1(CNC(=O)CCCc2ccc([O-])c(F)c2)C[C@H]1c1ccccc1 ZINC000501665480 1035491205 /nfs/dbraw/zinc/49/12/05/1035491205.db2.gz QVHGYFVZIXJIHY-UWJYYQICSA-N -1 3 341.426 4.164 20 0 EIADHM O=C([O-])c1ccc(-c2nc(CN(CC3CC3)CC3CC3)cs2)cc1 ZINC000574884873 1035574643 /nfs/dbraw/zinc/57/46/43/1035574643.db2.gz XIOPKRIGEGNQQO-UHFFFAOYSA-N -1 3 342.464 4.130 20 0 EIADHM Cc1ccc([N-]S(=O)(=O)c2cc(F)ccc2Cl)c(Cl)c1 ZINC000485414933 1035863735 /nfs/dbraw/zinc/86/37/35/1035863735.db2.gz XGPSINXJBOADGO-UHFFFAOYSA-N -1 3 334.199 4.242 20 0 EIADHM O=C([O-])c1ccc(CN2CCC(Cc3ccc(F)cc3)CC2)c(F)c1 ZINC000571887629 1036267340 /nfs/dbraw/zinc/26/73/40/1036267340.db2.gz HVFNHUHZQWLJFI-UHFFFAOYSA-N -1 3 345.389 4.118 20 0 EIADHM CCN(Cc1c[nH]c2ccccc12)[C@H](C)c1cc(C(=O)[O-])c(C)o1 ZINC000572048995 1036399283 /nfs/dbraw/zinc/39/92/83/1036399283.db2.gz PWUJKAGJCYDVRS-GFCCVEGCSA-N -1 3 326.396 4.351 20 0 EIADHM Cc1cccc(C(=O)N=c2cc(-c3cccc(Cl)c3)[n-][nH]2)c1C ZINC000598897338 1036814922 /nfs/dbraw/zinc/81/49/22/1036814922.db2.gz NBSCPPCDDYVMHZ-UHFFFAOYSA-N -1 3 325.799 4.021 20 0 EIADHM CC(=O)c1ccc(C(=O)N2CC[C@@H](c3ccccc3)C2(C)C)cc1[O-] ZINC000422142050 1036945361 /nfs/dbraw/zinc/94/53/61/1036945361.db2.gz WRHWHDGTXINITF-SFHVURJKSA-N -1 3 337.419 4.003 20 0 EIADHM CCc1nnsc1C(=O)[N-]c1ccccc1SCC(F)(F)F ZINC000253606992 1037166308 /nfs/dbraw/zinc/16/63/08/1037166308.db2.gz LJCSIPLOFPNWDQ-UHFFFAOYSA-N -1 3 347.387 4.007 20 0 EIADHM CC[C@H](CC(=O)N=c1cc(-c2ccccc2OC)[n-][nH]1)c1ccccc1 ZINC000590962400 1037216152 /nfs/dbraw/zinc/21/61/52/1037216152.db2.gz VRXKDLURGROSEP-OAHLLOKOSA-N -1 3 349.434 4.030 20 0 EIADHM CC(C)c1ccc(C(C)(C)NC(=O)c2cc(=O)c3ccccc3[n-]2)cc1 ZINC000591300132 1037350611 /nfs/dbraw/zinc/35/06/11/1037350611.db2.gz DGNBLIYZQZPMNY-UHFFFAOYSA-N -1 3 348.446 4.317 20 0 EIADHM O=S(=O)([N-]c1ccc(OC2CCCCC2)cc1)c1ccccc1 ZINC000604738325 1037504216 /nfs/dbraw/zinc/50/42/16/1037504216.db2.gz YBOFJHIKZCXHID-UHFFFAOYSA-N -1 3 331.437 4.199 20 0 EIADHM CC(C)(C)Oc1ccc([N-]S(=O)(=O)c2ccc(Cl)cc2)cc1 ZINC000607616080 1038240058 /nfs/dbraw/zinc/24/00/58/1038240058.db2.gz UNUJTPJCXIAPHJ-UHFFFAOYSA-N -1 3 339.844 4.318 20 0 EIADHM COc1ccccc1[C@H]1CCN(Cc2cc(C(=O)[O-])ccc2Cl)C1 ZINC000574644220 1038317173 /nfs/dbraw/zinc/31/71/73/1038317173.db2.gz CXOSDKKHMQAKHJ-AWEZNQCLSA-N -1 3 345.826 4.036 20 0 EIADHM S=c1[n-]nc(CCC2CCCC2)n1CN1CCC2(CCCC2)C1 ZINC000173443908 1038347459 /nfs/dbraw/zinc/34/74/59/1038347459.db2.gz PKBDRRDNHCUXNZ-UHFFFAOYSA-N -1 3 334.533 4.287 20 0 EIADHM CC(C)OC(=O)NCc1ccc(NCc2c([O-])cccc2Cl)cc1 ZINC000151056154 1038599219 /nfs/dbraw/zinc/59/92/19/1038599219.db2.gz GGHJBOAOOWIKQE-UHFFFAOYSA-N -1 3 348.830 4.292 20 0 EIADHM CC(C)Oc1ccc(CN2CCCC[C@H]2CCC(=O)[O-])cc1Cl ZINC000424254325 1038753942 /nfs/dbraw/zinc/75/39/42/1038753942.db2.gz GNJMLBAZRGXNCM-HNNXBMFYSA-N -1 3 339.863 4.347 20 0 EIADHM CCOC(=O)Nc1cccc(OC(=O)c2cc3ccsc3[n-]2)c1 ZINC000899132134 1038828139 /nfs/dbraw/zinc/82/81/39/1038828139.db2.gz CCZXVYVBNNPDCP-UHFFFAOYSA-N -1 3 330.365 4.017 20 0 EIADHM CCc1onc(-c2ccccc2)c1C(=O)Nc1cc(F)ccc1[O-] ZINC000476498813 1038837266 /nfs/dbraw/zinc/83/72/66/1038837266.db2.gz GIRBOTNXFSMMCZ-UHFFFAOYSA-N -1 3 326.327 4.001 20 0 EIADHM Cc1ccc(-c2nc(-c3cc(Br)cs3)no2)c([O-])c1 ZINC000071306179 1038858953 /nfs/dbraw/zinc/85/89/53/1038858953.db2.gz IECZRMNOGCZTQG-UHFFFAOYSA-N -1 3 337.198 4.242 20 0 EIADHM CC(=O)c1cccc(NC(=O)C(C)(C)Oc2ccc(Cl)cc2)c1[O-] ZINC000552070043 1039096580 /nfs/dbraw/zinc/09/65/80/1039096580.db2.gz ZKWVATCWEHSPNC-UHFFFAOYSA-N -1 3 347.798 4.044 20 0 EIADHM CC(C)Oc1ccc(F)cc1NC(=O)CCCc1ccc([O-])c(F)c1 ZINC000469230583 1039206256 /nfs/dbraw/zinc/20/62/56/1039206256.db2.gz YVVQISONEXNSJI-UHFFFAOYSA-N -1 3 349.377 4.419 20 0 EIADHM Cc1ccc(NC(=O)c2cc([O-])c3ccccc3c2)c2c1NCCC2 ZINC000552216662 1039266459 /nfs/dbraw/zinc/26/64/59/1039266459.db2.gz XNYNASVLVPCUJO-UHFFFAOYSA-N -1 3 332.403 4.464 20 0 EIADHM O=C(Cn1ccc2ccc(Cl)cc21)Nc1cc(Cl)ccc1[O-] ZINC000059987561 1039494613 /nfs/dbraw/zinc/49/46/13/1039494613.db2.gz OKBXDVGNBSQMOC-UHFFFAOYSA-N -1 3 335.190 4.292 20 0 EIADHM O=C(Nc1c([O-])cccc1Cl)c1cnn(-c2ccc(Cl)cc2)c1 ZINC000552433490 1039511313 /nfs/dbraw/zinc/51/13/13/1039511313.db2.gz LSUDYWVYWBLTBX-UHFFFAOYSA-N -1 3 348.189 4.137 20 0 EIADHM O=C(COc1cccc(C(F)(F)F)c1)Nc1ccc(Cl)cc1[O-] ZINC000534703853 1039717636 /nfs/dbraw/zinc/71/76/36/1039717636.db2.gz DHRWRKQVSNFPKO-UHFFFAOYSA-N -1 3 345.704 4.082 20 0 EIADHM CC(C)(C)Oc1cccc(CCC(=O)Nc2ccc(Cl)cc2[O-])n1 ZINC000534710416 1039719650 /nfs/dbraw/zinc/71/96/50/1039719650.db2.gz XIMBZCGXLPQLJY-UHFFFAOYSA-N -1 3 348.830 4.189 20 0 EIADHM O=C(Nc1cccc([O-])c1F)c1ccc(Cl)cc1Br ZINC000534944809 1039865359 /nfs/dbraw/zinc/86/53/59/1039865359.db2.gz AIIUCHNEPLOMGL-UHFFFAOYSA-N -1 3 344.567 4.200 20 0 EIADHM CCc1c(C(=O)Nc2ccc(Cl)cc2[O-])cnn1C(CC)CC ZINC000478859077 1039968355 /nfs/dbraw/zinc/96/83/55/1039968355.db2.gz SFGLMTLPADWTFS-UHFFFAOYSA-N -1 3 335.835 4.418 20 0 EIADHM O=C(Nc1ccc(Cl)cc1[O-])c1ccccc1N1CCCCC1 ZINC000551128619 1039997805 /nfs/dbraw/zinc/99/78/05/1039997805.db2.gz CNZOPBQNANEDJB-UHFFFAOYSA-N -1 3 330.815 4.288 20 0 EIADHM CCOc1ccc(F)c([N-]C(=O)c2cnc(C(C)(C)C)s2)c1F ZINC000551238098 1040084412 /nfs/dbraw/zinc/08/44/12/1040084412.db2.gz SQJCEWQSTKZJEB-UHFFFAOYSA-N -1 3 340.395 4.370 20 0 EIADHM O=C(c1ccccc1[O-])N1CCC[C@H](c2nc3ccccc3s2)C1 ZINC000514717061 1040176524 /nfs/dbraw/zinc/17/65/24/1040176524.db2.gz VSHXXTFTBLEFPD-ZDUSSCGKSA-N -1 3 338.432 4.022 20 0 EIADHM CCCc1cc(=O)[n-]c(C(=Cc2cccc(OC(C)C)c2)CC)n1 ZINC000435340735 1040294858 /nfs/dbraw/zinc/29/48/58/1040294858.db2.gz MKJZYIGCKORNIS-WJDWOHSUSA-N -1 3 326.440 4.460 20 0 EIADHM CC(C)Oc1ncc(C(=O)Nc2c([O-])cccc2Cl)cc1Cl ZINC000646488056 1040327109 /nfs/dbraw/zinc/32/71/09/1040327109.db2.gz YTBORFLSFIFYMX-UHFFFAOYSA-N -1 3 341.194 4.134 20 0 EIADHM CC(C)c1ccc([C@H](N=c2ncnc3[nH][n-]cc2-3)c2cccs2)cc1 ZINC000514922492 1040359032 /nfs/dbraw/zinc/35/90/32/1040359032.db2.gz SNMXLXLSFLVOAJ-KRWDZBQOSA-N -1 3 349.463 4.113 20 0 EIADHM Cc1cc(=O)[n-]c([C@@H](C)Sc2nc3cc(F)cc(Cl)c3o2)n1 ZINC000479509429 1040426831 /nfs/dbraw/zinc/42/68/31/1040426831.db2.gz CQLXXYRMBHVEBH-SSDOTTSWSA-N -1 3 339.779 4.278 20 0 EIADHM CCc1cc(=O)[n-]c(CSCc2cc(C)nc3ccccc23)n1 ZINC000477367477 1040452388 /nfs/dbraw/zinc/45/23/88/1040452388.db2.gz UHLSAXYSPMXUTR-UHFFFAOYSA-N -1 3 325.437 4.035 20 0 EIADHM CCc1nc2c(s1)[C@@H](N(C)Cc1c(F)ccc([O-])c1F)CCC2 ZINC000508854842 1040542003 /nfs/dbraw/zinc/54/20/03/1040542003.db2.gz HKKZUYGYVFEMPJ-ZDUSSCGKSA-N -1 3 338.423 4.199 20 0 EIADHM Cc1c(Br)cccc1C(=O)Nc1c([O-])cccc1Cl ZINC000515444524 1040754588 /nfs/dbraw/zinc/75/45/88/1040754588.db2.gz KFQWGXGXBZIYEL-UHFFFAOYSA-N -1 3 340.604 4.369 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2nc(C)c(Cl)cc2Cl)c(C)c1 ZINC000537752881 1040807150 /nfs/dbraw/zinc/80/71/50/1040807150.db2.gz RJMBRRRPVXFGLO-UHFFFAOYSA-N -1 3 345.251 4.114 20 0 EIADHM CCc1ccc([O-])c(C(=O)N(CC)[C@H](C)c2cccc(OC)c2)c1 ZINC000539855587 1040842400 /nfs/dbraw/zinc/84/24/00/1040842400.db2.gz XRIMDQIXVJTWOP-CQSZACIVSA-N -1 3 327.424 4.187 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)NC[C@@H](c1ccccc1)C1CC1 ZINC000554389224 1041055825 /nfs/dbraw/zinc/05/58/25/1041055825.db2.gz LUYIEQXKZPUOKM-SFHVURJKSA-N -1 3 341.426 4.164 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)N[C@@H]1CCCCC12CCCC2 ZINC000462978366 1041180211 /nfs/dbraw/zinc/18/02/11/1041180211.db2.gz JRKSDHHPQAQYJD-GOSISDBHSA-N -1 3 333.447 4.473 20 0 EIADHM CCc1cccc(C)c1[N-]S(=O)(=O)c1ccc(CCCl)cc1 ZINC000042777406 1041186939 /nfs/dbraw/zinc/18/69/39/1041186939.db2.gz ZDPLCXIAXXCNNB-UHFFFAOYSA-N -1 3 337.872 4.140 20 0 EIADHM O=C([N-]c1n[nH]c(-c2ccc(Cl)cc2)n1)c1sccc1Cl ZINC000554544697 1041233809 /nfs/dbraw/zinc/23/38/09/1041233809.db2.gz SBJRANWIEWBVJO-UHFFFAOYSA-N -1 3 339.207 4.092 20 0 EIADHM CC[C@H](C)[C@@H](C)N(Cc1coc(-c2ccc(C(=O)[O-])cc2)n1)C1CC1 ZINC000567359168 1041244837 /nfs/dbraw/zinc/24/48/37/1041244837.db2.gz MEOSWMYEMVIALV-UONOGXRCSA-N -1 3 342.439 4.439 20 0 EIADHM CC(C)c1ccc([C@@H](CC(=O)[O-])NCc2ccc(C(F)F)nc2)cc1 ZINC000904001747 1041246070 /nfs/dbraw/zinc/24/60/70/1041246070.db2.gz FKZHEQXXZLBMOW-QGZVFWFLSA-N -1 3 348.393 4.448 20 0 EIADHM CCc1nc(CNC/C=C/c2c(C)cc(C)cc2C)ccc1C(=O)[O-] ZINC000903996143 1041253587 /nfs/dbraw/zinc/25/35/87/1041253587.db2.gz BGKAGARFCTWPRO-VOTSOKGWSA-N -1 3 338.451 4.070 20 0 EIADHM Cc1cccc([C@@H](CC(=O)[O-])NCc2cnc(C3CCC3)s2)c1 ZINC000904045822 1041301235 /nfs/dbraw/zinc/30/12/35/1041301235.db2.gz PIRLDWBJDDDPLW-MRXNPFEDSA-N -1 3 330.453 4.025 20 0 EIADHM O=C(c1cc(Cc2ccccc2)ccc1[O-])N1CCCC[C@@H]1C(F)F ZINC000436518882 1041322616 /nfs/dbraw/zinc/32/26/16/1041322616.db2.gz MSQXKLVVZXFSTH-QGZVFWFLSA-N -1 3 345.389 4.243 20 0 EIADHM CCOCCOc1c(Cl)cccc1NC(=O)c1ccc(C)cc1[O-] ZINC000436536063 1041331817 /nfs/dbraw/zinc/33/18/17/1041331817.db2.gz CKFDEPFMBFMJRD-UHFFFAOYSA-N -1 3 349.814 4.022 20 0 EIADHM CCC(CC)(C(=O)Nc1cccc(C(C)=O)c1[O-])c1ccccc1 ZINC000554695442 1041333999 /nfs/dbraw/zinc/33/39/99/1041333999.db2.gz FRIISUJFQGWWMO-UHFFFAOYSA-N -1 3 325.408 4.291 20 0 EIADHM CC[C@H](c1ccccc1)[C@H]1CCCN1C(=O)c1ccc(OC)cc1[O-] ZINC000436540839 1041334532 /nfs/dbraw/zinc/33/45/32/1041334532.db2.gz ULRBATNQLAXEBW-IEBWSBKVSA-N -1 3 339.435 4.199 20 0 EIADHM CC(C)c1ccc(C(=O)N2CCC(OC3CCCCC3)CC2)c([O-])c1 ZINC000436542171 1041336116 /nfs/dbraw/zinc/33/61/16/1041336116.db2.gz FDFRWRSQEIZDNQ-UHFFFAOYSA-N -1 3 345.483 4.470 20 0 EIADHM C[C@@H]1CCSCCN1C(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436603606 1041367345 /nfs/dbraw/zinc/36/73/45/1041367345.db2.gz MEXIDNIBMSJKON-CQSZACIVSA-N -1 3 343.448 4.152 20 0 EIADHM CC(=O)c1cccc(-c2nc(-c3ccc([O-])c4ccccc34)no2)c1 ZINC000436608988 1041369927 /nfs/dbraw/zinc/36/99/27/1041369927.db2.gz HRWRZOQDSVZZPO-UHFFFAOYSA-N -1 3 330.343 4.465 20 0 EIADHM O=c1cc(CSCCC(Cl)(Cl)Cl)nc(C2CC2)[n-]1 ZINC000842194052 1041395482 /nfs/dbraw/zinc/39/54/82/1041395482.db2.gz POIVSZSTJHACOW-UHFFFAOYSA-N -1 3 327.664 4.053 20 0 EIADHM [O-]c1cc2ccccc2cc1-c1nc(-c2ncsc2Cl)no1 ZINC000436657591 1041400291 /nfs/dbraw/zinc/40/02/91/1041400291.db2.gz LSZPRYWZWQVRPR-UHFFFAOYSA-N -1 3 329.768 4.372 20 0 EIADHM CC(C)c1ccc(C(=O)N[C@H]2CCO[C@@H](c3ccccc3)C2)c([O-])c1 ZINC000436660009 1041412977 /nfs/dbraw/zinc/41/29/77/1041412977.db2.gz RCLQVDAMTYALEO-FXAWDEMLSA-N -1 3 339.435 4.166 20 0 EIADHM [O-]c1c(F)cc(-c2nc3cc(Br)c(F)cc3[nH]2)cc1F ZINC000436737984 1041446638 /nfs/dbraw/zinc/44/66/38/1041446638.db2.gz LBJZSGVZPROITE-UHFFFAOYSA-N -1 3 343.102 4.115 20 0 EIADHM CCc1ccc(C(=O)N(C)[C@H](CC)c2ccccc2OC)c([O-])c1 ZINC000436742968 1041450022 /nfs/dbraw/zinc/45/00/22/1041450022.db2.gz WLNGSBKTCYPREG-QGZVFWFLSA-N -1 3 327.424 4.187 20 0 EIADHM C[C@H](NC(=O)c1ccccc1[O-])c1ccc(Oc2cccnc2)cc1 ZINC000436730411 1041453987 /nfs/dbraw/zinc/45/39/87/1041453987.db2.gz WPWXQQMPFPOHCY-AWEZNQCLSA-N -1 3 334.375 4.071 20 0 EIADHM C[C@@H](NC(=O)c1ccccc1[O-])c1ccc(Oc2cccnc2)cc1 ZINC000436730413 1041454449 /nfs/dbraw/zinc/45/44/49/1041454449.db2.gz WPWXQQMPFPOHCY-CQSZACIVSA-N -1 3 334.375 4.071 20 0 EIADHM O=C(c1cc(Cc2ccccc2)ccc1[O-])N1CCOc2ccccc21 ZINC000436759952 1041458307 /nfs/dbraw/zinc/45/83/07/1041458307.db2.gz IZMCPNFWBORRQH-UHFFFAOYSA-N -1 3 345.398 4.022 20 0 EIADHM C[C@@H](c1ccco1)N(C)C(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436761740 1041459853 /nfs/dbraw/zinc/45/98/53/1041459853.db2.gz OJVFPTKRWISPME-HNNXBMFYSA-N -1 3 335.403 4.409 20 0 EIADHM O=C(c1ccccc1[O-])N1CCc2sccc2[C@@H]1c1cccs1 ZINC000436751889 1041463601 /nfs/dbraw/zinc/46/36/01/1041463601.db2.gz ODMKIISMDGWVDA-QGZVFWFLSA-N -1 3 341.457 4.303 20 0 EIADHM CC(C)Cc1nnc([N-]C(=O)c2cc3cccc(Cl)c3o2)s1 ZINC000041330855 1041468220 /nfs/dbraw/zinc/46/82/20/1041468220.db2.gz PEHKCPPEEUBUFY-UHFFFAOYSA-N -1 3 335.816 4.389 20 0 EIADHM Cc1noc(C)c1NC(=O)c1cc(CCc2ccccc2)ccc1[O-] ZINC000436792993 1041484010 /nfs/dbraw/zinc/48/40/10/1041484010.db2.gz QEANLXZLRNPTGQ-UHFFFAOYSA-N -1 3 336.391 4.035 20 0 EIADHM O=C(c1cc(CCc2ccccc2)ccc1[O-])N1CC2(C1)CCCC2 ZINC000436824597 1041504664 /nfs/dbraw/zinc/50/46/64/1041504664.db2.gz CHMRLJUAQYLRSD-UHFFFAOYSA-N -1 3 335.447 4.194 20 0 EIADHM Cc1ccc(C(=O)Nc2ccccc2O[C@H](C)C(F)(F)F)c([O-])c1 ZINC000436841383 1041510315 /nfs/dbraw/zinc/51/03/15/1041510315.db2.gz AHPZBTCNOXRHDG-LLVKDONJSA-N -1 3 339.313 4.283 20 0 EIADHM Cc1ccc([O-])c(C(=O)Nc2ccccc2O[C@@H](C)C(F)(F)F)c1 ZINC000436843635 1041511449 /nfs/dbraw/zinc/51/14/49/1041511449.db2.gz JJFXZEMOKSFTMW-NSHDSACASA-N -1 3 339.313 4.283 20 0 EIADHM CCc1cccc(C(=O)N(c2ccc(OC)cc2)[C@H](C)C2CC2)c1[O-] ZINC000538741513 1041516943 /nfs/dbraw/zinc/51/69/43/1041516943.db2.gz IZNQGYOKASVOQY-CQSZACIVSA-N -1 3 339.435 4.409 20 0 EIADHM CCSc1cccc(F)c1[N-]C(=O)c1ccn(-c2ccccc2)n1 ZINC000484924260 1041521229 /nfs/dbraw/zinc/52/12/29/1041521229.db2.gz GAJKBWRLFZXFFH-UHFFFAOYSA-N -1 3 341.411 4.376 20 0 EIADHM CCc1ccc(-c2nc([C@@H](C)c3c(F)cccc3F)no2)c([O-])c1 ZINC000436863966 1041522934 /nfs/dbraw/zinc/52/29/34/1041522934.db2.gz LWPDXUQRIBWQJN-JTQLQIEISA-N -1 3 330.334 4.435 20 0 EIADHM COc1cccc(C(=O)Nc2ccc(-c3ccncc3)c(C)c2)c1[O-] ZINC000436868884 1041527664 /nfs/dbraw/zinc/52/76/64/1041527664.db2.gz IVRITCMQRAQICE-UHFFFAOYSA-N -1 3 334.375 4.024 20 0 EIADHM O=C(c1cc(CCc2ccccc2)ccc1[O-])N1CC[C@H](C2CC2)C1 ZINC000436915328 1041554886 /nfs/dbraw/zinc/55/48/86/1041554886.db2.gz NTHALMGEXDEMQO-IBGZPJMESA-N -1 3 335.447 4.050 20 0 EIADHM Cc1cc(-c2noc(-c3cc(Cc4ccccc4)ccc3[O-])n2)ccn1 ZINC000436956135 1041575156 /nfs/dbraw/zinc/57/51/56/1041575156.db2.gz OWGTVLUCCGHGRF-UHFFFAOYSA-N -1 3 343.386 4.403 20 0 EIADHM COCC1(c2noc(-c3ccc(C(C)C)cc3[O-])n2)CCCCC1 ZINC000436956270 1041575440 /nfs/dbraw/zinc/57/54/40/1041575440.db2.gz PTPHFJZEBVSAIT-UHFFFAOYSA-N -1 3 330.428 4.414 20 0 EIADHM CCc1ccc(C(=O)Nc2ccc(OC)cc2C(F)(F)F)c([O-])c1 ZINC000436989182 1041583164 /nfs/dbraw/zinc/58/31/64/1041583164.db2.gz ZAYQETZPDZFKBN-UHFFFAOYSA-N -1 3 339.313 4.234 20 0 EIADHM [O-]c1cc2ccccc2cc1-c1nc(COc2cccc(F)c2)no1 ZINC000437000958 1041594722 /nfs/dbraw/zinc/59/47/22/1041594722.db2.gz USOJOFMYSKWPBN-UHFFFAOYSA-N -1 3 336.322 4.314 20 0 EIADHM CC(=O)c1cccc(NC(=O)c2cc(Cl)sc2Cl)c1[O-] ZINC000516918644 1041810597 /nfs/dbraw/zinc/81/05/97/1041810597.db2.gz ROMKFKBFKMUPOX-UHFFFAOYSA-N -1 3 330.192 4.215 20 0 EIADHM COc1cccc(C(=O)Nc2nc(-c3ccc(C)cc3)cs2)c1[O-] ZINC000302000392 1042048990 /nfs/dbraw/zinc/04/89/90/1042048990.db2.gz VAWCLGNOJBHYQD-UHFFFAOYSA-N -1 3 340.404 4.085 20 0 EIADHM O=c1nc(COc2ccc(F)cc2)[n-]c2sc3c(c21)CCCCC3 ZINC000542090274 1042280092 /nfs/dbraw/zinc/28/00/92/1042280092.db2.gz IMBTUBVYICEGQD-UHFFFAOYSA-N -1 3 344.411 4.384 20 0 EIADHM O=C(c1ccc([O-])cc1)C1CCN(Cc2cccc(Cl)c2)CC1 ZINC000261369896 1042280892 /nfs/dbraw/zinc/28/08/92/1042280892.db2.gz KQPABIDRMLODLE-UHFFFAOYSA-N -1 3 329.827 4.141 20 0 EIADHM O=C(C[C@@H](Cc1ccccc1)c1ccccc1)Nc1ncccc1[O-] ZINC000438882296 1042404396 /nfs/dbraw/zinc/40/43/96/1042404396.db2.gz DNVQQBVTTAKNKL-GOSISDBHSA-N -1 3 332.403 4.142 20 0 EIADHM CC[C@H](O[C@H]1CCC[C@H](C)C1)C(=O)Nc1cc(Cl)ccc1[O-] ZINC000439097180 1042491681 /nfs/dbraw/zinc/49/16/81/1042491681.db2.gz LWYFQXWOBNQDAY-RBOXIYTFSA-N -1 3 325.836 4.358 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])[C@H]1C[C@]12CCCc1ccccc12 ZINC000439093541 1042496313 /nfs/dbraw/zinc/49/63/13/1042496313.db2.gz HNIBXRLQRXYHFE-BEFAXECRSA-N -1 3 327.811 4.278 20 0 EIADHM O=C([N-]c1nc(Sc2ccccc2)ns1)c1cc(F)cc(F)c1 ZINC000518886984 1042746797 /nfs/dbraw/zinc/74/67/97/1042746797.db2.gz JCYOKCYQXVJTJK-UHFFFAOYSA-N -1 3 349.387 4.220 20 0 EIADHM CCOc1ccc(NC(=O)c2cc([O-])c3ccccc3c2)cc1F ZINC000469998737 1043005325 /nfs/dbraw/zinc/00/53/25/1043005325.db2.gz GTIPOBNGQJLANJ-UHFFFAOYSA-N -1 3 325.339 4.336 20 0 EIADHM O=C(c1cc(Oc2ccccc2)ccc1[O-])N1CC[C@H](c2ccco2)C1 ZINC000673809705 1043080497 /nfs/dbraw/zinc/08/04/97/1043080497.db2.gz PVWGFCQDYJUMNB-HNNXBMFYSA-N -1 3 349.386 4.407 20 0 EIADHM CSc1cccc(C)c1[N-]C(=O)c1occc1Br ZINC000184643396 1043118590 /nfs/dbraw/zinc/11/85/90/1043118590.db2.gz RCUDHPBPZFHVIM-UHFFFAOYSA-N -1 3 326.215 4.325 20 0 EIADHM [O-]c1cc(F)cc(CNc2ccc(-c3cn4c(n3)CCCC4)cc2)c1 ZINC000185589900 1043201086 /nfs/dbraw/zinc/20/10/86/1043201086.db2.gz ZIZYTLFMYUCBAI-UHFFFAOYSA-N -1 3 337.398 4.343 20 0 EIADHM COc1ccc([C@H](C)N(C)C(=O)c2cc([O-])c3ccccc3c2)cc1 ZINC000525923901 1043234257 /nfs/dbraw/zinc/23/42/57/1043234257.db2.gz LMKPXEZJANGLKP-AWEZNQCLSA-N -1 3 335.403 4.387 20 0 EIADHM CCO[C@H](CCNC(=O)c1cc([O-])c2ccccc2c1)C1CCCC1 ZINC000525935310 1043237044 /nfs/dbraw/zinc/23/70/44/1043237044.db2.gz GWXFYIDBCXVDAW-HXUWFJFHSA-N -1 3 341.451 4.261 20 0 EIADHM CC1(C)[C@H](C(F)(F)F)CCN1C(=O)c1cc([O-])c2ccccc2c1 ZINC000526929765 1043245469 /nfs/dbraw/zinc/24/54/69/1043245469.db2.gz OJSXVQNACOSFBD-OAHLLOKOSA-N -1 3 337.341 4.348 20 0 EIADHM O=C(Nc1ccc(-n2cccn2)c(F)c1)c1cc([O-])c2ccccc2c1 ZINC000527157787 1043251645 /nfs/dbraw/zinc/25/16/45/1043251645.db2.gz VQRWYFIXSPQIPL-UHFFFAOYSA-N -1 3 347.349 4.123 20 0 EIADHM O=C(N[C@H](c1ccccc1)[C@H]1CCCO1)c1cc([O-])c2ccccc2c1 ZINC000527450143 1043260275 /nfs/dbraw/zinc/26/02/75/1043260275.db2.gz PVUKNIALENOKBG-NHCUHLMSSA-N -1 3 347.414 4.196 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)C1(c2ccc(F)cc2)CCCCC1 ZINC000427945964 1043269549 /nfs/dbraw/zinc/26/95/49/1043269549.db2.gz HZYTXZFAOYTOEQ-UHFFFAOYSA-N -1 3 345.389 4.189 20 0 EIADHM O=C(c1ccccc1[O-])N(CCc1ccc(F)cc1)C1CCCC1 ZINC000220120062 1043292900 /nfs/dbraw/zinc/29/29/00/1043292900.db2.gz PGQSOHQYTWIDMY-UHFFFAOYSA-N -1 3 327.399 4.159 20 0 EIADHM COc1ccc(Cl)c(S(=O)(=O)[N-]c2ccc(C)cc2Cl)c1 ZINC000487407968 1043296566 /nfs/dbraw/zinc/29/65/66/1043296566.db2.gz TUGQMSFQMOBYQC-UHFFFAOYSA-N -1 3 346.235 4.111 20 0 EIADHM C[C@@H](C(=O)[N-][C@@H](c1ccc(F)c(Cl)c1)C(F)(F)F)C(C)(F)F ZINC000508175643 1043303457 /nfs/dbraw/zinc/30/34/57/1043303457.db2.gz WGWWYWUMZRONPR-WKEGUHRASA-N -1 3 347.686 4.490 20 0 EIADHM CCCOc1ccc(Cl)cc1NC(=O)c1cc(OC)ccc1[O-] ZINC001626093255 1043305878 /nfs/dbraw/zinc/30/58/78/1043305878.db2.gz QSZJPTOQTLLLGZ-UHFFFAOYSA-N -1 3 335.787 4.095 20 0 EIADHM [O-]c1c(F)cc(F)cc1Nc1noc2cc(Br)ccc21 ZINC001212478063 1043406960 /nfs/dbraw/zinc/40/69/60/1043406960.db2.gz SJMMKRVXZAKWRJ-UHFFFAOYSA-N -1 3 341.111 4.318 20 0 EIADHM COc1ccc(C(=O)N[C@@H](C)c2csc3ccccc32)c([O-])c1 ZINC000729960558 1043418009 /nfs/dbraw/zinc/41/80/09/1043418009.db2.gz NCOOCTSWQYMIPY-NSHDSACASA-N -1 3 327.405 4.107 20 0 EIADHM CSc1ccncc1[N-]C(=O)c1nc(-c2ccccc2)oc1C ZINC000674255184 1043502543 /nfs/dbraw/zinc/50/25/43/1043502543.db2.gz AUEUNUYALQVBJL-UHFFFAOYSA-N -1 3 325.393 4.019 20 0 EIADHM Cc1nc2cc(F)ccc2cc1C(=O)Nc1cc(Cl)ccc1[O-] ZINC000521338538 1043714005 /nfs/dbraw/zinc/71/40/05/1043714005.db2.gz SBNLKPSWIPFPSZ-UHFFFAOYSA-N -1 3 330.746 4.294 20 0 EIADHM Cc1ccc(C(=O)Nc2ncc(Cc3ccc(F)cc3)s2)c([O-])c1 ZINC001626099542 1043714275 /nfs/dbraw/zinc/71/42/75/1043714275.db2.gz WEJNHPGTVUUCJJ-UHFFFAOYSA-N -1 3 342.395 4.139 20 0 EIADHM O=C(OCc1ncc(-c2cccs2)o1)c1cc(Cl)c(Cl)[n-]1 ZINC000731509905 1043779330 /nfs/dbraw/zinc/77/93/30/1043779330.db2.gz RTKBKWKABQXLMO-UHFFFAOYSA-N -1 3 343.191 4.395 20 0 EIADHM CSc1cc(O)ccc1[N-]C(=O)c1ncoc1-c1ccc(F)cc1 ZINC000191554566 1043825457 /nfs/dbraw/zinc/82/54/57/1043825457.db2.gz QXSMXCVHDZILIR-UHFFFAOYSA-N -1 3 344.367 4.161 20 0 EIADHM CC(C)c1ccc(C(=O)COC(=O)c2cncc([O-])c2)c(C(C)C)c1 ZINC000732394786 1043911646 /nfs/dbraw/zinc/91/16/46/1043911646.db2.gz VLNDAPLWJWGIRI-UHFFFAOYSA-N -1 3 341.407 4.074 20 0 EIADHM CC(C)(C(=O)[O-])[C@@H]1CCCN(Cc2ccc(Cl)c(Cl)c2)C1 ZINC000169106178 1043960341 /nfs/dbraw/zinc/96/03/41/1043960341.db2.gz ZDPARSOQRZJSMY-GFCCVEGCSA-N -1 3 330.255 4.316 20 0 EIADHM COc1cccc(C(=O)C(F)(F)F)c1Nc1cccc([O-])c1F ZINC001212553358 1044290159 /nfs/dbraw/zinc/29/01/59/1044290159.db2.gz OZEGHRSMVBZHSY-UHFFFAOYSA-N -1 3 329.249 4.029 20 0 EIADHM [O-]c1ccc(-c2nc(-c3ccc(Cl)c(C(F)(F)F)c3)no2)nc1 ZINC001212557871 1044306208 /nfs/dbraw/zinc/30/62/08/1044306208.db2.gz FGPIURWXTGQMFH-UHFFFAOYSA-N -1 3 341.676 4.176 20 0 EIADHM O=C([N-]c1ccccc1SCC(F)(F)F)c1ocnc1C1CC1 ZINC000673458685 1044417766 /nfs/dbraw/zinc/41/77/66/1044417766.db2.gz CKAJAVJOZGIRGG-UHFFFAOYSA-N -1 3 342.342 4.459 20 0 EIADHM O=C([N-]c1nnc(-c2ccco2)s1)c1ccc(-c2ccco2)s1 ZINC000675751376 1044463972 /nfs/dbraw/zinc/46/39/72/1044463972.db2.gz VJVNHPUCKWQXEQ-UHFFFAOYSA-N -1 3 343.389 4.372 20 0 EIADHM Cc1cc(Cl)ccc1O[C@H](C)C(=O)Nc1cc(Cl)ccc1[O-] ZINC000069693361 1044560714 /nfs/dbraw/zinc/56/07/14/1044560714.db2.gz YMTYBDNRKAVWTJ-SNVBAGLBSA-N -1 3 340.206 4.413 20 0 EIADHM Cc1ccc(NC(=O)[C@H](C)OC(=O)c2cc3ccsc3[n-]2)c(C)c1 ZINC000914889378 1044852001 /nfs/dbraw/zinc/85/20/01/1044852001.db2.gz HVVSFCITSXXNRM-LBPRGKRZSA-N -1 3 342.420 4.030 20 0 EIADHM CCC[C@@H]1CCc2nc([N-]C(=O)c3ocnc3C(F)F)sc2C1 ZINC000624964405 1044908235 /nfs/dbraw/zinc/90/82/35/1044908235.db2.gz NTWHRZQAVKSIPW-MRVPVSSYSA-N -1 3 341.383 4.226 20 0 EIADHM Cc1oc(-c2ccccc2F)nc1C(=O)Nc1cc(Cl)ccc1[O-] ZINC000738514518 1045063399 /nfs/dbraw/zinc/06/33/99/1045063399.db2.gz XHALWPZVXNDUIK-UHFFFAOYSA-N -1 3 346.745 4.400 20 0 EIADHM Cc1noc(C(F)F)c1C(=O)[N-]c1nc2ccc(Cl)cc2s1 ZINC000673698993 1045209559 /nfs/dbraw/zinc/20/95/59/1045209559.db2.gz FHQFCUULTDVJOY-UHFFFAOYSA-N -1 3 343.742 4.436 20 0 EIADHM CSCc1c2ccccc2oc1C(=O)Nc1cccc([O-])c1F ZINC000611191137 1045260930 /nfs/dbraw/zinc/26/09/30/1045260930.db2.gz QCRCDIFGEARYLC-UHFFFAOYSA-N -1 3 331.368 4.393 20 0 EIADHM O=C([N-]c1ccccc1SC(F)F)c1cc(-c2ccncc2)on1 ZINC000193710277 1045446970 /nfs/dbraw/zinc/44/69/70/1045446970.db2.gz PXEPRIMWFCIXRI-UHFFFAOYSA-N -1 3 347.346 4.304 20 0 EIADHM CCn1ncc2ccc(NC(=O)c3cc4sccc4c([O-])c3)cc21 ZINC000791347250 1045728256 /nfs/dbraw/zinc/72/82/56/1045728256.db2.gz LDZLRLRIBOMYQH-UHFFFAOYSA-N -1 3 337.404 4.229 20 0 EIADHM O=C1c2cc(Cl)ccc2N[C@@H](c2ccc([O-])c(F)c2)N1CC1CC1 ZINC000533713429 1045808469 /nfs/dbraw/zinc/80/84/69/1045808469.db2.gz VAJGBUYVQNBQBV-QGZVFWFLSA-N -1 3 346.789 4.161 20 0 EIADHM COc1cc(Nc2ccc([O-])c(F)c2F)ccc1Br ZINC001212009455 1045831547 /nfs/dbraw/zinc/83/15/47/1045831547.db2.gz PEFOQFFVOMKGAS-UHFFFAOYSA-N -1 3 330.128 4.185 20 0 EIADHM [O-]c1ccc(Nc2cccc(I)c2)c(F)c1F ZINC001212009508 1045832274 /nfs/dbraw/zinc/83/22/74/1045832274.db2.gz REEGPPMFOBCUSG-UHFFFAOYSA-N -1 3 347.102 4.019 20 0 EIADHM [O-]c1ccc(Nc2ccc(N3CCSCC3)c(F)c2)c(F)c1F ZINC001212013624 1045834720 /nfs/dbraw/zinc/83/47/20/1045834720.db2.gz ATJWNLXCWGCQIV-UHFFFAOYSA-N -1 3 340.370 4.106 20 0 EIADHM COc1ccc(-c2ccccc2Nc2ccc([O-])c(F)c2F)nc1 ZINC001212016325 1045839164 /nfs/dbraw/zinc/83/91/64/1045839164.db2.gz KEVDBEFRKVYSOC-UHFFFAOYSA-N -1 3 328.318 4.485 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N1CCS[C@@H](c2ccccc2)C1 ZINC000792186347 1045877118 /nfs/dbraw/zinc/87/71/18/1045877118.db2.gz OTVIBBGXMARSGA-HXUWFJFHSA-N -1 3 349.455 4.476 20 0 EIADHM Cc1cccc(CC2CN(C(=O)c3cc([O-])c4ccccc4c3)C2)c1 ZINC000792211166 1045882080 /nfs/dbraw/zinc/88/20/80/1045882080.db2.gz BFWMYRXWVOLLRC-UHFFFAOYSA-N -1 3 331.415 4.169 20 0 EIADHM CC(C)[C@H](NC(=O)c1cc([O-])c2ccccc2c1)[C@@H](O)c1ccccc1 ZINC000792492630 1045898253 /nfs/dbraw/zinc/89/82/53/1045898253.db2.gz ZRRSTHVIQFLYQM-SFTDATJTSA-N -1 3 349.430 4.033 20 0 EIADHM CC(C)(C)c1ccc(O)c([N-]S(=O)(=O)/C=C/c2ccccc2)c1 ZINC000916103638 1045912413 /nfs/dbraw/zinc/91/24/13/1045912413.db2.gz UFJKPEIGAFBINZ-VAWYXSNFSA-N -1 3 331.437 4.102 20 0 EIADHM CC(C)C[C@@H](NC(=O)OC(C)(C)C)c1noc(-c2ccccc2[O-])n1 ZINC000496400030 1045935629 /nfs/dbraw/zinc/93/56/29/1045935629.db2.gz OUNUMJGQADMZJY-CYBMUJFWSA-N -1 3 347.415 4.054 20 0 EIADHM CCN(c1ccc(NC(=O)c2c[n-]c3ccccc3c2=O)cc1)C(C)C ZINC000032978798 1046172619 /nfs/dbraw/zinc/17/26/19/1046172619.db2.gz XNUFATHVHFJNEF-UHFFFAOYSA-N -1 3 349.434 4.015 20 0 EIADHM Cn1cc(CC(=O)Nc2ccc([O-])c(C(F)(F)F)c2)c2ccccc21 ZINC000125285891 1046296670 /nfs/dbraw/zinc/29/66/70/1046296670.db2.gz VCUNRQOAZWCGNK-UHFFFAOYSA-N -1 3 348.324 4.084 20 0 EIADHM CSc1ccsc1C(=O)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000125381631 1046303079 /nfs/dbraw/zinc/30/30/79/1046303079.db2.gz RHXDYXPPAJSQFU-UHFFFAOYSA-N -1 3 333.356 4.447 20 0 EIADHM CC(C)O[C@@H](CO[N-]C(=O)CCCc1ccccc1)c1ccccc1 ZINC000793836269 1046338222 /nfs/dbraw/zinc/33/82/22/1046338222.db2.gz VKKMIIMJTZLULZ-FQEVSTJZSA-N -1 3 341.451 4.223 20 0 EIADHM CSc1ccsc1C(=O)Nc1cc(Br)ccc1[O-] ZINC000126512983 1046493695 /nfs/dbraw/zinc/49/36/95/1046493695.db2.gz SCOFXEXZLGWVDD-UHFFFAOYSA-N -1 3 344.255 4.190 20 0 EIADHM C[C@H]1Cc2ccccc2[C@H]1NCc1cccc([O-])c1Br ZINC000459413374 1046636404 /nfs/dbraw/zinc/63/64/04/1046636404.db2.gz WZWHXXAVTSHWNO-GTNSWQLSSA-N -1 3 332.241 4.178 20 0 EIADHM Cc1cccnc1[C@H](NCc1cccc([O-])c1Br)C(C)C ZINC000459416907 1046642579 /nfs/dbraw/zinc/64/25/79/1046642579.db2.gz TYXAGGZSINWLCX-MRXNPFEDSA-N -1 3 349.272 4.345 20 0 EIADHM [O-]c1cccc(CNc2ccc([C@H]3CCOC3)cc2)c1Br ZINC000459582614 1046778462 /nfs/dbraw/zinc/77/84/62/1046778462.db2.gz DZLOEHYUFVCWDQ-AWEZNQCLSA-N -1 3 348.240 4.271 20 0 EIADHM CCOc1cc(CN2CC(C)(C)[C@@H]2c2cccnc2)cc(Cl)c1[O-] ZINC000459565027 1046788101 /nfs/dbraw/zinc/78/81/01/1046788101.db2.gz XHUWSMHAXJDWGH-SFHVURJKSA-N -1 3 346.858 4.422 20 0 EIADHM CCOc1cc(CN2CC(C)(C)[C@H]2c2cccnc2)cc(Cl)c1[O-] ZINC000459565026 1046788686 /nfs/dbraw/zinc/78/86/86/1046788686.db2.gz XHUWSMHAXJDWGH-GOSISDBHSA-N -1 3 346.858 4.422 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)N(CCc1ccccc1)C1CC1 ZINC000786844089 1046876002 /nfs/dbraw/zinc/87/60/02/1046876002.db2.gz TZERGEMQCFDWNS-UHFFFAOYSA-N -1 3 341.426 4.088 20 0 EIADHM CCc1ccc(C(=O)N2CCC(c3cccc(F)c3)CC2)c([O-])c1 ZINC000787115187 1046910098 /nfs/dbraw/zinc/91/00/98/1046910098.db2.gz NCXGMOJEFGVULM-UHFFFAOYSA-N -1 3 327.399 4.114 20 0 EIADHM O=C(CCc1ccc(Cl)c(Cl)c1)Nc1cccc([O-])c1F ZINC000128615415 1046994415 /nfs/dbraw/zinc/99/44/15/1046994415.db2.gz WCCYAYXHOQIDRI-UHFFFAOYSA-N -1 3 328.170 4.409 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)OCc1nc2ccccc2s1 ZINC000787844380 1047058760 /nfs/dbraw/zinc/05/87/60/1047058760.db2.gz KBXIUMQJCQPCTD-UHFFFAOYSA-N -1 3 345.395 4.207 20 0 EIADHM CC(C)COc1ccccc1[N-]S(=O)(=O)/C=C\c1ccccc1 ZINC000917756603 1047096443 /nfs/dbraw/zinc/09/64/43/1047096443.db2.gz GZPUFCCFBGFJMZ-SEYXRHQNSA-N -1 3 331.437 4.134 20 0 EIADHM CC(C)(C)c1csc(CNC(=O)c2cc3sccc3c([O-])c2)n1 ZINC000788302186 1047153512 /nfs/dbraw/zinc/15/35/12/1047153512.db2.gz WOWSYIJHZJAYKD-UHFFFAOYSA-N -1 3 346.477 4.291 20 0 EIADHM CCOCc1ccc(CNC(=O)c2cc3sccc3c([O-])c2)cc1 ZINC000788280424 1047156942 /nfs/dbraw/zinc/15/69/42/1047156942.db2.gz LKMKNEHXWVCBAT-UHFFFAOYSA-N -1 3 341.432 4.073 20 0 EIADHM Cc1cc(S(=O)(=O)[N-]c2ccc3[nH]ccc3c2)ccc1OC(C)C ZINC000497944488 1047211410 /nfs/dbraw/zinc/21/14/10/1047211410.db2.gz PRIBOGIPKOWSPR-UHFFFAOYSA-N -1 3 344.436 4.064 20 0 EIADHM O=C(CCCCc1nc2ccccc2s1)Nc1cccc([O-])c1F ZINC000129023443 1047246865 /nfs/dbraw/zinc/24/68/65/1047246865.db2.gz JLYHWVBVQHHEKI-UHFFFAOYSA-N -1 3 344.411 4.493 20 0 EIADHM CC(C)c1ncc(C(=O)[N-]c2nc(-c3ccccc3)ns2)s1 ZINC000129178276 1047327256 /nfs/dbraw/zinc/32/72/56/1047327256.db2.gz ZKAIPBBDLPEIBR-UHFFFAOYSA-N -1 3 330.438 4.037 20 0 EIADHM CCCCc1ccc(C(=O)CCC(=O)Nc2cccc([O-])c2F)cc1 ZINC000129312587 1047349747 /nfs/dbraw/zinc/34/97/47/1047349747.db2.gz LVPJMICKIVJWFJ-UHFFFAOYSA-N -1 3 343.398 4.476 20 0 EIADHM COc1cc(C2(C(=O)Nc3cccc([O-])c3F)CCCC2)ccc1C ZINC000129349591 1047354402 /nfs/dbraw/zinc/35/44/02/1047354402.db2.gz VVBBEJOIUVQVKG-UHFFFAOYSA-N -1 3 343.398 4.299 20 0 EIADHM O=C(O[C@H](c1ccccn1)C(F)(F)F)c1cc2ccsc2[n-]1 ZINC000747357277 1047372921 /nfs/dbraw/zinc/37/29/21/1047372921.db2.gz GZEVEUZTNRRTQO-LLVKDONJSA-N -1 3 326.299 4.085 20 0 EIADHM O=C([N-]c1cc(C(F)F)ccc1F)c1cc(-c2ccccn2)no1 ZINC001130773312 1047380920 /nfs/dbraw/zinc/38/09/20/1047380920.db2.gz HFEJVYRFAXOZMZ-UHFFFAOYSA-N -1 3 333.269 4.066 20 0 EIADHM CC[C@H](OC1CCCCC1)C(=O)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000476163002 1047393169 /nfs/dbraw/zinc/39/31/69/1047393169.db2.gz PPAGWBIOCCSKIX-HNNXBMFYSA-N -1 3 345.361 4.477 20 0 EIADHM Cc1ccccc1C1(C(=O)Nc2ccc([O-])c(C(F)(F)F)c2)CC1 ZINC000476169891 1047399186 /nfs/dbraw/zinc/39/91/86/1047399186.db2.gz SGJKDLNTAZDPPW-UHFFFAOYSA-N -1 3 335.325 4.390 20 0 EIADHM O=C(CSc1ccc(F)cc1)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000476179977 1047401895 /nfs/dbraw/zinc/40/18/95/1047401895.db2.gz WEHGSHIMRBDOEM-UHFFFAOYSA-N -1 3 345.317 4.281 20 0 EIADHM O=C(Cc1ccc(F)cc1Cl)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000476172903 1047402531 /nfs/dbraw/zinc/40/25/31/1047402531.db2.gz UFNHDDGOUOBSSY-UHFFFAOYSA-N -1 3 347.695 4.385 20 0 EIADHM CC(C)CCn1ncc([N-]S(=O)(=O)C2=CCCCC2)c1C(C)C ZINC000829931698 1047432273 /nfs/dbraw/zinc/43/22/73/1047432273.db2.gz SFAZFMBRRSJDJG-UHFFFAOYSA-N -1 3 339.505 4.252 20 0 EIADHM C[C@@H]1CN(C(=O)c2cc([O-])ccc2Cl)CC[C@@H]1c1ccccc1 ZINC000556352498 1047700520 /nfs/dbraw/zinc/70/05/20/1047700520.db2.gz AYRJFNZFXOXZCR-CJNGLKHVSA-N -1 3 329.827 4.311 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2cccc(COC(C)(C)C)c2C)cc1 ZINC000476389988 1047756383 /nfs/dbraw/zinc/75/63/83/1047756383.db2.gz HKRCKUFJUMDRFQ-UHFFFAOYSA-N -1 3 347.480 4.419 20 0 EIADHM O=C(Nc1cc(Br)ccc1[O-])[C@H](c1ccccc1)C1CC1 ZINC000498648895 1047803090 /nfs/dbraw/zinc/80/30/90/1047803090.db2.gz DIQQXCPIGAPZCG-MRXNPFEDSA-N -1 3 346.224 4.287 20 0 EIADHM COc1ccc(-c2nc(C(=O)[N-]c3c(F)cccc3F)cs2)cc1 ZINC000071804385 1047804306 /nfs/dbraw/zinc/80/43/06/1047804306.db2.gz YGIGRPBCTSXUQB-UHFFFAOYSA-N -1 3 346.358 4.349 20 0 EIADHM Cc1ccc(-c2cc(C(=O)O[C@@H](C)c3ccc(F)c(F)c3)n[n-]2)o1 ZINC000919329077 1047814150 /nfs/dbraw/zinc/81/41/50/1047814150.db2.gz UNVHVTNOGMJGDD-JTQLQIEISA-N -1 3 332.306 4.174 20 0 EIADHM Cc1ccc(-c2cc(C(=O)O[C@@H](C)c3ccc(F)c(F)c3)[n-]n2)o1 ZINC000919329077 1047814152 /nfs/dbraw/zinc/81/41/52/1047814152.db2.gz UNVHVTNOGMJGDD-JTQLQIEISA-N -1 3 332.306 4.174 20 0 EIADHM CCc1ccc(C(=O)Nc2ccc(F)cc2OCC2CC2)c([O-])c1 ZINC001136855316 1047854794 /nfs/dbraw/zinc/85/47/94/1047854794.db2.gz XSFCKMGHUYXBLJ-UHFFFAOYSA-N -1 3 329.371 4.135 20 0 EIADHM CC(C)c1cc(C(=O)[N-]c2ccc(F)c(Br)c2F)on1 ZINC001131387993 1048030639 /nfs/dbraw/zinc/03/06/39/1048030639.db2.gz ICUYETVUOSNIEL-UHFFFAOYSA-N -1 3 345.143 4.091 20 0 EIADHM Cc1nc(C(=O)[N-]c2c(F)ccc(Br)c2F)sc1C ZINC001134408318 1048036917 /nfs/dbraw/zinc/03/69/17/1048036917.db2.gz KWZZGYMXMLFNSO-UHFFFAOYSA-N -1 3 347.184 4.053 20 0 EIADHM CC(=O)c1cccc(NC(=O)c2cc3cc(C)ccc3nc2C)c1[O-] ZINC000556891514 1048134283 /nfs/dbraw/zinc/13/42/83/1048134283.db2.gz BLYNABBSXKDQTC-UHFFFAOYSA-N -1 3 334.375 4.012 20 0 EIADHM [O-]c1ccccc1-c1nc(-c2c(Cl)nc3cc(Cl)ccn32)no1 ZINC000809531597 1048394979 /nfs/dbraw/zinc/39/49/79/1048394979.db2.gz HTYMAAZDWAEKBC-UHFFFAOYSA-N -1 3 347.161 4.064 20 0 EIADHM CC1(C)CN(C(=O)c2cc3sccc3c([O-])c2)[C@H]1c1ccco1 ZINC001170786075 1048464521 /nfs/dbraw/zinc/46/45/21/1048464521.db2.gz BFXJPJIPHDKHLO-INIZCTEOSA-N -1 3 327.405 4.423 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)[C@@H]1C[C@@H]1c1ccc2ccccc2c1 ZINC000132742527 1048481449 /nfs/dbraw/zinc/48/14/49/1048481449.db2.gz ILJDTIWIOAXYME-QZTJIDSGSA-N -1 3 335.378 4.104 20 0 EIADHM Cc1ccc([C@H]2C[C@@H](C)CCN2C(=O)NCc2ccc([O-])c(F)c2)o1 ZINC000074375304 1048485301 /nfs/dbraw/zinc/48/53/01/1048485301.db2.gz GFQJSQPZLGAADK-BLLLJJGKSA-N -1 3 346.402 4.116 20 0 EIADHM CC(=O)c1ccc(C(=O)N2Cc3ccccc3-c3ccccc32)cc1[O-] ZINC001144212321 1048497689 /nfs/dbraw/zinc/49/76/89/1048497689.db2.gz QTGQNFBWNMZAQD-UHFFFAOYSA-N -1 3 343.382 4.422 20 0 EIADHM C[C@@H]1CC(=O)c2c1c(F)ccc2OC(=O)c1cc2ccsc2[n-]1 ZINC000920153632 1048529981 /nfs/dbraw/zinc/52/99/81/1048529981.db2.gz ADIYXCFPRBFQST-MRVPVSSYSA-N -1 3 329.352 4.278 20 0 EIADHM CSc1ccc([O-])c(C(=O)NCCc2ccc(C(C)C)cc2)c1 ZINC001135296239 1048643808 /nfs/dbraw/zinc/64/38/08/1048643808.db2.gz OQGOCJMZUGZKKG-UHFFFAOYSA-N -1 3 329.465 4.210 20 0 EIADHM Cc1sc2[n-]c([C@H](C)OC(=O)C[C@H](C)C3CC3)nc(=O)c2c1C ZINC000920728702 1048763274 /nfs/dbraw/zinc/76/32/74/1048763274.db2.gz QMETULUKFGMQGT-WPRPVWTQSA-N -1 3 334.441 4.054 20 0 EIADHM [O-]c1cc(F)c(CN2CCC(n3ccc4ccccc43)CC2)cc1F ZINC001144659301 1048794462 /nfs/dbraw/zinc/79/44/62/1048794462.db2.gz CGFFZURTYMAYIO-UHFFFAOYSA-N -1 3 342.389 4.462 20 0 EIADHM CN(Cc1sccc1C(=O)[O-])Cc1cccc(C(F)(F)F)c1 ZINC001144678346 1048800404 /nfs/dbraw/zinc/80/04/04/1048800404.db2.gz WVGBXOQOBRNOBL-UHFFFAOYSA-N -1 3 329.343 4.097 20 0 EIADHM [O-]c1ccc(F)c(CN2CCC[C@H]2c2ccc(F)c(F)c2)c1F ZINC000816511822 1048822907 /nfs/dbraw/zinc/82/29/07/1048822907.db2.gz LUSSMVWNEBCOCY-HNNXBMFYSA-N -1 3 325.305 4.286 20 0 EIADHM C[C@@H](OC(=O)c1cc2cc(Cl)sc2[n-]1)c1ncc(Cl)n1C ZINC000810652949 1048834505 /nfs/dbraw/zinc/83/45/05/1048834505.db2.gz QELDKXXYNJNQQZ-ZCFIWIBFSA-N -1 3 344.223 4.188 20 0 EIADHM O=C([N-][C@@H]1CCc2c1cccc2F)C(F)(F)c1cccc(Cl)c1 ZINC000921006700 1048838094 /nfs/dbraw/zinc/83/80/94/1048838094.db2.gz FGZJBCHDEIMOLV-OAHLLOKOSA-N -1 3 339.744 4.375 20 0 EIADHM O=C(OCC1(C2CC2)CCOCC1)c1cc2cc(Cl)sc2[n-]1 ZINC000810677518 1048845518 /nfs/dbraw/zinc/84/55/18/1048845518.db2.gz MWANZJGKCPLHJW-UHFFFAOYSA-N -1 3 339.844 4.246 20 0 EIADHM CC[C@H](C)[C@@H](C)N(C(=O)c1cc([O-])cc(Br)c1)C1CC1 ZINC001144848418 1048868190 /nfs/dbraw/zinc/86/81/90/1048868190.db2.gz AJNJDORXZXPXGE-WDEREUQCSA-N -1 3 340.261 4.194 20 0 EIADHM CCCC[C@@](CC)(Nc1ccc2c(c1)[N-]C(=S)C2)C(=O)OCC ZINC001171232333 1048878507 /nfs/dbraw/zinc/87/85/07/1048878507.db2.gz HVEWQOYBDWRACK-GOSISDBHSA-N -1 3 334.485 4.296 20 0 EIADHM O=C(Nc1ccc([O-])c(C(F)(F)F)c1)[C@H]1CSc2ccccc21 ZINC000134111950 1048884128 /nfs/dbraw/zinc/88/41/28/1048884128.db2.gz GLMQLSWARRCJPM-NSHDSACASA-N -1 3 339.338 4.239 20 0 EIADHM Cc1nnsc1C(=O)[N-]c1ccccc1SCc1ccccc1 ZINC000921242050 1048889199 /nfs/dbraw/zinc/88/91/99/1048889199.db2.gz JKMQFLKZJODLCS-UHFFFAOYSA-N -1 3 341.461 4.391 20 0 EIADHM Cc1cccc2[nH]cc(CC(=O)Nc3ccc([O-])c(C(F)(F)F)c3)c21 ZINC000134215367 1048898506 /nfs/dbraw/zinc/89/85/06/1048898506.db2.gz OPTXCBRRHHYIPR-UHFFFAOYSA-N -1 3 348.324 4.382 20 0 EIADHM CCC[C@H](C(=O)Nc1cccc(-c2nc(CC)cc(=O)[n-]2)c1)C(C)C ZINC000134318871 1048934665 /nfs/dbraw/zinc/93/46/65/1048934665.db2.gz NZEPNYQOGXUPDI-KRWDZBQOSA-N -1 3 341.455 4.010 20 0 EIADHM COC(=O)c1oc(C(=O)[N-]c2cc(Cl)cc(Cl)c2F)cc1C ZINC001132588892 1048941223 /nfs/dbraw/zinc/94/12/23/1048941223.db2.gz YHFPBHOJMULNBA-UHFFFAOYSA-N -1 3 346.141 4.073 20 0 EIADHM O=C([N-]CC1CC(F)(F)C1)C(F)(F)c1cc(Cl)ccc1Cl ZINC000817453557 1048969268 /nfs/dbraw/zinc/96/92/68/1048969268.db2.gz VCTLVKLCZGEXTJ-UHFFFAOYSA-N -1 3 344.135 4.247 20 0 EIADHM CCc1cccc(C(=O)N[C@@H](c2ccc(OC)cc2)C(C)C)c1[O-] ZINC001135978237 1049031925 /nfs/dbraw/zinc/03/19/25/1049031925.db2.gz KSFQJEDZXLELGH-GOSISDBHSA-N -1 3 327.424 4.090 20 0 EIADHM CCc1ccc([C@@H]2CCCCCN2C(=O)c2ccc(OC)cc2[O-])o1 ZINC001147299135 1049118585 /nfs/dbraw/zinc/11/85/85/1049118585.db2.gz VOZWYZZJHXKFGM-KRWDZBQOSA-N -1 3 343.423 4.314 20 0 EIADHM O=C(NC[C@@H]1CCC[C@@H]2C[C@@H]21)c1cc(Cc2ccccc2)ccc1[O-] ZINC001147566007 1049191084 /nfs/dbraw/zinc/19/10/84/1049191084.db2.gz ZRQZNRLPKAXRNV-QYZOEREBSA-N -1 3 335.447 4.149 20 0 EIADHM CCCC[C@@H](C)N(CCCC)C(=O)c1nnc2ccccc2c1[O-] ZINC000818925068 1049222816 /nfs/dbraw/zinc/22/28/16/1049222816.db2.gz UUZVVTIFRUYMGY-CQSZACIVSA-N -1 3 329.444 4.156 20 0 EIADHM Cc1ccc(C(=O)Nc2ccc(C(=O)OC(C)(C)C)cc2[O-])c(C)c1 ZINC001148253053 1049290531 /nfs/dbraw/zinc/29/05/31/1049290531.db2.gz VPCKPOUBWVDIPH-UHFFFAOYSA-N -1 3 341.407 4.217 20 0 EIADHM C[C@@H]1CCC[C@@H](NC(=O)c2cc(CCc3ccccc3)ccc2[O-])C1 ZINC001136204256 1049293373 /nfs/dbraw/zinc/29/33/73/1049293373.db2.gz ISLMRSDLNDAYDL-VQIMIIECSA-N -1 3 337.463 4.486 20 0 EIADHM O=C(Nc1ccc(F)c([O-])c1)c1ccc(C(=O)c2ccccc2)cc1 ZINC001148290278 1049299518 /nfs/dbraw/zinc/29/95/18/1049299518.db2.gz DGAYYGXRDJFWNT-UHFFFAOYSA-N -1 3 335.334 4.015 20 0 EIADHM Cc1ccc(C(=O)N2CCC(n3ccc4ccccc43)CC2)c([O-])c1 ZINC001148504425 1049327890 /nfs/dbraw/zinc/32/78/90/1049327890.db2.gz QACOHVMLMIGPAJ-UHFFFAOYSA-N -1 3 334.419 4.133 20 0 EIADHM CC(=O)c1cc(C(=O)Nc2ccc3sc(Cl)nc3c2)ccc1[O-] ZINC001148663745 1049356179 /nfs/dbraw/zinc/35/61/79/1049356179.db2.gz FHAPGBPWTHAFPI-UHFFFAOYSA-N -1 3 346.795 4.110 20 0 EIADHM Cc1cccc(Oc2ncccc2[N-]C(=O)c2cc(Cl)no2)c1C ZINC001136330346 1049482712 /nfs/dbraw/zinc/48/27/12/1049482712.db2.gz JMNCOWIEJBVKTI-UHFFFAOYSA-N -1 3 343.770 4.384 20 0 EIADHM CCCN(C(=O)c1cc([O-])ccc1Cl)[C@@H]1CCc2ccccc2C1 ZINC001136388302 1049571560 /nfs/dbraw/zinc/57/15/60/1049571560.db2.gz OXIOCEPEHPXYLD-MRXNPFEDSA-N -1 3 343.854 4.455 20 0 EIADHM CCc1ccc([O-])c(C(=O)N2CCC[C@@H]2Cc2ccccc2Cl)c1 ZINC001136408426 1049592580 /nfs/dbraw/zinc/59/25/80/1049592580.db2.gz NCECWMFLHRPCST-MRXNPFEDSA-N -1 3 343.854 4.455 20 0 EIADHM C[C@H](NCc1cc(Cl)cc([N+](=O)[O-])c1[O-])c1ccc(F)cc1F ZINC000237570388 1049618976 /nfs/dbraw/zinc/61/89/76/1049618976.db2.gz BIMDAEBELKMFMJ-QMMMGPOBSA-N -1 3 342.729 4.083 20 0 EIADHM CC[C@H]1CCC[C@@]1(C)C(=O)Nc1ccc(Br)cc1[O-] ZINC001441343878 1049632385 /nfs/dbraw/zinc/63/23/85/1049632385.db2.gz RTSYCCOMHYGPQB-ZUZCIYMTSA-N -1 3 326.234 4.310 20 0 EIADHM CC(C)n1ncc2ccc(NC(=O)c3cc4c(cc3[O-])CCCC4)cc21 ZINC001136569310 1049746722 /nfs/dbraw/zinc/74/67/22/1049746722.db2.gz ODYBWBHNBQQDKV-UHFFFAOYSA-N -1 3 349.434 4.454 20 0 EIADHM [O-]c1ccc(CNCc2nc(-c3ccccc3F)cs2)cc1F ZINC000813338519 1049755681 /nfs/dbraw/zinc/75/56/81/1049755681.db2.gz KQAOCEQIUHECQQ-UHFFFAOYSA-N -1 3 332.375 4.084 20 0 EIADHM C[C@@H]1CCCCN1C(=O)c1ccc(NCc2ccc([O-])c(F)c2)cc1 ZINC000813339027 1049756008 /nfs/dbraw/zinc/75/60/08/1049756008.db2.gz YTTCTQKYXKXPFE-CQSZACIVSA-N -1 3 342.414 4.158 20 0 EIADHM CCCC[C@@](C)(F)C(=O)Nc1cccc(-c2nc(CC)cc(=O)[n-]2)c1 ZINC000822405788 1049759705 /nfs/dbraw/zinc/75/97/05/1049759705.db2.gz YIEBKHICBONTDT-LJQANCHMSA-N -1 3 345.418 4.269 20 0 EIADHM CC(C)Cc1coc([N-]C(=O)c2cc(-c3c(F)cccc3F)no2)n1 ZINC001133922597 1049816835 /nfs/dbraw/zinc/81/68/35/1049816835.db2.gz PVJSLRRDGJXWLZ-UHFFFAOYSA-N -1 3 347.321 4.059 20 0 EIADHM CN(C(=O)c1[n-]cnc1C(F)(F)F)c1ccc(C(C)(C)C)cc1 ZINC000823150888 1049823842 /nfs/dbraw/zinc/82/38/42/1049823842.db2.gz GUFJFKHORYHZEU-UHFFFAOYSA-N -1 3 325.334 4.003 20 0 EIADHM CN(C(=O)c1nc[n-]c1C(F)(F)F)c1ccc(C(C)(C)C)cc1 ZINC000823150888 1049823846 /nfs/dbraw/zinc/82/38/46/1049823846.db2.gz GUFJFKHORYHZEU-UHFFFAOYSA-N -1 3 325.334 4.003 20 0 EIADHM Cc1ccc(-c2noc(-c3[n-]nnc3C(F)(F)F)n2)c2ccccc12 ZINC001212652977 1049881641 /nfs/dbraw/zinc/88/16/41/1049881641.db2.gz RDFWNIFZUDDNTG-UHFFFAOYSA-N -1 3 345.284 4.002 20 0 EIADHM Cc1ccc(-c2noc(-c3nn[n-]c3C(F)(F)F)n2)c2ccccc12 ZINC001212652977 1049881646 /nfs/dbraw/zinc/88/16/46/1049881646.db2.gz RDFWNIFZUDDNTG-UHFFFAOYSA-N -1 3 345.284 4.002 20 0 EIADHM Nc1cc(Nc2c(Cl)ccc([O-])c2F)ccc1Br ZINC001160305174 1049890291 /nfs/dbraw/zinc/89/02/91/1049890291.db2.gz VSNWXWBGYZIWEN-UHFFFAOYSA-N -1 3 331.572 4.273 20 0 EIADHM O=C([N-]c1c2nsnc2ccc1Cl)c1ccc(F)c(F)c1F ZINC000181254556 1050071266 /nfs/dbraw/zinc/07/12/66/1050071266.db2.gz KNRCMAWJVAYMMR-UHFFFAOYSA-N -1 3 343.717 4.014 20 0 EIADHM C[C@@H](CCc1ccccc1)C(=O)Nc1cc(Br)ccc1[O-] ZINC001186023143 1050217066 /nfs/dbraw/zinc/21/70/66/1050217066.db2.gz WOAIYMMYJGNBHD-LBPRGKRZSA-N -1 3 348.240 4.362 20 0 EIADHM CC1CCC(C)([N-]S(=O)(=O)c2cc(Cl)ccc2Cl)CC1 ZINC001186369042 1050299871 /nfs/dbraw/zinc/29/98/71/1050299871.db2.gz BIUWCCYLHKNCIV-UHFFFAOYSA-N -1 3 336.284 4.241 20 0 EIADHM C[C@H](NC(=O)Nc1ccc(Br)cc1[O-])C1CCCCC1 ZINC001186389696 1050308156 /nfs/dbraw/zinc/30/81/56/1050308156.db2.gz SKRGVEXMCURSOL-JTQLQIEISA-N -1 3 341.249 4.245 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-][C@H]2CCC[C@@H]2CCC(C)C)c(F)c1F ZINC001186523874 1050351965 /nfs/dbraw/zinc/35/19/65/1050351965.db2.gz DUQUSSZFXYSGRG-KGLIPLIRSA-N -1 3 345.455 4.156 20 0 EIADHM Cc1ccc(NC(=O)NC23CC4CC(CC(C4)C2)C3)c(Cl)c1[O-] ZINC001186687249 1050386395 /nfs/dbraw/zinc/38/63/95/1050386395.db2.gz XAEIQBMIWFTLRP-UHFFFAOYSA-N -1 3 334.847 4.444 20 0 EIADHM CC[C@H]1CC[C@H](C(=O)Nc2ccc(-c3nc(C)cc(=O)[n-]3)cc2)CC1 ZINC000253586200 1050494557 /nfs/dbraw/zinc/49/45/57/1050494557.db2.gz CGOUMVCVFDGZOE-KOMQPUFPSA-N -1 3 339.439 4.313 20 0 EIADHM CCOc1ccccc1Nc1cc(Br)cc(F)c1[O-] ZINC001173850301 1050583588 /nfs/dbraw/zinc/58/35/88/1050583588.db2.gz PHIQYSDMVNFQMB-UHFFFAOYSA-N -1 3 326.165 4.436 20 0 EIADHM COc1ccc(Cl)cc1NC(=O)[N-]c1cc(-c2ccccn2)no1 ZINC001187904788 1050641831 /nfs/dbraw/zinc/64/18/31/1050641831.db2.gz SOHACVLANZAAGE-UHFFFAOYSA-N -1 3 344.758 4.043 20 0 EIADHM CC(C)c1nc(CNCc2ccc([O-])c(Cl)c2)c2ccccn21 ZINC001179506741 1050714181 /nfs/dbraw/zinc/71/41/81/1050714181.db2.gz IRKCMESBITUADP-UHFFFAOYSA-N -1 3 329.831 4.107 20 0 EIADHM COc1ccc(OC)c(NC(=O)[N-]c2cc(-c3cccs3)no2)c1 ZINC001188318634 1050744773 /nfs/dbraw/zinc/74/47/73/1050744773.db2.gz AOJKFAROFHXOAH-UHFFFAOYSA-N -1 3 345.380 4.064 20 0 EIADHM Fc1ccc(-c2csc([N-]c3ncnc4ncccc34)n2)cc1F ZINC000163099989 1050797115 /nfs/dbraw/zinc/79/71/15/1050797115.db2.gz BDDUHWPJEUKECN-UHFFFAOYSA-N -1 3 341.346 4.170 20 0 EIADHM CC(C)CNC(=O)c1cccc(Nc2nc3c(cccc3[O-])s2)c1 ZINC001174190809 1050826264 /nfs/dbraw/zinc/82/62/64/1050826264.db2.gz JLYFWHHTFGNWHX-UHFFFAOYSA-N -1 3 341.436 4.131 20 0 EIADHM Cc1ccc(-c2csc([N-]c3ncnc4ncccc34)n2)s1 ZINC000163120390 1050878055 /nfs/dbraw/zinc/87/80/55/1050878055.db2.gz KRDPDMDINKKNFU-UHFFFAOYSA-N -1 3 325.422 4.262 20 0 EIADHM O=S(=O)(CCc1ccc(Cl)cc1)[N-]c1cccc2occc21 ZINC001189111017 1050901806 /nfs/dbraw/zinc/90/18/06/1050901806.db2.gz WPWUWKRTWRHSDP-UHFFFAOYSA-N -1 3 335.812 4.071 20 0 EIADHM Cc1ccc(N2CCN(Cc3cccc([O-])c3Cl)[C@H](C)C2)cc1C ZINC001180166460 1050907575 /nfs/dbraw/zinc/90/75/75/1050907575.db2.gz PBCVGLFGNFEMEQ-MRXNPFEDSA-N -1 3 344.886 4.373 20 0 EIADHM O=C([N-]c1ccnc(Cl)c1Cl)c1cc(-c2cccs2)on1 ZINC001189183121 1050919208 /nfs/dbraw/zinc/91/92/08/1050919208.db2.gz HHBDQEZCRCVDQJ-UHFFFAOYSA-N -1 3 340.191 4.357 20 0 EIADHM CC(C)(C)[C@@H]1CCC[C@H]([N-]S(=O)(=O)c2cccnc2Cl)CC1 ZINC001189288351 1050946727 /nfs/dbraw/zinc/94/67/27/1050946727.db2.gz IODGUOONOFGXHP-OLZOCXBDSA-N -1 3 344.908 4.008 20 0 EIADHM CC(C)(C)OC(=O)c1ccc(NC(=O)CCC(F)=C(F)F)c([O-])c1 ZINC001180280770 1050952548 /nfs/dbraw/zinc/95/25/48/1050952548.db2.gz YVUFGJDPNXFDEV-UHFFFAOYSA-N -1 3 345.317 4.144 20 0 EIADHM O=C(Nc1cc(F)ccc1[O-])NC(c1ccccc1)c1ccccc1 ZINC001189533878 1051015346 /nfs/dbraw/zinc/01/53/46/1051015346.db2.gz MUFYPCUNEJGNQT-UHFFFAOYSA-N -1 3 336.366 4.442 20 0 EIADHM O=C(Nc1c(Cl)ccc([O-])c1Cl)c1cn[nH]c1-c1ccccc1 ZINC001189697051 1051040097 /nfs/dbraw/zinc/04/00/97/1051040097.db2.gz MFKZVHYGFZXELX-UHFFFAOYSA-N -1 3 348.189 4.341 20 0 EIADHM Cc1ccc2c(cccc2[N-]S(=O)(=O)Cc2cc(F)ccc2F)c1 ZINC001189698842 1051042692 /nfs/dbraw/zinc/04/26/92/1051042692.db2.gz NYUYEZJBLYEMSE-UHFFFAOYSA-N -1 3 347.386 4.368 20 0 EIADHM CC(C)c1cccnc1NC(=O)c1cccc(OC(F)(F)F)c1[O-] ZINC001189755132 1051051906 /nfs/dbraw/zinc/05/19/06/1051051906.db2.gz KBECPADIWFQMAR-UHFFFAOYSA-N -1 3 340.301 4.062 20 0 EIADHM [O-]c1cc(Cl)c(Nc2cnn([C@@H]3CCCCO3)c2)cc1Cl ZINC001174613731 1051111062 /nfs/dbraw/zinc/11/10/62/1051111062.db2.gz XPLUFADEGDQZIK-AWEZNQCLSA-N -1 3 328.199 4.338 20 0 EIADHM CCC(C)(C)c1ccc(S(=O)(=O)[N-]c2cnccc2Cl)cc1 ZINC001190422953 1051180723 /nfs/dbraw/zinc/18/07/23/1051180723.db2.gz AKYWAVFLYUNSGO-UHFFFAOYSA-N -1 3 338.860 4.223 20 0 EIADHM COc1ccc2ccc(C(=O)Nc3cc([O-])cc(Cl)c3)cc2c1 ZINC001174824460 1051190640 /nfs/dbraw/zinc/19/06/40/1051190640.db2.gz PRKFBYKBUWRAGJ-UHFFFAOYSA-N -1 3 327.767 4.460 20 0 EIADHM O=S(=O)([N-]c1ccc(OCC2CC2)cc1)c1ccc(C2CC2)cc1 ZINC001190500497 1051196483 /nfs/dbraw/zinc/19/64/83/1051196483.db2.gz SSJQLTVFSGXVLM-UHFFFAOYSA-N -1 3 343.448 4.154 20 0 EIADHM Cc1nc(-c2ccccn2)sc1C(=O)Nc1ccc(Cl)cc1[O-] ZINC000153580259 1051200277 /nfs/dbraw/zinc/20/02/77/1051200277.db2.gz UXORMHOZGXIJCX-UHFFFAOYSA-N -1 3 345.811 4.125 20 0 EIADHM Cc1cc(C(=O)Nc2ccc(F)c([O-])c2)c(F)cc1C(F)(F)F ZINC001190774847 1051274746 /nfs/dbraw/zinc/27/47/46/1051274746.db2.gz OOABRKOWAGEYAQ-UHFFFAOYSA-N -1 3 331.240 4.250 20 0 EIADHM O=C([N-]c1nsc2ncccc12)c1nc(-c2ccccc2)cs1 ZINC001191040167 1051328147 /nfs/dbraw/zinc/32/81/47/1051328147.db2.gz SRNIMXJMRSXSGX-UHFFFAOYSA-N -1 3 338.417 4.067 20 0 EIADHM CCNc1ccc(C(=O)OCC)cc1Nc1c(F)cc([O-])cc1F ZINC001175099700 1051345915 /nfs/dbraw/zinc/34/59/15/1051345915.db2.gz GFCDFWIPQVAFBJ-UHFFFAOYSA-N -1 3 336.338 4.023 20 0 EIADHM [O-]c1cc(F)c(Nc2cc(F)c(Br)cc2F)c(F)c1 ZINC001175100543 1051347746 /nfs/dbraw/zinc/34/77/46/1051347746.db2.gz QALPNXVBQANXBZ-UHFFFAOYSA-N -1 3 336.082 4.455 20 0 EIADHM CC(=O)c1cccc([O-])c1NC(=O)c1ccc(-c2ccc(C)o2)cc1 ZINC001191211755 1051387622 /nfs/dbraw/zinc/38/76/22/1051387622.db2.gz WGJSLXBZMJOHEP-UHFFFAOYSA-N -1 3 335.359 4.416 20 0 EIADHM Cc1ccc(Oc2ccc(NC([O-])=NO[C@@H]3CCCCO3)cc2)cc1 ZINC000775449320 1051433276 /nfs/dbraw/zinc/43/32/76/1051433276.db2.gz BOGOVZOPNXJYMO-GOSISDBHSA-N -1 3 342.395 4.367 20 0 EIADHM Cc1ccc(Oc2ccc(NC(=O)[N-]O[C@@H]3CCCCO3)cc2)cc1 ZINC000775449320 1051433279 /nfs/dbraw/zinc/43/32/79/1051433279.db2.gz BOGOVZOPNXJYMO-GOSISDBHSA-N -1 3 342.395 4.367 20 0 EIADHM C[C@H](C(=O)Nc1cncc([O-])c1)c1ccc(-c2ccccc2)c(F)c1 ZINC001182247928 1051439098 /nfs/dbraw/zinc/43/90/98/1051439098.db2.gz IIIDCYIMWOGSSA-ZDUSSCGKSA-N -1 3 336.366 4.336 20 0 EIADHM O=C(Nc1ccc2[nH]c(=S)[nH]c2c1)c1cc2sccc2c([O-])c1 ZINC000774090933 1051449114 /nfs/dbraw/zinc/44/91/14/1051449114.db2.gz DVLFLUTZDIKBFI-UHFFFAOYSA-N -1 3 341.417 4.024 20 0 EIADHM Cc1ccc(F)cc1NC(=O)Nc1c([O-])cccc1Br ZINC001191411657 1051450912 /nfs/dbraw/zinc/45/09/12/1051450912.db2.gz XHCKCLHOLRQZJD-UHFFFAOYSA-N -1 3 339.164 4.246 20 0 EIADHM Cc1cc(=O)[n-]c([C@H](C)Sc2nnc(-c3ccc(Cl)cc3)o2)n1 ZINC000155877333 1051470518 /nfs/dbraw/zinc/47/05/18/1051470518.db2.gz KYZCVSMJZIFWHK-VIFPVBQESA-N -1 3 348.815 4.047 20 0 EIADHM Cc1cc(=O)[n-]c([C@H](C)Sc2nc3ccccc3n2C(F)F)n1 ZINC000155920985 1051475588 /nfs/dbraw/zinc/47/55/88/1051475588.db2.gz WLVQWEKRSHIWJH-VIFPVBQESA-N -1 3 336.367 4.089 20 0 EIADHM C[C@@H](CC(=O)[N-]OCCCC(F)(F)F)Cc1ccc(Cl)cc1 ZINC001175284624 1051483680 /nfs/dbraw/zinc/48/36/80/1051483680.db2.gz OJFILABHFSMQPE-LLVKDONJSA-N -1 3 337.769 4.299 20 0 EIADHM COc1ccc(-c2ccc(Nc3c(F)ccc([O-])c3F)cn2)cc1 ZINC001175263914 1051500435 /nfs/dbraw/zinc/50/04/35/1051500435.db2.gz WZXFKQUTBLCVGK-UHFFFAOYSA-N -1 3 328.318 4.485 20 0 EIADHM [O-]c1ccc(F)c(Nc2ccnc(Cl)c2OC(F)(F)F)c1F ZINC001175264055 1051500568 /nfs/dbraw/zinc/50/05/68/1051500568.db2.gz QWULTASLEMOOQF-UHFFFAOYSA-N -1 3 340.635 4.361 20 0 EIADHM CC(=O)Nc1ccc(Nc2c(F)ccc([O-])c2F)cc1C(F)(F)F ZINC001175264796 1051500751 /nfs/dbraw/zinc/50/07/51/1051500751.db2.gz HOBVSTPTBBIIEB-UHFFFAOYSA-N -1 3 346.255 4.391 20 0 EIADHM CC(C)(C)OC(=O)c1ccc(Nc2c(F)ccc([O-])c2F)c(O)c1 ZINC001175270746 1051509502 /nfs/dbraw/zinc/50/95/02/1051509502.db2.gz IQCFGSIILWOLKG-UHFFFAOYSA-N -1 3 337.322 4.075 20 0 EIADHM O=C([O-])c1ccc(CN2CCC(c3ccccc3Cl)CC2)cc1 ZINC001204156450 1051532493 /nfs/dbraw/zinc/53/24/93/1051532493.db2.gz CPNXTLGLYNBLIP-UHFFFAOYSA-N -1 3 329.827 4.418 20 0 EIADHM [O-]c1cccc(Nc2ccc(-n3cccn3)cc2)c1Br ZINC001175374471 1051558459 /nfs/dbraw/zinc/55/84/59/1051558459.db2.gz JOUGGLUYEQUJNG-UHFFFAOYSA-N -1 3 330.185 4.084 20 0 EIADHM O=S(=O)(Cc1ccc(Cl)cc1F)[N-]c1ccc2c(c1)N=NC2 ZINC001191906698 1051572263 /nfs/dbraw/zinc/57/22/63/1051572263.db2.gz ZCQYJWOOAGUTEQ-UHFFFAOYSA-N -1 3 339.779 4.018 20 0 EIADHM [O-]C(=NO[C@@H]1CCCCO1)Nc1ccc(-c2ccccc2)cc1F ZINC000775489303 1051579112 /nfs/dbraw/zinc/57/91/12/1051579112.db2.gz XTAAIZVRNYOLIF-QGZVFWFLSA-N -1 3 330.359 4.072 20 0 EIADHM O=C([N-]O[C@@H]1CCCCO1)Nc1ccc(-c2ccccc2)cc1F ZINC000775489303 1051579128 /nfs/dbraw/zinc/57/91/28/1051579128.db2.gz XTAAIZVRNYOLIF-QGZVFWFLSA-N -1 3 330.359 4.072 20 0 EIADHM COc1cccc(-c2ccc(Nc3ccc(-c4nn[n-]n4)cc3)cc2)c1 ZINC001175429286 1051585622 /nfs/dbraw/zinc/58/56/22/1051585622.db2.gz GOQBQNNRQYVKMA-UHFFFAOYSA-N -1 3 343.390 4.286 20 0 EIADHM COc1ccc(-c2ccc(Nc3ccc(-c4nn[n-]n4)cc3)cc2)cc1 ZINC001175430740 1051586448 /nfs/dbraw/zinc/58/64/48/1051586448.db2.gz WCSMIYXYBZBXLX-UHFFFAOYSA-N -1 3 343.390 4.286 20 0 EIADHM COc1ccccc1-c1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC001175429926 1051587835 /nfs/dbraw/zinc/58/78/35/1051587835.db2.gz WEAFJVIZUVKNBQ-UHFFFAOYSA-N -1 3 343.390 4.286 20 0 EIADHM FC(F)(F)C1(c2ccc(Nc3ccc(-c4nn[n-]n4)cc3)cc2)CC1 ZINC001175428405 1051588244 /nfs/dbraw/zinc/58/82/44/1051588244.db2.gz HPHBIEAUOQGOGK-UHFFFAOYSA-N -1 3 345.328 4.204 20 0 EIADHM COc1ccc(-c2ccccc2Nc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC001175430428 1051588760 /nfs/dbraw/zinc/58/87/60/1051588760.db2.gz QDZBULOVWFUCOM-UHFFFAOYSA-N -1 3 343.390 4.286 20 0 EIADHM Cc1ncc(NC(=O)Nc2c(Cl)cc(Cl)cc2Cl)c(=O)[n-]1 ZINC001192016902 1051614507 /nfs/dbraw/zinc/61/45/07/1051614507.db2.gz PFXPOBGOLXMVLH-UHFFFAOYSA-N -1 3 347.589 4.095 20 0 EIADHM C[C@H](C(=O)Nc1cncc([O-])c1)c1cccc(Oc2ccccc2)c1 ZINC001182736000 1051693599 /nfs/dbraw/zinc/69/35/99/1051693599.db2.gz IIQGDBISFKLXJP-AWEZNQCLSA-N -1 3 334.375 4.322 20 0 EIADHM CSc1ccc(C)c(NC(=O)c2c[n-]c3c(C)cccc3c2=O)c1 ZINC001183078580 1051777274 /nfs/dbraw/zinc/77/72/74/1051777274.db2.gz PXXHGZGSMZQOHU-UHFFFAOYSA-N -1 3 338.432 4.119 20 0 EIADHM O=C(Nc1cc([O-])cc(Cl)c1)c1cccnc1Oc1ccccc1 ZINC001192706536 1051802894 /nfs/dbraw/zinc/80/28/94/1051802894.db2.gz OUGRIIZSCNFHTG-UHFFFAOYSA-N -1 3 340.766 4.485 20 0 EIADHM O=C(CCC(=O)c1ccc(-c2ccccc2)cc1)[N-]OC1CCCC1 ZINC000775597922 1051925228 /nfs/dbraw/zinc/92/52/28/1051925228.db2.gz BVDWADMTJJNGES-UHFFFAOYSA-N -1 3 337.419 4.307 20 0 EIADHM CC(C)(C)c1csc(C(=O)[N-]c2cc(-c3cccs3)on2)n1 ZINC001183915189 1051926446 /nfs/dbraw/zinc/92/64/46/1051926446.db2.gz VMPMCFFSEDGTQR-UHFFFAOYSA-N -1 3 333.438 4.409 20 0 EIADHM O=S(=O)(CC1CCC1)[N-]c1cc(F)cc2c1-c1ccc(F)cc1C2 ZINC001193523128 1051944858 /nfs/dbraw/zinc/94/48/58/1051944858.db2.gz UKJLVGCKGOYDPC-UHFFFAOYSA-N -1 3 349.402 4.078 20 0 EIADHM CC(C)(C)OC(=O)c1ccc(NC(=O)OC2CCCCC2)c([O-])c1 ZINC001193642831 1051961778 /nfs/dbraw/zinc/96/17/78/1051961778.db2.gz RWUMIMJBRMIXBZ-UHFFFAOYSA-N -1 3 335.400 4.229 20 0 EIADHM CC(C)(C)C1CCN(C(=O)c2ccc([O-])cc2C(F)(F)F)CC1 ZINC001193734631 1051978483 /nfs/dbraw/zinc/97/84/83/1051978483.db2.gz XJYCWAQXQUVWNZ-UHFFFAOYSA-N -1 3 329.362 4.309 20 0 EIADHM [O-]c1cc(Nc2ccc(OCc3ccccc3)nc2)c(F)cc1F ZINC001176304981 1052008246 /nfs/dbraw/zinc/00/82/46/1052008246.db2.gz CBURQZYEDMWMAO-UHFFFAOYSA-N -1 3 328.318 4.388 20 0 EIADHM [O-]c1cc(F)c(Nc2ccc(OCc3ccccc3)nc2)cc1F ZINC001176305543 1052010757 /nfs/dbraw/zinc/01/07/57/1052010757.db2.gz PZLADZJTJZFLBN-UHFFFAOYSA-N -1 3 328.318 4.388 20 0 EIADHM CCOC(=O)c1cc([N-]C(=O)Nc2c(C)cccc2C(C)(C)C)on1 ZINC001184583720 1052049834 /nfs/dbraw/zinc/04/98/34/1052049834.db2.gz FFPDERSSBBFTDV-UHFFFAOYSA-N -1 3 345.399 4.101 20 0 EIADHM Cc1nc(C(C)C)[n-]c(=O)c1C(=O)Nc1ccc(C(C)(C)C)c(F)c1 ZINC001176441675 1052059304 /nfs/dbraw/zinc/05/93/04/1052059304.db2.gz SDPUWKHXWAWCTP-UHFFFAOYSA-N -1 3 345.418 4.303 20 0 EIADHM O=C([O-])C[C@@H](NCc1ccccc1OC1CCCC1)c1cccs1 ZINC000671162145 1052073826 /nfs/dbraw/zinc/07/38/26/1052073826.db2.gz MLGIIBLTIIYBQK-MRXNPFEDSA-N -1 3 345.464 4.375 20 0 EIADHM C[C@@H](NC(=O)Nc1c([O-])cccc1Br)c1ccccc1 ZINC001185013284 1052145307 /nfs/dbraw/zinc/14/53/07/1052145307.db2.gz QFFWJVNHBMZEPD-SNVBAGLBSA-N -1 3 335.201 4.037 20 0 EIADHM O=C(Nc1ccc(F)c(F)c1)Nc1c([O-])cccc1Br ZINC001185089120 1052164306 /nfs/dbraw/zinc/16/43/06/1052164306.db2.gz BFOQWQDLOIBJIY-UHFFFAOYSA-N -1 3 343.127 4.077 20 0 EIADHM CCN(CC)C(=O)c1cc([N-]c2nnc(C(C)C)o2)ccc1Cl ZINC001185072564 1052170585 /nfs/dbraw/zinc/17/05/85/1052170585.db2.gz YECXDJQPXBEOJU-UHFFFAOYSA-N -1 3 336.823 4.072 20 0 EIADHM CCc1cccc(C(=O)N(C)Cc2ccc(C(F)(F)F)cc2)c1[O-] ZINC000622279042 1052176043 /nfs/dbraw/zinc/17/60/43/1052176043.db2.gz XENBWGMDELGTPZ-UHFFFAOYSA-N -1 3 337.341 4.246 20 0 EIADHM CC(C)c1ccc(C(=O)N(Cc2ccc(F)cc2)C2CC2)c([O-])c1 ZINC000622284515 1052179392 /nfs/dbraw/zinc/17/93/92/1052179392.db2.gz FEYRFVVNCCRDBB-UHFFFAOYSA-N -1 3 327.399 4.460 20 0 EIADHM CC(C)Oc1ccccc1NC(=O)c1cc([O-])cc(C(F)(F)F)c1 ZINC000622307911 1052187849 /nfs/dbraw/zinc/18/78/49/1052187849.db2.gz PHFPVLFPHHSIFI-UHFFFAOYSA-N -1 3 339.313 4.451 20 0 EIADHM CC1(C)[C@H](c2cccc(Cl)c2)CCN1C(=O)c1ccc(O)cc1[O-] ZINC001176901528 1052209534 /nfs/dbraw/zinc/20/95/34/1052209534.db2.gz CPTDTOZNKWQTGZ-INIZCTEOSA-N -1 3 345.826 4.160 20 0 EIADHM COc1ccc(N(CC(C)C)C(=O)c2ccc(C)c(C)c2[O-])cc1 ZINC000622334865 1052214019 /nfs/dbraw/zinc/21/40/19/1052214019.db2.gz FUDHUAABFNBYRU-UHFFFAOYSA-N -1 3 327.424 4.320 20 0 EIADHM c1[n-][nH]c2ncnc(=Nc3cccc(CSC4CCCCC4)c3)c1-2 ZINC001185395051 1052229403 /nfs/dbraw/zinc/22/94/03/1052229403.db2.gz XTBRMGNRAFNDSJ-UHFFFAOYSA-N -1 3 339.468 4.036 20 0 EIADHM Cc1ccc([C@@H](C)CNC(=O)c2cc([O-])cc(C(F)(F)F)c2)cc1 ZINC000622384037 1052239363 /nfs/dbraw/zinc/23/93/63/1052239363.db2.gz TXYXNLJDKJSQMS-LBPRGKRZSA-N -1 3 337.341 4.253 20 0 EIADHM CCc1cccc(C(=O)N(C)[C@H](Cc2ccc(F)cc2)C(C)C)c1[O-] ZINC000622400869 1052244808 /nfs/dbraw/zinc/24/48/08/1052244808.db2.gz CDKUJAOZELMQCD-LJQANCHMSA-N -1 3 343.442 4.433 20 0 EIADHM CC1(C)CCc2ccccc2[C@@H](NC(=O)Cc2ccc([O-])c(F)c2)C1 ZINC000622582715 1052336148 /nfs/dbraw/zinc/33/61/48/1052336148.db2.gz ZWTPDRLRXJJQBL-SFHVURJKSA-N -1 3 341.426 4.294 20 0 EIADHM O=C([N-]c1ccccc1SC1CCCC1)c1noc2c1COCC2 ZINC000623180613 1052598253 /nfs/dbraw/zinc/59/82/53/1052598253.db2.gz PTMZBHWCFWUOLP-UHFFFAOYSA-N -1 3 344.436 4.034 20 0 EIADHM COCc1nc(C)c(C(=O)[N-]c2cc(Cl)ccc2SC)s1 ZINC000179123975 1052723789 /nfs/dbraw/zinc/72/37/89/1052723789.db2.gz PMUSJGUDGZHKJU-UHFFFAOYSA-N -1 3 342.873 4.226 20 0 EIADHM O=C(N[C@@H](CC1CCC1)c1ccccc1)c1c[n-]c2ccccc2c1=O ZINC000183606411 1052979150 /nfs/dbraw/zinc/97/91/50/1052979150.db2.gz GCKXBZVDBRLWEY-FQEVSTJZSA-N -1 3 346.430 4.189 20 0 EIADHM COc1cc(C)c(S(=O)(=O)[N-]c2ccc3occc3c2)c(C)c1C ZINC001194864976 1053136578 /nfs/dbraw/zinc/13/65/78/1053136578.db2.gz VRYMHFCJURAJFZ-UHFFFAOYSA-N -1 3 345.420 4.167 20 0 EIADHM Cc1ccc(C(F)(F)F)c([N-]S(=O)(=O)CC[Si](C)(C)C)c1 ZINC001195073596 1053257881 /nfs/dbraw/zinc/25/78/81/1053257881.db2.gz HHEITSHPFAJITH-UHFFFAOYSA-N -1 3 339.455 4.094 20 0 EIADHM CC(C)(C)Oc1cccc(CN[C@@H](CC(=O)[O-])c2ccsc2)c1 ZINC000864504664 1053297832 /nfs/dbraw/zinc/29/78/32/1053297832.db2.gz XACGJHGTZSMCPR-INIZCTEOSA-N -1 3 333.453 4.231 20 0 EIADHM CN(Cc1nc(=O)c2c(-c3ccco3)csc2[n-]1)c1ccsc1 ZINC001195668952 1053459878 /nfs/dbraw/zinc/45/98/78/1053459878.db2.gz CORVNQIWXIOKQK-UHFFFAOYSA-N -1 3 343.433 4.355 20 0 EIADHM O=c1cc(CSCc2coc(C3CC3)n2)nc(-c2ccccc2)[n-]1 ZINC000865282786 1053464381 /nfs/dbraw/zinc/46/43/81/1053464381.db2.gz DBYLPBYBIZCURR-UHFFFAOYSA-N -1 3 339.420 4.148 20 0 EIADHM [O-]c1cc(C(F)(F)F)ccc1NC(=S)Nc1ccccc1F ZINC001195775517 1053483848 /nfs/dbraw/zinc/48/38/48/1053483848.db2.gz AICZUGHGFYWHPZ-UHFFFAOYSA-N -1 3 330.306 4.359 20 0 EIADHM CC(C)(C)c1ccc(NS(=O)(=O)c2ccc([O-])cc2)c(Cl)c1 ZINC001195796428 1053491050 /nfs/dbraw/zinc/49/10/50/1053491050.db2.gz NIAAQOUKXUSZSB-UHFFFAOYSA-N -1 3 339.844 4.144 20 0 EIADHM Cc1ccc(F)cc1NC(=S)Nc1nc2c(cccc2[O-])s1 ZINC001195875347 1053512736 /nfs/dbraw/zinc/51/27/36/1053512736.db2.gz QRDJFCHPIXOGRE-UHFFFAOYSA-N -1 3 333.413 4.258 20 0 EIADHM O=C(Nc1ccc(F)c([O-])c1)c1c(Cl)cc(Cl)nc1Cl ZINC001195917601 1053526145 /nfs/dbraw/zinc/52/61/45/1053526145.db2.gz AELHGPHWBGMGJE-UHFFFAOYSA-N -1 3 335.549 4.139 20 0 EIADHM [O-]c1cccc2sc(NC(=S)NCc3cccc(Cl)c3)nc21 ZINC001195946517 1053542655 /nfs/dbraw/zinc/54/26/55/1053542655.db2.gz OXOXSTFDUBYLRB-UHFFFAOYSA-N -1 3 349.868 4.142 20 0 EIADHM C[C@@H](NC(=O)c1cc([O-])c2ccccc2c1)c1ccc(F)cc1F ZINC000471588525 1053637528 /nfs/dbraw/zinc/63/75/28/1053637528.db2.gz CFTAMWCXUXBMKH-LLVKDONJSA-N -1 3 327.330 4.315 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N1CCC[C@H]1Cc1ccccc1 ZINC000471618466 1053670541 /nfs/dbraw/zinc/67/05/41/1053670541.db2.gz BBDJCRRRYNPPCF-IBGZPJMESA-N -1 3 331.415 4.393 20 0 EIADHM [O-]c1cccc2sc(NC(=S)NCc3ccccc3Cl)nc21 ZINC001196793927 1053758244 /nfs/dbraw/zinc/75/82/44/1053758244.db2.gz HZZMXMWCKDZXAY-UHFFFAOYSA-N -1 3 349.868 4.142 20 0 EIADHM COc1cc(C)c(S(=O)(=O)[N-]c2ccc3oc(C)cc3c2)c(C)c1 ZINC001196888266 1053788504 /nfs/dbraw/zinc/78/85/04/1053788504.db2.gz PPPCQGLQIWQLSQ-UHFFFAOYSA-N -1 3 345.420 4.167 20 0 EIADHM COc1ccc(C(=O)N[C@H]2CCSc3ccc(Cl)cc32)c([O-])c1 ZINC000024247970 1053801274 /nfs/dbraw/zinc/80/12/74/1053801274.db2.gz LPGGWZXKUBNKNH-AWEZNQCLSA-N -1 3 349.839 4.021 20 0 EIADHM Cc1nc(C(C)C)oc1C[N-]C(=O)C(F)(F)c1cccc(Cl)c1 ZINC000854593550 1053830089 /nfs/dbraw/zinc/83/00/89/1053830089.db2.gz RUCDFJSRESTTGX-UHFFFAOYSA-N -1 3 342.773 4.168 20 0 EIADHM [O-]c1cncc(NC(=S)Nc2ccc(Cl)c(C(F)(F)F)c2)c1 ZINC001197436811 1053912887 /nfs/dbraw/zinc/91/28/87/1053912887.db2.gz CFSYKWHOATXRKR-UHFFFAOYSA-N -1 3 347.749 4.268 20 0 EIADHM [O-]c1cccc(Br)c1NC(=S)Nc1cccc(F)c1 ZINC001197640924 1053956803 /nfs/dbraw/zinc/95/68/03/1053956803.db2.gz KUEDMZAUWCQNNQ-UHFFFAOYSA-N -1 3 341.205 4.103 20 0 EIADHM CC(C)(C)OC1CCC(NC(=O)c2cc([O-])c3ccccc3c2)CC1 ZINC000870491168 1054103698 /nfs/dbraw/zinc/10/36/98/1054103698.db2.gz FQMHWYZAOPPRRW-UHFFFAOYSA-N -1 3 341.451 4.402 20 0 EIADHM COc1ccccc1CC(C)(C)NC(=O)c1cc([O-])c2ccccc2c1 ZINC000472029061 1054207512 /nfs/dbraw/zinc/20/75/12/1054207512.db2.gz HQLHPJHIEXBGOG-UHFFFAOYSA-N -1 3 349.430 4.305 20 0 EIADHM O=C(N[C@@H]1[C@@H]2CCc3ccccc3[C@@H]21)c1cc([O-])c2ccccc2c1 ZINC000472345809 1054285557 /nfs/dbraw/zinc/28/55/57/1054285557.db2.gz FTBYJRFVEVAOOJ-HLAWJBBLSA-N -1 3 329.399 4.004 20 0 EIADHM Cc1nn(-c2ccccc2)c(C)c1CN[C@@H](C)c1cccc([O-])c1F ZINC000872018821 1054334381 /nfs/dbraw/zinc/33/43/81/1054334381.db2.gz QDOHWPSSHDHGJV-ZDUSSCGKSA-N -1 3 339.414 4.185 20 0 EIADHM C[C@H](NCc1ccc(N2CCC(C)CC2)nc1)c1cccc([O-])c1F ZINC000872024952 1054341032 /nfs/dbraw/zinc/34/10/32/1054341032.db2.gz FTXAYALRRRPVEM-HNNXBMFYSA-N -1 3 343.446 4.013 20 0 EIADHM C[C@@H](N[C@H](C)c1cccc([O-])c1F)c1nc(C(F)(F)F)cs1 ZINC000872067112 1054374304 /nfs/dbraw/zinc/37/43/04/1054374304.db2.gz OIRLPHZSJBWKGY-HTQZYQBOSA-N -1 3 334.338 4.418 20 0 EIADHM C[C@@H](N[C@H]1CCc2cc(F)c(F)c(F)c21)c1cccc([O-])c1F ZINC000872076710 1054380460 /nfs/dbraw/zinc/38/04/60/1054380460.db2.gz QKXURFRVAQGPTA-PELKAZGASA-N -1 3 325.305 4.287 20 0 EIADHM Cc1ccc(CN2CCC(c3cccc(F)c3F)CC2)cc1C(=O)[O-] ZINC000872159790 1054415052 /nfs/dbraw/zinc/41/50/52/1054415052.db2.gz OPVHKYUGWOGMGX-UHFFFAOYSA-N -1 3 345.389 4.351 20 0 EIADHM CC(C)C(=O)Nc1ccc(Nc2cccc([O-])c2Br)cc1 ZINC001199800865 1054473441 /nfs/dbraw/zinc/47/34/41/1054473441.db2.gz JOXOAUHHEASEPD-UHFFFAOYSA-N -1 3 349.228 4.493 20 0 EIADHM [O-]c1cc(C(F)(F)F)ccc1NC(=S)NC1CCCCCC1 ZINC001199969361 1054506427 /nfs/dbraw/zinc/50/64/27/1054506427.db2.gz OJMSYNYGYPYCQE-UHFFFAOYSA-N -1 3 332.391 4.420 20 0 EIADHM Cc1cc(C)c(S(=O)(=O)[N-]c2ccc3scnc3c2)c(C)c1 ZINC000060291559 1054667711 /nfs/dbraw/zinc/66/77/11/1054667711.db2.gz BNWBRZJZZHULEU-UHFFFAOYSA-N -1 3 332.450 4.022 20 0 EIADHM Cc1sc2[n-]c([C@H](C)OC(=O)[C@H]3CCCC34CC4)nc(=O)c2c1C ZINC000860177038 1054782028 /nfs/dbraw/zinc/78/20/28/1054782028.db2.gz LZKUOMXVDXEOKI-CMPLNLGQSA-N -1 3 346.452 4.198 20 0 EIADHM O=C(Nc1cc(Br)ccc1[O-])Nc1ccc(F)cc1F ZINC001202020684 1054981223 /nfs/dbraw/zinc/98/12/23/1054981223.db2.gz XYPYXONYSBOEGE-UHFFFAOYSA-N -1 3 343.127 4.077 20 0 EIADHM O=C(Nc1ccc(F)cc1F)Nc1c([O-])cccc1C(F)(F)F ZINC001202023822 1054983947 /nfs/dbraw/zinc/98/39/47/1054983947.db2.gz KVZHXSPIVJWWJR-UHFFFAOYSA-N -1 3 332.228 4.333 20 0 EIADHM CCc1c(C)sc2[n-]c([C@@H]3CSc4ccccc4O3)nc(=O)c12 ZINC000429548059 1055067492 /nfs/dbraw/zinc/06/74/92/1055067492.db2.gz LOXDFCCLAOEACG-LBPRGKRZSA-N -1 3 344.461 4.494 20 0 EIADHM Cc1cccc(C)c1NC(=O)Nc1c([O-])cccc1Br ZINC001202206253 1055084673 /nfs/dbraw/zinc/08/46/73/1055084673.db2.gz OPBMUFVLYCBUGY-UHFFFAOYSA-N -1 3 335.201 4.416 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@H](C)c3cc(C)cc(C)c3)nc2)n1 ZINC000068703007 1055090200 /nfs/dbraw/zinc/09/02/00/1055090200.db2.gz GCPTZEAPQFEBMU-OAHLLOKOSA-N -1 3 348.450 4.184 20 0 EIADHM C[C@H](CC(C)(C)c1ccccc1)NC(=O)c1cc(=O)c2ccccc2[n-]1 ZINC000068933447 1055101206 /nfs/dbraw/zinc/10/12/06/1055101206.db2.gz GMNPCOGDQREVLS-OAHLLOKOSA-N -1 3 348.446 4.014 20 0 EIADHM CC(C)(C)OC(=O)c1ccc(NC(=O)Nc2ccc(F)cc2)c([O-])c1 ZINC001202358356 1055150404 /nfs/dbraw/zinc/15/04/04/1055150404.db2.gz NNIHWANZTQZOKI-UHFFFAOYSA-N -1 3 346.358 4.131 20 0 EIADHM O=C(Nc1ccc(Cl)cc1)Nc1cc(Br)ccc1[O-] ZINC001202375461 1055155510 /nfs/dbraw/zinc/15/55/10/1055155510.db2.gz WYNIXOFLQFXKMR-UHFFFAOYSA-N -1 3 341.592 4.452 20 0 EIADHM O=C(Nc1ccc(C(F)(F)F)cc1)Nc1ncc([O-])cc1Cl ZINC001202410458 1055161041 /nfs/dbraw/zinc/16/10/41/1055161041.db2.gz XJMKCJTZMAZFAW-UHFFFAOYSA-N -1 3 331.681 4.103 20 0 EIADHM O=C(N[C@@H]1CCC[C@@H]1Cc1ccccc1)c1cc(=O)c2ccccc2[n-]1 ZINC000265709298 1055645016 /nfs/dbraw/zinc/64/50/16/1055645016.db2.gz UQFMMJQDEINGJE-SJLPKXTDSA-N -1 3 346.430 4.082 20 0 EIADHM Cc1cc(O[C@H](C)C(=O)NCc2ccc([O-])c(F)c2)ccc1C(C)C ZINC000303744549 1056265447 /nfs/dbraw/zinc/26/54/47/1056265447.db2.gz ACQJLUMCJKVCGC-CQSZACIVSA-N -1 3 345.414 4.047 20 0 EIADHM Cc1nc2ccccc2c(C)c1CC(=O)Nc1cc(Cl)ccc1[O-] ZINC000060636331 1056505979 /nfs/dbraw/zinc/50/59/79/1056505979.db2.gz BFLOEKFPOJNTNZ-UHFFFAOYSA-N -1 3 340.810 4.392 20 0 EIADHM CCc1csc(CC2CCN([C@H](C)c3ccc(C(=O)[O-])o3)CC2)n1 ZINC000656191416 1056690575 /nfs/dbraw/zinc/69/05/75/1056690575.db2.gz UMWTWSZHXZCLON-GFCCVEGCSA-N -1 3 348.468 4.012 20 0 EIADHM Cc1ccc(-c2csc3[n-]c(-c4cc(C)ccn4)nc(=O)c23)s1 ZINC000111664973 1056812461 /nfs/dbraw/zinc/81/24/61/1056812461.db2.gz LMVFBHNBZXQCHW-UHFFFAOYSA-N -1 3 339.445 4.392 20 0 EIADHM [O-]c1ccc(CNC(=S)Nc2ccc3ccccc3c2)cc1F ZINC000737459644 1058491072 /nfs/dbraw/zinc/49/10/72/1058491072.db2.gz DCFOLLIOFNPMJX-UHFFFAOYSA-N -1 3 326.396 4.171 20 0 EIADHM O=c1ccnc(C=Cc2cn(-c3ccccc3)nc2-c2ccccc2)[n-]1 ZINC000742221077 1058549806 /nfs/dbraw/zinc/54/98/06/1058549806.db2.gz XQPTUWHEGMIFQG-QXMHVHEDSA-N -1 3 340.386 4.205 20 0 EIADHM Cc1ccc(-c2cc(C(=O)OCc3cc(C)nc4ccccc34)n[n-]2)o1 ZINC000744134157 1059282168 /nfs/dbraw/zinc/28/21/68/1059282168.db2.gz OUQDBEJQEIVGQC-UHFFFAOYSA-N -1 3 347.374 4.192 20 0 EIADHM Cc1ccc(-c2cc(C(=O)OCc3cc(C)nc4ccccc34)[n-]n2)o1 ZINC000744134157 1059282206 /nfs/dbraw/zinc/28/22/06/1059282206.db2.gz OUQDBEJQEIVGQC-UHFFFAOYSA-N -1 3 347.374 4.192 20 0 EIADHM CCCC[C@H](CC)C(=O)Oc1cccc(-c2nc(C)cc(=O)[n-]2)c1 ZINC000744218552 1059335731 /nfs/dbraw/zinc/33/57/31/1059335731.db2.gz MYCRSNASEGNYKO-AWEZNQCLSA-N -1 3 328.412 4.279 20 0 EIADHM Cc1cc(COC(=O)c2cc(-c3ccccc3)cc(Cl)c2[O-])no1 ZINC000746079820 1060006454 /nfs/dbraw/zinc/00/64/54/1060006454.db2.gz QKDDSCWKGGUTNT-UHFFFAOYSA-N -1 3 343.766 4.366 20 0 EIADHM CCc1cc2c(CN3CC[C@H]3c3ccccc3)cc(=O)oc2cc1[O-] ZINC000746457148 1060351177 /nfs/dbraw/zinc/35/11/77/1060351177.db2.gz JBWOANAEWFZBKH-SFHVURJKSA-N -1 3 335.403 4.008 20 0 EIADHM CCc1cc(=O)[n-]c(CN2CCC[C@@H]2c2ccc(C(C)C)cc2)n1 ZINC001168919162 1060523588 /nfs/dbraw/zinc/52/35/88/1060523588.db2.gz WVPVUCCBDGKCKK-GOSISDBHSA-N -1 3 325.456 4.205 20 0 EIADHM COC(=O)c1sc2ncccc2c1Nc1ccc(Cl)c([O-])c1 ZINC001212588005 1060764963 /nfs/dbraw/zinc/76/49/63/1060764963.db2.gz FAJLHEADDUTDCU-UHFFFAOYSA-N -1 3 334.784 4.186 20 0 EIADHM Nc1cn(-c2ccc(Cl)c([O-])c2)c2ccc(Br)cc12 ZINC001212590250 1060818547 /nfs/dbraw/zinc/81/85/47/1060818547.db2.gz CMLJRFKSKNZFDS-UHFFFAOYSA-N -1 3 337.604 4.334 20 0 EIADHM [O-]c1cc(Nc2cn3cc(C(F)(F)F)ccc3n2)ccc1Cl ZINC001212590484 1060831888 /nfs/dbraw/zinc/83/18/88/1060831888.db2.gz OIQIUYYPGYSQMW-UHFFFAOYSA-N -1 3 327.693 4.456 20 0 EIADHM [O-]c1cc(Nc2cc(F)ccc2OC[C@@H]2CCCO2)ccc1Cl ZINC001212592515 1060890745 /nfs/dbraw/zinc/89/07/45/1060890745.db2.gz UICWCRPQJVHLGC-ZDUSSCGKSA-N -1 3 337.778 4.486 20 0 EIADHM [O-]c1cccnc1CNc1ccc(C(F)(F)F)cc1C(F)(F)F ZINC001169730767 1060933768 /nfs/dbraw/zinc/93/37/68/1060933768.db2.gz HPRZDSMHOOXIDO-UHFFFAOYSA-N -1 3 336.235 4.437 20 0 EIADHM CC[C@@H](C)c1ccc(S(=O)(=O)[N-]c2ccc(F)c(F)c2F)cc1 ZINC000007405030 210794443 /nfs/dbraw/zinc/79/44/43/210794443.db2.gz XYLKDTLPFIWSIK-SNVBAGLBSA-N -1 3 343.370 4.418 20 0 EIADHM Cc1cccc(C(=O)Nc2cc(Cl)ccc2[O-])c1Br ZINC000123974303 1046208369 /nfs/dbraw/zinc/20/83/69/1046208369.db2.gz QFHPTRLWPXOABZ-UHFFFAOYSA-N -1 3 340.604 4.369 20 0 EIADHM CCCc1cc(=O)[n-]c(C(=Cc2nc(-c3ccccc3)c[nH]2)CC)n1 ZINC000193617065 1032164888 /nfs/dbraw/zinc/16/48/88/1032164888.db2.gz VMYBQMXWNBSHLQ-KAMYIIQDSA-N -1 3 334.423 4.063 20 0 EIADHM CC(C)(C)[C@@H](NCc1cc(=O)[n-]c(C2CC2)n1)c1ccc(F)cc1F ZINC000459382034 1032248820 /nfs/dbraw/zinc/24/88/20/1032248820.db2.gz DTMVURYIZQYKHS-KRWDZBQOSA-N -1 3 347.409 4.215 20 0 EIADHM CCN(C(=O)c1ccc(O)cc1[O-])[C@@H](C)c1cc2ccccc2o1 ZINC000194243992 1032249222 /nfs/dbraw/zinc/24/92/22/1032249222.db2.gz RYRFTZUSEXJBFI-LBPRGKRZSA-N -1 3 325.364 4.067 20 0 EIADHM CC(C)(C)c1cc2cccnc2c(NC([O-])=NO[C@H]2CCCCO2)c1 ZINC000529276928 1032276822 /nfs/dbraw/zinc/27/68/22/1032276822.db2.gz VVLGJBHEJDIPFY-INIZCTEOSA-N -1 3 343.427 4.112 20 0 EIADHM CC(C)(C)c1cc2cccnc2c(NC(=O)[N-]O[C@H]2CCCCO2)c1 ZINC000529276928 1032276825 /nfs/dbraw/zinc/27/68/25/1032276825.db2.gz VVLGJBHEJDIPFY-INIZCTEOSA-N -1 3 343.427 4.112 20 0 EIADHM O=C([N-]c1cc(-c2ccccc2)on1)c1cnc(-c2ccccn2)s1 ZINC000175862350 1032445636 /nfs/dbraw/zinc/44/56/36/1032445636.db2.gz MHQLBAFBOGWFLZ-UHFFFAOYSA-N -1 3 348.387 4.112 20 0 EIADHM O=C(Nc1cccc(C2CCCCC2)c1)c1cc(=O)[n-]c(C2CC2)n1 ZINC000529648184 1032506307 /nfs/dbraw/zinc/50/63/07/1032506307.db2.gz BBQRZVMZSJHMPO-UHFFFAOYSA-N -1 3 337.423 4.360 20 0 EIADHM CCC1(CC)CCC([N-]S(=O)(=O)c2cc(C)c(F)cc2F)CC1 ZINC001211719199 1032660437 /nfs/dbraw/zinc/66/04/37/1032660437.db2.gz BMJKASLRIXLBSL-UHFFFAOYSA-N -1 3 345.455 4.301 20 0 EIADHM C[C@@H]1CN(C(=O)c2cc([O-])cc(C(F)(F)F)c2)[C@@H]1c1ccccc1 ZINC000646878385 1018861372 /nfs/dbraw/zinc/86/13/72/1018861372.db2.gz OEIXJNRTCWCDIT-BZNIZROVSA-N -1 3 335.325 4.244 20 0 EIADHM Cc1cc(=O)[n-]c(CN2CCC[C@H]2c2ccc(C(C)(C)C)cc2)n1 ZINC001167055982 1019014956 /nfs/dbraw/zinc/01/49/56/1019014956.db2.gz VEMKOHIPAXZLEJ-KRWDZBQOSA-N -1 3 325.456 4.125 20 0 EIADHM O=C([O-])[C@H](CNCc1c(Cl)cccc1Cl)Cc1ccccc1 ZINC000683170859 1019086737 /nfs/dbraw/zinc/08/67/37/1019086737.db2.gz DIFAAQZDWDBKQJ-ZDUSSCGKSA-N -1 3 338.234 4.027 20 0 EIADHM O=[S@](Cc1coc(-c2cccc(Cl)c2)n1)c1ccc([O-])cc1 ZINC000108083304 1019319059 /nfs/dbraw/zinc/31/90/59/1019319059.db2.gz AHIQSBWDEVLTQW-QFIPXVFZSA-N -1 3 333.796 4.008 20 0 EIADHM Cc1noc(C)c1[N-]C(=O)c1cc(Cl)cc(F)c1Br ZINC000339829833 1019896896 /nfs/dbraw/zinc/89/68/96/1019896896.db2.gz OBRMFAGZHMYNCK-UHFFFAOYSA-N -1 3 347.571 4.099 20 0 EIADHM O=C(N[C@@H]1CC[C@@H](c2ccc(F)cc2)C1)c1cc([O-])ccc1Cl ZINC000510154992 1020028334 /nfs/dbraw/zinc/02/83/34/1020028334.db2.gz SSQUHONJEKDJCA-TZMCWYRMSA-N -1 3 333.790 4.251 20 0 EIADHM Cc1cccc(C)c1[N-]S(=O)(=O)c1ccc(OCC(C)C)cc1 ZINC000047454292 1020150555 /nfs/dbraw/zinc/15/05/55/1020150555.db2.gz GBVCHPSHDDDSQB-UHFFFAOYSA-N -1 3 333.453 4.139 20 0 EIADHM CCOc1ccc(-c2nc(C(=O)[N-]c3c(C)noc3C)cs2)cc1 ZINC000340253767 1020689724 /nfs/dbraw/zinc/68/97/24/1020689724.db2.gz BXGVGQFSRNESJR-UHFFFAOYSA-N -1 3 343.408 4.066 20 0 EIADHM O=C(Nc1cc(F)ccc1[O-])c1cc(C2CC2)nc2ccc(F)cc21 ZINC000340316717 1020756379 /nfs/dbraw/zinc/75/63/79/1020756379.db2.gz HZUBRPOHOCWUGC-UHFFFAOYSA-N -1 3 340.329 4.348 20 0 EIADHM COc1ccc(C(C)=O)cc1Nc1ccc([O-])c(Br)c1 ZINC001210077885 1020801527 /nfs/dbraw/zinc/80/15/27/1020801527.db2.gz IPEHVQXRTZEBJG-UHFFFAOYSA-N -1 3 336.185 4.110 20 0 EIADHM O=S(=O)(/C=C\c1ccc(F)cc1)[N-]c1ccccc1C(F)(F)F ZINC000255085406 1020912174 /nfs/dbraw/zinc/91/21/74/1020912174.db2.gz DECFUTVMFFSEJA-KTKRTIGZSA-N -1 3 345.317 4.257 20 0 EIADHM COc1cc(Br)c(O)c(Nc2cccc(Cl)c2[O-])c1 ZINC001210222065 1020957838 /nfs/dbraw/zinc/95/78/38/1020957838.db2.gz MBUXDTHUMPILDS-UHFFFAOYSA-N -1 3 344.592 4.266 20 0 EIADHM COC(=O)c1cc(F)c(Nc2cccc(Cl)c2[O-])c(C)c1F ZINC001210223608 1020963498 /nfs/dbraw/zinc/96/34/98/1020963498.db2.gz UOOWERUXQJXBGV-UHFFFAOYSA-N -1 3 327.714 4.162 20 0 EIADHM CCc1cccc(C(=O)N2CC[C@@H](CSc3ccccc3)C2)c1[O-] ZINC000530957659 1021172399 /nfs/dbraw/zinc/17/23/99/1021172399.db2.gz AUJMPJCSJGSWLR-OAHLLOKOSA-N -1 3 341.476 4.209 20 0 EIADHM O=S(=O)([N-]c1cccc(F)c1Cl)c1ccc(F)cc1Cl ZINC000584492887 1021222235 /nfs/dbraw/zinc/22/22/35/1021222235.db2.gz WVAYKZVOZWGRNW-UHFFFAOYSA-N -1 3 338.162 4.072 20 0 EIADHM CC[C@H](CC(F)(F)F)C(=O)Nc1ccc(Br)cc1[O-] ZINC000580033994 1021325483 /nfs/dbraw/zinc/32/54/83/1021325483.db2.gz OHZGFZVQUIALAA-SSDOTTSWSA-N -1 3 340.139 4.072 20 0 EIADHM CC(=O)Nc1ccc([O-])c(C(=O)N2CC[C@@H](CC(C)(C)C)C2(C)C)c1 ZINC000413980867 1021564235 /nfs/dbraw/zinc/56/42/35/1021564235.db2.gz DYNYTFJJSFTJCO-AWEZNQCLSA-N -1 3 346.471 4.028 20 0 EIADHM O=C(OCc1csc(C2CC2)n1)c1cccc2[n-]c(C(F)F)nc21 ZINC000924080377 1021801700 /nfs/dbraw/zinc/80/17/00/1021801700.db2.gz RVGPOESAKHWHAX-UHFFFAOYSA-N -1 3 349.362 4.191 20 0 EIADHM COc1ccc(-n2ncc(C)c2Nc2cccc([O-])c2Cl)cc1 ZINC001210855822 1021808867 /nfs/dbraw/zinc/80/88/67/1021808867.db2.gz ZHHDZCUCEHYBTN-UHFFFAOYSA-N -1 3 329.787 4.292 20 0 EIADHM O=C(Nc1cccc([O-])c1F)c1cccc(Oc2nccs2)c1 ZINC000129575256 1021829290 /nfs/dbraw/zinc/82/92/90/1021829290.db2.gz LGYCAXHCCJQJKB-UHFFFAOYSA-N -1 3 330.340 4.032 20 0 EIADHM O=C(N[C@H](c1ccco1)c1ccccc1)c1cc([O-])ccc1Cl ZINC000377868567 1022061972 /nfs/dbraw/zinc/06/19/72/1022061972.db2.gz JKNZLEYXXNCRQO-KRWDZBQOSA-N -1 3 327.767 4.158 20 0 EIADHM O=C([O-])[C@@H](NCc1cc(F)cc(Cl)c1)c1ccc(Cl)cc1 ZINC000756333946 1022069326 /nfs/dbraw/zinc/06/93/26/1022069326.db2.gz VKQWKEWHMXAQNU-AWEZNQCLSA-N -1 3 328.170 4.048 20 0 EIADHM Cc1cc(Br)ccc1C(=O)Nc1c([O-])cccc1Cl ZINC000580500428 1022106825 /nfs/dbraw/zinc/10/68/25/1022106825.db2.gz LITFXYVSAYTACP-UHFFFAOYSA-N -1 3 340.604 4.369 20 0 EIADHM CCc1cccc(C(=O)N(C)[C@@H](COC)c2ccc(Cl)cc2)c1[O-] ZINC000580512602 1022137966 /nfs/dbraw/zinc/13/79/66/1022137966.db2.gz LWTHCKDXIZNZIN-KRWDZBQOSA-N -1 3 347.842 4.068 20 0 EIADHM CCC[C@@H]1[C@H](C)CCCN1Cc1nc2cc(C(=O)[O-])ccc2n1CC ZINC000580560853 1022212186 /nfs/dbraw/zinc/21/21/86/1022212186.db2.gz AJMDRTIRFOUMPS-RHSMWYFYSA-N -1 3 343.471 4.155 20 0 EIADHM Cc1cc(C(=O)/C(C#N)=C/c2ccc([O-])cc2)c(C)n1CC(F)(F)F ZINC000023741181 1022522035 /nfs/dbraw/zinc/52/20/35/1022522035.db2.gz IUJYGUGAKKRLTE-RIYZIHGNSA-N -1 3 348.324 4.163 20 0 EIADHM CC(C)C[C@H](NCc1csc(-c2ccc(Cl)cc2)n1)C(=O)[O-] ZINC000580820941 1022545374 /nfs/dbraw/zinc/54/53/74/1022545374.db2.gz UWPDYQHHVARMCI-AWEZNQCLSA-N -1 3 338.860 4.052 20 0 EIADHM O=C(CC1(CSc2ccccc2)CC1)Nc1cccc([O-])c1F ZINC000186278749 1022553047 /nfs/dbraw/zinc/55/30/47/1022553047.db2.gz CBEXROOJJDOQFG-UHFFFAOYSA-N -1 3 331.412 4.432 20 0 EIADHM CCc1cc(=O)[n-]c(SCc2cnc(-c3ccc(Cl)cc3)[nH]2)n1 ZINC000376425581 1022558672 /nfs/dbraw/zinc/55/86/72/1022558672.db2.gz IPXBGUBONOZFNB-UHFFFAOYSA-N -1 3 346.843 4.080 20 0 EIADHM CCCCO[C@@H]1C[C@@H](N(C)C(=O)c2cc([O-])ccc2Cl)C1(C)C ZINC001149273692 1022699259 /nfs/dbraw/zinc/69/92/59/1022699259.db2.gz JVWDIQMUYDDCMA-HZPDHXFCSA-N -1 3 339.863 4.101 20 0 EIADHM COc1cc(-c2nc3cc(C)ccc3[nH]2)cc(Br)c1[O-] ZINC000041005840 1033091906 /nfs/dbraw/zinc/09/19/06/1033091906.db2.gz PMWPBFHOJLMZLV-UHFFFAOYSA-N -1 3 333.185 4.015 20 0 EIADHM O=C(N[C@H](c1ccc(F)cc1)C1CCC1)c1cc([O-])ccc1Cl ZINC000581340550 1023035558 /nfs/dbraw/zinc/03/55/58/1023035558.db2.gz DEJQBGRMLVOEGK-KRWDZBQOSA-N -1 3 333.790 4.456 20 0 EIADHM O=c1nc(COC[C@H]2CCCO2)[n-]c2scc(C3CCCCC3)c21 ZINC000656491840 1023044181 /nfs/dbraw/zinc/04/41/81/1023044181.db2.gz RBPXRZYCNCYXIV-CYBMUJFWSA-N -1 3 348.468 4.140 20 0 EIADHM Cc1cccc2c1CC[C@@H]2NCc1cccc([O-])c1Br ZINC000656497545 1023058868 /nfs/dbraw/zinc/05/88/68/1023058868.db2.gz HTFVGVILQAPZKK-HNNXBMFYSA-N -1 3 332.241 4.240 20 0 EIADHM Cc1c(COC(C)(C)C)cccc1NCc1cc(=O)[n-]c(C2CC2)n1 ZINC000417027480 1023117912 /nfs/dbraw/zinc/11/79/12/1023117912.db2.gz TYGDCDBLQJFVKL-UHFFFAOYSA-N -1 3 341.455 4.295 20 0 EIADHM Cc1cc(Oc2ccccc2)ccc1NC(=O)NCc1ncccc1[O-] ZINC000684227640 1023137874 /nfs/dbraw/zinc/13/78/74/1023137874.db2.gz FIGLNLAOWBMNNA-UHFFFAOYSA-N -1 3 349.390 4.210 20 0 EIADHM CC(C)[C@H](CC(F)(F)F)[N-]C(=O)C(F)(F)c1ccc(F)cc1 ZINC000782949068 1023193705 /nfs/dbraw/zinc/19/37/05/1023193705.db2.gz IIDQLZWOEPVAAL-NSHDSACASA-N -1 3 327.268 4.011 20 0 EIADHM [O-]C(=Cc1nc(-c2ccc3cnccc3c2)no1)c1ccccc1Cl ZINC001211647337 1023223571 /nfs/dbraw/zinc/22/35/71/1023223571.db2.gz KTUHVHZIYYXDFJ-UHFFFAOYSA-N -1 3 349.777 4.364 20 0 EIADHM CC1(C)[C@H](CCC(=O)[O-])C[C@@H]1NCc1c(Cl)cccc1Cl ZINC000656568704 1023240404 /nfs/dbraw/zinc/24/04/04/1023240404.db2.gz NWQZFMQCYDYBDS-YGRLFVJLSA-N -1 3 330.255 4.363 20 0 EIADHM O=C([O-])c1ccc(CN2CCC(CCc3ccccc3)CC2)cc1F ZINC000659786111 1023271332 /nfs/dbraw/zinc/27/13/32/1023271332.db2.gz KJWYJUIXBLGGCB-UHFFFAOYSA-N -1 3 341.426 4.369 20 0 EIADHM C[C@H](CC(=O)[O-])NCc1nc(-c2cc(Cl)ccc2Cl)cs1 ZINC000414639694 1023307927 /nfs/dbraw/zinc/30/79/27/1023307927.db2.gz QJJHUYQMOIWIFY-MRVPVSSYSA-N -1 3 345.251 4.070 20 0 EIADHM Cc1ccc(C2CCN(C(=O)c3cc([O-])c4ccccc4c3)CC2)cn1 ZINC000376830544 1023321084 /nfs/dbraw/zinc/32/10/84/1023321084.db2.gz DLHRKCLYEVYTAZ-UHFFFAOYSA-N -1 3 346.430 4.269 20 0 EIADHM CC1C[C@H]2CC[C@@H](C1)N2Cc1csc(-c2cccc(C(=O)[O-])c2)n1 ZINC000584793159 1023324115 /nfs/dbraw/zinc/32/41/15/1023324115.db2.gz JKPACHLDURMCJD-MYFMFCSTSA-N -1 3 342.464 4.271 20 0 EIADHM CC[C@H](NCc1nc(-c2cc(Cl)ccc2Cl)cs1)C(=O)[O-] ZINC000417581932 1023363144 /nfs/dbraw/zinc/36/31/44/1023363144.db2.gz UNJXTYRASFEMDA-NSHDSACASA-N -1 3 345.251 4.070 20 0 EIADHM CC(C)COc1ccccc1CN[C@H]1C[C@@H](C(=O)[O-])c2ccccc21 ZINC000417634308 1023385152 /nfs/dbraw/zinc/38/51/52/1023385152.db2.gz VKHQSGXIYRIRMV-MOPGFXCFSA-N -1 3 339.435 4.124 20 0 EIADHM C[C@H](C1CC1)N(Cc1ccccc1)C(=O)NCc1ccc([O-])c(F)c1 ZINC000163679220 1023390654 /nfs/dbraw/zinc/39/06/54/1023390654.db2.gz VILVWHCTXSFJLO-CQSZACIVSA-N -1 3 342.414 4.042 20 0 EIADHM O=C([O-])[C@@H](c1cccc(Cl)c1Cl)N1CCC[C@@H](CCF)C1 ZINC000656764663 1023505094 /nfs/dbraw/zinc/50/50/94/1023505094.db2.gz ZYJUMLLCBUDPIX-IINYFYTJSA-N -1 3 334.218 4.191 20 0 EIADHM C[C@H]1c2ccsc2CCN1C(=O)CCCc1ccc([O-])c(F)c1 ZINC000468586176 1023539025 /nfs/dbraw/zinc/53/90/25/1023539025.db2.gz MOMIWMOOUWIEKZ-LBPRGKRZSA-N -1 3 333.428 4.061 20 0 EIADHM O=S(=O)([N-]c1cc(Cl)ccc1F)c1cccc(C(F)F)c1 ZINC000780366051 1023813054 /nfs/dbraw/zinc/81/30/54/1023813054.db2.gz IQILNFWTNPZNJW-UHFFFAOYSA-N -1 3 335.734 4.218 20 0 EIADHM C[C@H](NC(=O)c1cc([O-])ccc1Cl)c1c(F)cccc1Cl ZINC000581899175 1023850350 /nfs/dbraw/zinc/85/03/50/1023850350.db2.gz DXUMSYVYADAGPY-QMMMGPOBSA-N -1 3 328.170 4.329 20 0 EIADHM CC[C@@H](C)Oc1ccccc1/C=C\C(=O)Nc1cccc([O-])c1F ZINC000255394035 1023931872 /nfs/dbraw/zinc/93/18/72/1023931872.db2.gz HZJDQYFESPWVRG-YLGBQOPLSA-N -1 3 329.371 4.361 20 0 EIADHM COCc1c(Br)cccc1NCc1cc([O-])cc(F)c1 ZINC000184140910 1024211631 /nfs/dbraw/zinc/21/16/31/1024211631.db2.gz SGZRDKVDGNYJDJ-UHFFFAOYSA-N -1 3 340.192 4.052 20 0 EIADHM O=c1[n-]c(CN2CCC(c3ccco3)CC2)nc2c3ccccc3oc21 ZINC000661162921 1024292933 /nfs/dbraw/zinc/29/29/33/1024292933.db2.gz YKPKZNMIOMSRTM-UHFFFAOYSA-N -1 3 349.390 4.054 20 0 EIADHM O=C(c1ccccc1[O-])N1CCC(c2ccc(C(F)(F)F)cc2)CC1 ZINC000091151435 1024525538 /nfs/dbraw/zinc/52/55/38/1024525538.db2.gz GTDIMAHJZIKYDS-UHFFFAOYSA-N -1 3 349.352 4.431 20 0 EIADHM CC(C)c1ccccc1S(=O)(=O)[N-]c1cc(F)cc(F)c1F ZINC000431160039 1024738266 /nfs/dbraw/zinc/73/82/66/1024738266.db2.gz TUKWUJJXTPDRAZ-UHFFFAOYSA-N -1 3 329.343 4.028 20 0 EIADHM Cc1cc(CN2CCC[C@@H]2Cc2ccccc2Cl)oc1C(=O)[O-] ZINC000652400834 1024810497 /nfs/dbraw/zinc/81/04/97/1024810497.db2.gz VOEFTYDVDFZOMX-CQSZACIVSA-N -1 3 333.815 4.147 20 0 EIADHM CCc1ccc(-c2nc(CN3CCC[C@@](C)(C(=O)[O-])C3)cs2)cc1 ZINC000652483428 1024849410 /nfs/dbraw/zinc/84/94/10/1024849410.db2.gz YWWVMJAXYRQNLD-LJQANCHMSA-N -1 3 344.480 4.059 20 0 EIADHM O=C([O-])CC[C@H]1CCCN(CCc2cccc(Cl)c2Cl)C1 ZINC000652495233 1024854526 /nfs/dbraw/zinc/85/45/26/1024854526.db2.gz PASAKANVECDJDS-GFCCVEGCSA-N -1 3 330.255 4.113 20 0 EIADHM Cc1ccc(-c2ncc(CN[C@@H](CC(=O)[O-])c3ccccc3)s2)o1 ZINC000426819392 1024886903 /nfs/dbraw/zinc/88/69/03/1024886903.db2.gz IBAMENJUEUTIKO-HNNXBMFYSA-N -1 3 342.420 4.017 20 0 EIADHM O=C(Nc1ccc(Br)cc1[O-])[C@@H](c1ccccc1)C1CC1 ZINC000535736601 1024905134 /nfs/dbraw/zinc/90/51/34/1024905134.db2.gz YGFOZJRSBGHLQA-INIZCTEOSA-N -1 3 346.224 4.287 20 0 EIADHM C[C@H]([N-]c1nc(-c2ccccc2)no1)c1ccc(Br)cn1 ZINC000684600596 1024962452 /nfs/dbraw/zinc/96/24/52/1024962452.db2.gz VOKAXKKBEYBYLH-JTQLQIEISA-N -1 3 345.200 4.067 20 0 EIADHM COc1cccc([C@H](CC(=O)[O-])NCc2cccc(C(C)C)c2)c1 ZINC000663259832 1024964713 /nfs/dbraw/zinc/96/47/13/1024964713.db2.gz JLVLCUKWTCKEQA-IBGZPJMESA-N -1 3 327.424 4.124 20 0 EIADHM COc1cccc(-c2nc(-c3c(Cl)cccc3Cl)no2)c1[O-] ZINC000184837059 1024981169 /nfs/dbraw/zinc/98/11/69/1024981169.db2.gz BTFFWGHMHNJUJD-UHFFFAOYSA-N -1 3 337.162 4.425 20 0 EIADHM CC(=O)c1ccc(C(=O)Nc2ccccc2NC(C)(C)C)cc1[O-] ZINC000613882294 1025009248 /nfs/dbraw/zinc/00/92/48/1025009248.db2.gz OXXAKOMHEBIUEA-UHFFFAOYSA-N -1 3 326.396 4.058 20 0 EIADHM Cc1ccc(NCc2c(C)cc(Cl)cc2Cl)cc1-c1nnn[n-]1 ZINC001167796236 1025029982 /nfs/dbraw/zinc/02/99/82/1025029982.db2.gz RGMXDFUTMFDLRF-UHFFFAOYSA-N -1 3 348.237 4.402 20 0 EIADHM Cc1ccc(NCc2c(C)cc(Cl)cc2Cl)cc1-c1nn[n-]n1 ZINC001167796236 1025029987 /nfs/dbraw/zinc/02/99/87/1025029987.db2.gz RGMXDFUTMFDLRF-UHFFFAOYSA-N -1 3 348.237 4.402 20 0 EIADHM CC[C@@H](C)c1ccc(S(=O)(=O)[N-]c2ccc(OC)cc2C)cc1 ZINC000014223701 1025775696 /nfs/dbraw/zinc/77/56/96/1025775696.db2.gz FVVSALDUOOJUBE-CYBMUJFWSA-N -1 3 333.453 4.318 20 0 EIADHM O=c1[n-]c(CSc2cc(F)ccc2F)nc2c3ccccc3oc21 ZINC000006999030 1025807602 /nfs/dbraw/zinc/80/76/02/1025807602.db2.gz QVRKBHCKEXAXNM-UHFFFAOYSA-N -1 3 344.342 4.240 20 0 EIADHM O=C([O-])[C@@H](CCCNCc1c(F)cccc1Cl)Cc1ccccc1 ZINC000426642347 1025838973 /nfs/dbraw/zinc/83/89/73/1025838973.db2.gz HTSNJEQOYMCFPA-HNNXBMFYSA-N -1 3 349.833 4.292 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(NC3CCC(C(F)F)CC3)nc2)n1 ZINC000413438652 1025923514 /nfs/dbraw/zinc/92/35/14/1025923514.db2.gz JHWOFPOBAYIMNU-UHFFFAOYSA-N -1 3 348.397 4.042 20 0 EIADHM O=C(Cc1ccc(C(F)(F)F)cc1)Nc1cc(Cl)ccc1[O-] ZINC000111210168 1026098630 /nfs/dbraw/zinc/09/86/30/1026098630.db2.gz JUAKNZZLAXGACG-UHFFFAOYSA-N -1 3 329.705 4.246 20 0 EIADHM CC1(C(=O)NCc2ccc([O-])c(Br)c2)CCCCCC1 ZINC000512149648 1026152060 /nfs/dbraw/zinc/15/20/60/1026152060.db2.gz VHAKTYDREINSEK-UHFFFAOYSA-N -1 3 340.261 4.131 20 0 EIADHM O=C(Nc1nc(-c2ccc[nH]2)cs1)c1cc([O-])c2ccccc2c1 ZINC000349504226 1026344192 /nfs/dbraw/zinc/34/41/92/1026344192.db2.gz HYEIPTDKFSDGJU-UHFFFAOYSA-N -1 3 335.388 4.249 20 0 EIADHM C[C@@H]1C[C@H](CC[N-]S(=O)(=O)c2ccc(F)cc2F)CC(C)(C)C1 ZINC001211704581 1026394042 /nfs/dbraw/zinc/39/40/42/1026394042.db2.gz BHLYARSUFZUXME-OLZOCXBDSA-N -1 3 345.455 4.096 20 0 EIADHM Cc1cc(C(F)(F)F)ccc1CN[C@H](CC(=O)[O-])c1ccsc1 ZINC000426683067 1026470419 /nfs/dbraw/zinc/47/04/19/1026470419.db2.gz OKEJQVPKHYLUSA-CQSZACIVSA-N -1 3 343.370 4.381 20 0 EIADHM CCCCOc1ccc(CN[C@H](CC(=O)[O-])c2ccsc2)cc1 ZINC000426713903 1026493961 /nfs/dbraw/zinc/49/39/61/1026493961.db2.gz KMROFAJGYQWQIF-QGZVFWFLSA-N -1 3 333.453 4.233 20 0 EIADHM CC1(C)C[C@@H](C(=O)Nc2c([O-])cccc2Cl)c2ccccc2O1 ZINC000582369105 1026505229 /nfs/dbraw/zinc/50/52/29/1026505229.db2.gz BCVIAEWXARRJOO-GFCCVEGCSA-N -1 3 331.799 4.329 20 0 EIADHM COc1ccc([O-])c(C(=O)N2CC3(CCCC3)c3cccc(F)c32)c1 ZINC000432564732 1026527684 /nfs/dbraw/zinc/52/76/84/1026527684.db2.gz DMFRQKHZXJFMLD-UHFFFAOYSA-N -1 3 341.382 4.012 20 0 EIADHM O=C([O-])[C@@H](NCc1cccc(C(F)(F)F)c1)c1cccc(Cl)c1 ZINC000426745423 1026527976 /nfs/dbraw/zinc/52/79/76/1026527976.db2.gz ZXXIHHOKIDWKAQ-AWEZNQCLSA-N -1 3 343.732 4.274 20 0 EIADHM O=C([O-])[C@H](NCc1coc2ccccc12)c1ccc(Cl)c(F)c1 ZINC000426762321 1026529213 /nfs/dbraw/zinc/52/92/13/1026529213.db2.gz JGIRZRGLZIIFDZ-MRXNPFEDSA-N -1 3 333.746 4.141 20 0 EIADHM O=C([O-])[C@@H](NCc1coc2ccccc12)c1ccc(Cl)c(F)c1 ZINC000426762320 1026530429 /nfs/dbraw/zinc/53/04/29/1026530429.db2.gz JGIRZRGLZIIFDZ-INIZCTEOSA-N -1 3 333.746 4.141 20 0 EIADHM C[C@@H](C(=O)[O-])[C@H](NCc1ccc(-c2ccccc2)o1)c1ccccc1 ZINC000426753071 1026537305 /nfs/dbraw/zinc/53/73/05/1026537305.db2.gz GPADKTJTDMRFGM-QRWLVFNGSA-N -1 3 335.403 4.498 20 0 EIADHM O=C([O-])[C@@H](NCc1ccc(-c2ccccc2)cc1)c1ccc(F)cc1 ZINC000426784681 1026557548 /nfs/dbraw/zinc/55/75/48/1026557548.db2.gz NGCJDBYJUJFEKW-FQEVSTJZSA-N -1 3 335.378 4.408 20 0 EIADHM O=C([O-])C[C@@H](NCc1cc2c(cccc2F)[nH]1)c1cccc(Cl)c1 ZINC000426802851 1026570619 /nfs/dbraw/zinc/57/06/19/1026570619.db2.gz YESCXNQBGHFNIA-QGZVFWFLSA-N -1 3 346.789 4.266 20 0 EIADHM Cc1cc([C@H](NCc2ccc(F)c(Cl)c2)C(=O)[O-])ccc1Cl ZINC000426808438 1026573194 /nfs/dbraw/zinc/57/31/94/1026573194.db2.gz MLODPQKNMAHQQO-HNNXBMFYSA-N -1 3 342.197 4.356 20 0 EIADHM O=C([O-])[C@H](NCc1ccc(Cl)c(C(F)(F)F)c1)c1cccs1 ZINC000426813783 1026575435 /nfs/dbraw/zinc/57/54/35/1026575435.db2.gz ZNWUKJNWENSLRU-GFCCVEGCSA-N -1 3 349.761 4.336 20 0 EIADHM O=C([O-])[C@@H](NCc1ccc(-c2ccccc2)cc1)c1cccc(F)c1 ZINC000426814677 1026577285 /nfs/dbraw/zinc/57/72/85/1026577285.db2.gz AIKCAHVWBSJFBU-FQEVSTJZSA-N -1 3 335.378 4.408 20 0 EIADHM COc1ccccc1CN[C@@H](CC(=O)[O-])c1ccc(C(C)C)cc1 ZINC000426824112 1026582258 /nfs/dbraw/zinc/58/22/58/1026582258.db2.gz LHACCHLZHDTINF-SFHVURJKSA-N -1 3 327.424 4.124 20 0 EIADHM Cc1c(C)c(C)c(S(=O)(=O)[N-]c2ccc3c(c2)COC3)c(C)c1C ZINC000507009347 1026587628 /nfs/dbraw/zinc/58/76/28/1026587628.db2.gz ZPNBBYGRDZKGRB-UHFFFAOYSA-N -1 3 345.464 4.060 20 0 EIADHM COC(=O)c1cnc(SCCCSc2ccccc2Cl)[n-]1 ZINC000432671008 1026702545 /nfs/dbraw/zinc/70/25/45/1026702545.db2.gz OGYQOIXBEJSLJH-UHFFFAOYSA-N -1 3 342.873 4.124 20 0 EIADHM O=c1ccnc(C(=Cc2ccc(F)c(Cl)c2)Cc2ccccc2)[n-]1 ZINC000432693169 1026781799 /nfs/dbraw/zinc/78/17/99/1026781799.db2.gz HOFJOKSCNINHAK-PTNGSMBKSA-N -1 3 340.785 4.346 20 0 EIADHM O=c1ccnc(C(=Cc2cc(Cl)ccc2F)Cc2ccccc2)[n-]1 ZINC000432696626 1026784919 /nfs/dbraw/zinc/78/49/19/1026784919.db2.gz UKXMJLYNBCODPI-RVDMUPIBSA-N -1 3 340.785 4.346 20 0 EIADHM O=c1ccnc(C(=Cc2cc(F)cc(Cl)c2)Cc2ccccc2)[n-]1 ZINC000432695333 1026785750 /nfs/dbraw/zinc/78/57/50/1026785750.db2.gz PJVAOEHETHXOHK-OQLLNIDSSA-N -1 3 340.785 4.346 20 0 EIADHM O=C([N-]c1csc(-c2ccccn2)n1)c1cc(-c2ccccc2)on1 ZINC000342664136 1026822817 /nfs/dbraw/zinc/82/28/17/1026822817.db2.gz YBXCONXTSUGPRP-UHFFFAOYSA-N -1 3 348.387 4.112 20 0 EIADHM O=c1[n-]c(-c2ccon2)nc2ccc(Oc3ccc(Cl)cc3)cc12 ZINC000074797535 1027021364 /nfs/dbraw/zinc/02/13/64/1027021364.db2.gz RDXRMWYWHGWVKZ-UHFFFAOYSA-N -1 3 339.738 4.024 20 0 EIADHM O=C(Nc1ccc([O-])c(C(F)(F)F)c1)c1cc(-c2ccccc2)no1 ZINC000440977269 1027169331 /nfs/dbraw/zinc/16/93/31/1027169331.db2.gz DFXLOJLLVVIBJZ-UHFFFAOYSA-N -1 3 348.280 4.318 20 0 EIADHM [O-]c1ccc(NC(=S)NC2CC2)cc1-c1nc2ccccc2s1 ZINC000007582987 1027438137 /nfs/dbraw/zinc/43/81/37/1027438137.db2.gz VRFSYGGZWBSJGV-UHFFFAOYSA-N -1 3 341.461 4.118 20 0 EIADHM O=C(CCC1CCCCC1)[N-]OCc1cccc(OC(F)F)c1 ZINC000303555017 1027585572 /nfs/dbraw/zinc/58/55/72/1027585572.db2.gz KEMKQJGWPYCCSB-UHFFFAOYSA-N -1 3 327.371 4.196 20 0 EIADHM CC(C)(C)OC(=O)Nc1cccc(C(=O)Nc2cccc([O-])c2F)c1 ZINC000179156613 1027606803 /nfs/dbraw/zinc/60/68/03/1027606803.db2.gz BUPOECOLIQUREL-UHFFFAOYSA-N -1 3 346.358 4.131 20 0 EIADHM CC[C@@H](C(=O)Nc1ccc([O-])c(C(F)(F)F)c1)c1c(C)noc1C ZINC000342956585 1027768988 /nfs/dbraw/zinc/76/89/88/1027768988.db2.gz YCIAXWRJILQMBC-LLVKDONJSA-N -1 3 342.317 4.148 20 0 EIADHM COc1ccc([O-])c(C(=O)Nc2ccc(OC(C)C)cc2Cl)c1 ZINC000444513516 1027858831 /nfs/dbraw/zinc/85/88/31/1027858831.db2.gz UTHNYHDDBYXEAO-UHFFFAOYSA-N -1 3 335.787 4.094 20 0 EIADHM COc1ccc([O-])c(C(=O)N2C[C@@H](C(C)(C)C)c3ccccc32)c1 ZINC000443865649 1028005851 /nfs/dbraw/zinc/00/58/51/1028005851.db2.gz DCVMYJVBNRWOMV-MRXNPFEDSA-N -1 3 325.408 4.191 20 0 EIADHM COc1ccccc1[C@@H](NCc1cccc(-c2ccccc2)c1)C(=O)[O-] ZINC000426768844 1028081853 /nfs/dbraw/zinc/08/18/53/1028081853.db2.gz CRTURHZAMZXJOI-OAQYLSRUSA-N -1 3 347.414 4.278 20 0 EIADHM O=C([O-])[C@@H](NCc1cccc(-c2ccccc2)c1)c1cccc(F)c1 ZINC000426813108 1028088715 /nfs/dbraw/zinc/08/87/15/1028088715.db2.gz VEGZQKPQYDFNAU-FQEVSTJZSA-N -1 3 335.378 4.408 20 0 EIADHM O=C([O-])c1ccc(Cl)c(CN2CCC[C@H]2Cc2cccc(F)c2)c1 ZINC000583147818 1028089266 /nfs/dbraw/zinc/08/92/66/1028089266.db2.gz QMQCQZCCPHZYPD-KRWDZBQOSA-N -1 3 347.817 4.384 20 0 EIADHM Cc1cc(S(=O)(=O)[N-]c2ccsc2Cl)c(Cl)cc1F ZINC000189739132 1028212324 /nfs/dbraw/zinc/21/23/24/1028212324.db2.gz DXGVSQCBRRBFNG-UHFFFAOYSA-N -1 3 340.228 4.303 20 0 EIADHM COc1cc(C(=O)N(C)C2CCC(C(C)(C)C)CC2)cc(OC)c1[O-] ZINC000343162238 1028445756 /nfs/dbraw/zinc/44/57/56/1028445756.db2.gz GXRXVNULWWBKPM-UHFFFAOYSA-N -1 3 349.471 4.086 20 0 EIADHM O=C([O-])c1ccccc1CC1CCN(Cc2ccccc2Cl)CC1 ZINC000566510520 1028677291 /nfs/dbraw/zinc/67/72/91/1028677291.db2.gz TZOZXZKRNFYJIT-UHFFFAOYSA-N -1 3 343.854 4.493 20 0 EIADHM O=c1nc([C@@H]2CSc3ccccc3O2)[n-]c2sc3c(c21)CCC3 ZINC000685189909 1029092591 /nfs/dbraw/zinc/09/25/91/1029092591.db2.gz ZXOXCBYZLMVDEL-NSHDSACASA-N -1 3 342.445 4.111 20 0 EIADHM CC[C@@H](c1ccc(Br)cc1)N1CCC(C)(C(=O)[O-])CC1 ZINC000086776870 1029100546 /nfs/dbraw/zinc/10/05/46/1029100546.db2.gz NQTGZRVLBZVMDV-AWEZNQCLSA-N -1 3 340.261 4.087 20 0 EIADHM O=c1[n-]c(CSc2ccc(Cl)cn2)nc2c3ccccc3oc21 ZINC000103260084 1029192118 /nfs/dbraw/zinc/19/21/18/1029192118.db2.gz BQVIAINCHILBLE-UHFFFAOYSA-N -1 3 343.795 4.010 20 0 EIADHM Cc1noc(C(C)C)c1[N-]C(=O)c1sccc1Br ZINC000928785767 1029425379 /nfs/dbraw/zinc/42/53/79/1029425379.db2.gz AFIKTAMKAPKJOH-UHFFFAOYSA-N -1 3 329.219 4.183 20 0 EIADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)CC(C)=C(C)C)c2)n1 ZINC000635348407 1029431941 /nfs/dbraw/zinc/43/19/41/1029431941.db2.gz NMYDASWMNCKGDK-UHFFFAOYSA-N -1 3 325.412 4.097 20 0 EIADHM Cc1cccc(NC(=O)NCc2ccc([O-])c(Br)c2)c1C ZINC000151460435 1029527236 /nfs/dbraw/zinc/52/72/36/1029527236.db2.gz UAJFSYTVEHIAFG-UHFFFAOYSA-N -1 3 349.228 4.093 20 0 EIADHM O=C(NCCOc1cccc2ccccc21)c1cc([O-])ccc1Cl ZINC000584023228 1029537835 /nfs/dbraw/zinc/53/78/35/1029537835.db2.gz BQWJYLNBBSRKNN-UHFFFAOYSA-N -1 3 341.794 4.008 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)N[C@H](c1cccs1)C1CC1 ZINC000468365118 1029544527 /nfs/dbraw/zinc/54/45/27/1029544527.db2.gz REQHAMAHWBLANQ-SFHVURJKSA-N -1 3 333.428 4.183 20 0 EIADHM CCc1noc(C)c1CSCc1cc(=O)[n-]c(-c2ccccc2)n1 ZINC000584162822 1029652394 /nfs/dbraw/zinc/65/23/94/1029652394.db2.gz MOYWXEGNEFJODD-UHFFFAOYSA-N -1 3 341.436 4.141 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(NCCc3ccc(C)cc3C)nc2)n1 ZINC000301187267 1029684116 /nfs/dbraw/zinc/68/41/16/1029684116.db2.gz VQYJJWYDSDURCZ-UHFFFAOYSA-N -1 3 348.450 4.078 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@@H]3CCC[C@@H](CC)C3)nc2)n1 ZINC000301353765 1029714855 /nfs/dbraw/zinc/71/48/55/1029714855.db2.gz MIPRHZCLBWHJDO-CZUORRHYSA-N -1 3 326.444 4.187 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(NC[C@H](C)c3cccc(C)c3)nc2)n1 ZINC000301364620 1029717362 /nfs/dbraw/zinc/71/73/62/1029717362.db2.gz QFIJFLPNGXLDOY-HNNXBMFYSA-N -1 3 348.450 4.331 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@H](c3ccccc3)C3CC3)nc2)n1 ZINC000301497591 1029743529 /nfs/dbraw/zinc/74/35/29/1029743529.db2.gz BULPCKFBBSDULF-HXUWFJFHSA-N -1 3 346.434 4.370 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N3CCC[C@@H]3c3ccccc3)nc2)n1 ZINC000301503919 1029745313 /nfs/dbraw/zinc/74/53/13/1029745313.db2.gz GDEXEJXNKCWJPY-GOSISDBHSA-N -1 3 346.434 4.148 20 0 EIADHM Clc1cnc(-n2cc([N-]c3nc4ccccc4o3)cn2)c(Cl)c1 ZINC000301717880 1029797078 /nfs/dbraw/zinc/79/70/78/1029797078.db2.gz YMWGCRUEMYVBLX-UHFFFAOYSA-N -1 3 346.177 4.459 20 0 EIADHM CC1(C)CCc2cccc(NC(=O)c3cc([O-])ccc3Cl)c2O1 ZINC000530042310 1030082859 /nfs/dbraw/zinc/08/28/59/1030082859.db2.gz NRPQMBQDHROYFL-UHFFFAOYSA-N -1 3 331.799 4.402 20 0 EIADHM Cc1cc(NC(=O)c2ccc(C)cc2[O-])n(-c2cccc(Cl)c2)n1 ZINC001143457777 1030230091 /nfs/dbraw/zinc/23/00/91/1030230091.db2.gz JTKYRFKCIAQTAW-UHFFFAOYSA-N -1 3 341.798 4.100 20 0 EIADHM O=C(CC1(CSc2ccccc2)CC1)NCc1ccc([O-])c(F)c1 ZINC000186178257 1030256014 /nfs/dbraw/zinc/25/60/14/1030256014.db2.gz GISMTOVDRZGRBA-UHFFFAOYSA-N -1 3 345.439 4.110 20 0 EIADHM O=S(=O)([N-]c1cc(Cl)ccc1F)c1ccc2c(c1)CCCC2 ZINC000006316265 1030287361 /nfs/dbraw/zinc/28/73/61/1030287361.db2.gz RYXMZPTYBGFPLK-UHFFFAOYSA-N -1 3 339.819 4.159 20 0 EIADHM O=C1[N-]C(=O)C(=CNc2ccc(-c3ccccc3)cc2)c2ccccc21 ZINC000145224905 1030378171 /nfs/dbraw/zinc/37/81/71/1030378171.db2.gz IHZOLXNIUJVPCF-ZHZULCJRSA-N -1 3 340.382 4.077 20 0 EIADHM CN(C(=O)CCCc1ccc([O-])c(F)c1)[C@H]1CCCc2ccccc21 ZINC000527038307 1030421111 /nfs/dbraw/zinc/42/11/11/1030421111.db2.gz FLWKTDNASIBHGE-IBGZPJMESA-N -1 3 341.426 4.390 20 0 EIADHM Cc1cc(=O)[n-]c([C@H](C)N[C@@H](c2ccc(F)c(Cl)c2)C2CC2)n1 ZINC000451354029 1030428888 /nfs/dbraw/zinc/42/88/88/1030428888.db2.gz MBLQQMPQPLYUAA-MGPLVRAMSA-N -1 3 335.810 4.085 20 0 EIADHM CCOc1ccc(F)c([N-]C(=O)c2oc(CC(C)C)nc2C)c1F ZINC000475809866 1030572637 /nfs/dbraw/zinc/57/26/37/1030572637.db2.gz IXJMEOOKASOWCZ-UHFFFAOYSA-N -1 3 338.354 4.111 20 0 EIADHM O=C(CCCc1cccs1)Nc1cc(Br)ccc1[O-] ZINC000530678219 1030648073 /nfs/dbraw/zinc/64/80/73/1030648073.db2.gz JNEBQCPSLYBGEZ-UHFFFAOYSA-N -1 3 340.242 4.178 20 0 EIADHM COc1cc(Cl)c(Cl)cc1C(=O)Nc1cc(F)ccc1[O-] ZINC000530680386 1030648219 /nfs/dbraw/zinc/64/82/19/1030648219.db2.gz ZTUSRQKALHAZLZ-UHFFFAOYSA-N -1 3 330.142 4.099 20 0 EIADHM Cc1cccc(C2(C(=O)Nc3cc(Br)ccc3[O-])CC2)c1 ZINC000530777701 1030707222 /nfs/dbraw/zinc/70/72/22/1030707222.db2.gz NAPCMSIOXCMVBJ-UHFFFAOYSA-N -1 3 346.224 4.133 20 0 EIADHM CCC(CC)n1nc(C(=O)N=c2cc(C3(C)CCCC3)o[n-]2)cc1C ZINC000448416653 1030777862 /nfs/dbraw/zinc/77/78/62/1030777862.db2.gz WCTGVHKMHPILEZ-UHFFFAOYSA-N -1 3 344.459 4.047 20 0 EIADHM O=S(=O)([N-]c1cc(F)ccc1Cl)c1cc(F)ccc1Cl ZINC000103059737 1030834282 /nfs/dbraw/zinc/83/42/82/1030834282.db2.gz OTWHFVKRGFZBCC-UHFFFAOYSA-N -1 3 338.162 4.072 20 0 EIADHM CCCOc1ccc([C@@H](C)NCc2ccc(C(=O)[O-])cc2)cc1OC ZINC000263479458 1030887334 /nfs/dbraw/zinc/88/73/34/1030887334.db2.gz NNYJQFKGBMJCDP-CQSZACIVSA-N -1 3 343.423 4.033 20 0 EIADHM CSc1ccc([O-])c(C(=O)N2CCCCC[C@@H]2c2ccncc2)c1 ZINC000666417413 1030893315 /nfs/dbraw/zinc/89/33/15/1030893315.db2.gz GHYTWHVPMKNQRH-QGZVFWFLSA-N -1 3 342.464 4.267 20 0 EIADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)[C@@]3(C)CC=CCC3)c2)n1 ZINC000448727091 1030990219 /nfs/dbraw/zinc/99/02/19/1030990219.db2.gz WPTCVJHODAKIHA-FQEVSTJZSA-N -1 3 337.423 4.097 20 0 EIADHM O=C(Cc1ccc([O-])c(F)c1)N1CCCCC[C@@H]1c1ccccc1 ZINC000448734715 1031020046 /nfs/dbraw/zinc/02/00/46/1031020046.db2.gz HRBGXPHAAMLZQA-GOSISDBHSA-N -1 3 327.399 4.218 20 0 EIADHM CCc1cccc(C(=O)N2CC3(CCC3)c3c2cccc3F)c1[O-] ZINC000531432553 1031233806 /nfs/dbraw/zinc/23/38/06/1031233806.db2.gz XYTKVMWWXWREKU-UHFFFAOYSA-N -1 3 325.383 4.176 20 0 EIADHM C[C@@H]1CC[C@@H](c2noc(-c3cc(Cc4ccccc4)ccc3[O-])n2)O1 ZINC000528234492 1031281070 /nfs/dbraw/zinc/28/10/70/1031281070.db2.gz KQXZRTJFRUADCG-ACJLOTCBSA-N -1 3 336.391 4.273 20 0 EIADHM [O-]c1ccc(Cc2nc(-c3ccccc3OC3CCC3)no2)cc1F ZINC000528260537 1031312156 /nfs/dbraw/zinc/31/21/56/1031312156.db2.gz PEJAVOHZCQJKTG-UHFFFAOYSA-N -1 3 340.354 4.103 20 0 EIADHM Cc1c(Br)ccc([O-])c1NC(=O)c1cc[nH]c1C1CCC1 ZINC000452760588 1031313362 /nfs/dbraw/zinc/31/33/62/1031313362.db2.gz VUXOTKMZDGIPKC-UHFFFAOYSA-N -1 3 349.228 4.311 20 0 EIADHM Cc1ccccc1[C@@H](C(C)C)N(C)C(=O)Cc1ccc([O-])c(F)c1 ZINC000448962203 1031325343 /nfs/dbraw/zinc/32/53/43/1031325343.db2.gz PSMNUDMNHIIDLR-HXUWFJFHSA-N -1 3 329.415 4.238 20 0 EIADHM CCOCc1ccc(NCc2cccc([O-])c2Br)cc1 ZINC000459359278 1031924384 /nfs/dbraw/zinc/92/43/84/1031924384.db2.gz GFYFIVBFYAZLLJ-UHFFFAOYSA-N -1 3 336.229 4.303 20 0 EIADHM [O-]c1cccc(CNCc2cccc(OCC(F)(F)F)c2)c1Cl ZINC000645146295 1033831124 /nfs/dbraw/zinc/83/11/24/1033831124.db2.gz NLQFICHARDURLN-UHFFFAOYSA-N -1 3 345.748 4.277 20 0 EIADHM Cc1c(F)ccc(Cl)c1[N-]S(=O)(=O)Cc1c(F)cccc1F ZINC000433117528 1033871623 /nfs/dbraw/zinc/87/16/23/1033871623.db2.gz PAOOHHUQAWAFKV-UHFFFAOYSA-N -1 3 349.761 4.008 20 0 EIADHM Cc1cc(F)cc2c(=O)c(C(=O)Nc3cccc4ccccc43)c[n-]c12 ZINC000433225276 1034070045 /nfs/dbraw/zinc/07/00/45/1034070045.db2.gz HANDESVIECKPDV-UHFFFAOYSA-N -1 3 346.361 4.381 20 0 EIADHM CC(C)(C)c1ccc(NC(=O)c2ccc3c(c2)CCCC3=O)c([O-])c1 ZINC000512904071 1034188138 /nfs/dbraw/zinc/18/81/38/1034188138.db2.gz LYNTVSHPRUWHCU-UHFFFAOYSA-N -1 3 337.419 4.461 20 0 EIADHM COc1ccc(C2(NC(=O)c3cc([O-])ccc3Cl)CCCC2)cc1 ZINC000433354629 1034265057 /nfs/dbraw/zinc/26/50/57/1034265057.db2.gz OONUKADLLNRRFD-UHFFFAOYSA-N -1 3 345.826 4.254 20 0 EIADHM O=C(Nc1ccc(OC(F)F)cc1F)c1cc([O-])ccc1Cl ZINC000513272632 1034864114 /nfs/dbraw/zinc/86/41/14/1034864114.db2.gz SKWWJTKYRPKYQW-UHFFFAOYSA-N -1 3 331.677 4.038 20 0 EIADHM COC[C@@H](c1ccc(Cl)cc1)N(C)Cc1c(F)ccc([O-])c1F ZINC000513308197 1034872074 /nfs/dbraw/zinc/87/20/74/1034872074.db2.gz FSDJMGVAPDOFKK-HNNXBMFYSA-N -1 3 341.785 4.143 20 0 EIADHM CC(C)(C)Cc1csc([N-]C(=O)c2cc(-c3ccccn3)no2)n1 ZINC000345422055 1035216984 /nfs/dbraw/zinc/21/69/84/1035216984.db2.gz KEKOLDGHWQUWQV-UHFFFAOYSA-N -1 3 342.424 4.034 20 0 EIADHM CC[C@@H](c1ccccc1)N(CC)C(=O)c1cc(=O)c2ccccc2[n-]1 ZINC000345843402 1035313943 /nfs/dbraw/zinc/31/39/43/1035313943.db2.gz UZIXDANEKOVOGT-IBGZPJMESA-N -1 3 334.419 4.142 20 0 EIADHM COc1cc(CSCc2cc(=O)[n-]c(C3CC3)n2)ccc1SC ZINC000419414255 1035346468 /nfs/dbraw/zinc/34/64/68/1035346468.db2.gz TXIVWPNLANJZRI-UHFFFAOYSA-N -1 3 348.493 4.224 20 0 EIADHM O=C(Nc1ccc([O-])c(C(F)(F)F)c1)c1nc2ccccc2s1 ZINC000501455909 1035450831 /nfs/dbraw/zinc/45/08/31/1035450831.db2.gz SSILHYKRDPIVTJ-UHFFFAOYSA-N -1 3 338.310 4.273 20 0 EIADHM Cc1cc([N-]S(=O)(=O)c2ccc(OC(C)C)c(C)c2)ccc1F ZINC000485117102 1035706232 /nfs/dbraw/zinc/70/62/32/1035706232.db2.gz AMSFOHWZWUPDTI-UHFFFAOYSA-N -1 3 337.416 4.031 20 0 EIADHM Cc1ccc(C(=O)Nc2nnc(-c3cc4ccccc4o3)[n-]2)c(C)c1 ZINC000485130106 1035713190 /nfs/dbraw/zinc/71/31/90/1035713190.db2.gz BQCPBSSRYQWEFP-UHFFFAOYSA-N -1 3 332.363 4.087 20 0 EIADHM Cc1ccc(C(=O)Nc2n[n-]c(-c3cc4ccccc4o3)n2)c(C)c1 ZINC000485130106 1035713214 /nfs/dbraw/zinc/71/32/14/1035713214.db2.gz BQCPBSSRYQWEFP-UHFFFAOYSA-N -1 3 332.363 4.087 20 0 EIADHM CC(=O)Nc1ccc(-c2nc3cc(Cl)c(Cl)cc3c(=O)[n-]2)cc1 ZINC000485365992 1035848612 /nfs/dbraw/zinc/84/86/12/1035848612.db2.gz XMRHITVFDAMAEA-UHFFFAOYSA-N -1 3 348.189 4.268 20 0 EIADHM Cc1cc(-c2csc(NC(=O)c3cccc(C)c3[O-])n2)c(C)o1 ZINC000195560339 1035866865 /nfs/dbraw/zinc/86/68/65/1035866865.db2.gz IHUQOLXSBPXUQG-UHFFFAOYSA-N -1 3 328.393 4.286 20 0 EIADHM C[C@@H]1C[C@@H]1c1ccc(CNCCc2cc3ccc(C(=O)[O-])cc3o2)o1 ZINC000905804005 1035897688 /nfs/dbraw/zinc/89/76/88/1035897688.db2.gz OZTGEQAJBJZFIW-PXAZEXFGSA-N -1 3 339.391 4.180 20 0 EIADHM CC(C)Oc1ccc([C@H](C)NC(=O)c2cc([O-])ccc2Cl)cc1 ZINC000571212405 1036017118 /nfs/dbraw/zinc/01/71/18/1036017118.db2.gz WVFFSVVQXVLBLK-LBPRGKRZSA-N -1 3 333.815 4.324 20 0 EIADHM CC1(C)CCC[C@H]1[C@H]1CCN(Cc2nc(=O)c3sccc3[n-]2)C1 ZINC000646050633 1036069460 /nfs/dbraw/zinc/06/94/60/1036069460.db2.gz JDZTUMDOSZWLMJ-STQMWFEESA-N -1 3 331.485 4.045 20 0 EIADHM CC(C)(C)c1ccc(-c2noc(-c3cc(=O)[n-]c(C4CC4)n3)n2)cc1 ZINC000906110836 1036075272 /nfs/dbraw/zinc/07/52/72/1036075272.db2.gz IVDLTFYLCWWUMX-UHFFFAOYSA-N -1 3 336.395 4.074 20 0 EIADHM CC(C)(C)c1ccncc1CNCc1cccc([O-])c1Br ZINC000414500422 1036101183 /nfs/dbraw/zinc/10/11/83/1036101183.db2.gz QAVAWQJQLAQPEW-UHFFFAOYSA-N -1 3 349.272 4.137 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@H]3CCc4ccc(C)cc43)nc2)n1 ZINC000597947944 1036397707 /nfs/dbraw/zinc/39/77/07/1036397707.db2.gz MKBZZDDKESXLRH-SFHVURJKSA-N -1 3 346.434 4.214 20 0 EIADHM [O-]c1ccc(Br)cc1/C=N/Cc1nc2ccccc2s1 ZINC000060805157 1036477500 /nfs/dbraw/zinc/47/75/00/1036477500.db2.gz ROABRGOBSAYOFG-CAOOACKPSA-N -1 3 347.237 4.384 20 0 EIADHM Cc1c(C(=O)Nc2ccc([O-])c(C(F)(F)F)c2)ccn1C(C)C ZINC000486098867 1036482084 /nfs/dbraw/zinc/48/20/84/1036482084.db2.gz VKWLVHGDNUWMQI-UHFFFAOYSA-N -1 3 326.318 4.354 20 0 EIADHM COc1ccc(C)cc1-c1csc([N-]c2ncnc3ccncc32)n1 ZINC000502733955 1036596385 /nfs/dbraw/zinc/59/63/85/1036596385.db2.gz FZGIWCNLEHEWDR-UHFFFAOYSA-N -1 3 349.419 4.209 20 0 EIADHM Cc1ncc(C(=O)[N-]c2nc(C(C)(C)C)ns2)c(Cl)c1Cl ZINC000271724540 1036991058 /nfs/dbraw/zinc/99/10/58/1036991058.db2.gz MGSWDHANYVVXGE-UHFFFAOYSA-N -1 3 345.255 4.098 20 0 EIADHM CCS[C@H]1CCCCN(C(=O)c2cc([O-])cc(C(F)(F)F)c2)C1 ZINC000590436459 1037066532 /nfs/dbraw/zinc/06/65/32/1037066532.db2.gz VHPCUUGSYGVTOO-AWEZNQCLSA-N -1 3 347.402 4.159 20 0 EIADHM Cc1cc(C(=O)Nc2cccc([O-])c2F)cc(C(=O)OC(C)(C)C)c1 ZINC000590908861 1037202225 /nfs/dbraw/zinc/20/22/25/1037202225.db2.gz KSYHRQYZRUNHAA-UHFFFAOYSA-N -1 3 345.370 4.047 20 0 EIADHM C[C@H](c1cccs1)N(C)CCOc1ccc(C(=O)[O-])cc1Cl ZINC000573126326 1037344022 /nfs/dbraw/zinc/34/40/22/1037344022.db2.gz OQZKQVHBSWIABX-LLVKDONJSA-N -1 3 339.844 4.172 20 0 EIADHM CCN(Cc1ccc(Cl)c(Cl)c1)[C@@H](C(=O)[O-])c1cccnc1 ZINC000573570508 1037604833 /nfs/dbraw/zinc/60/48/33/1037604833.db2.gz GKRWCMFIRCIUOI-OAHLLOKOSA-N -1 3 339.222 4.036 20 0 EIADHM Cc1cc(=O)[n-]c([C@H](C)Sc2nccn2-c2ccc(Cl)cc2)n1 ZINC000488471076 1037621167 /nfs/dbraw/zinc/62/11/67/1037621167.db2.gz ADRWGVDLPVPKNX-NSHDSACASA-N -1 3 346.843 4.183 20 0 EIADHM CN(CCCCCC(=O)[O-])Cc1ccc(Br)cc1Cl ZINC000573733662 1037681409 /nfs/dbraw/zinc/68/14/09/1037681409.db2.gz JCYCGRLWNKIIIT-UHFFFAOYSA-N -1 3 348.668 4.179 20 0 EIADHM CC(C)[C@@H](C(=O)NCc1ccc([O-])c(F)c1)c1cccc(Cl)c1 ZINC000488604100 1037687494 /nfs/dbraw/zinc/68/74/94/1037687494.db2.gz VVIOKIZDADDXIY-QGZVFWFLSA-N -1 3 335.806 4.241 20 0 EIADHM Cc1cccc([C@@H](NC(=O)c2cc(=O)c3ccccc3[n-]2)C(C)(C)C)c1 ZINC000488794270 1037755738 /nfs/dbraw/zinc/75/57/38/1037755738.db2.gz JGELVGBMLIPEMS-HXUWFJFHSA-N -1 3 348.446 4.354 20 0 EIADHM CCC(C)(C)[C@H](C)NC(=O)Nc1ccc(-c2cc(=O)[n-]c(C)n2)cc1 ZINC000664319909 1037772692 /nfs/dbraw/zinc/77/26/92/1037772692.db2.gz UGNUUIHXOPYPGZ-LBPRGKRZSA-N -1 3 342.443 4.104 20 0 EIADHM Cc1cccc2c1[C@@H](C)C[C@@H]2CC(=O)NCc1ccc([O-])c(F)c1 ZINC000488990220 1037827935 /nfs/dbraw/zinc/82/79/35/1037827935.db2.gz YCJBPWSKJXNXJH-DZGCQCFKSA-N -1 3 327.399 4.137 20 0 EIADHM CC(C)Sc1c(Cl)cccc1[N-]C(=O)c1cnc(CN)s1 ZINC000912257895 1037910052 /nfs/dbraw/zinc/91/00/52/1037910052.db2.gz OSYCFVYSPRIDNG-UHFFFAOYSA-N -1 3 341.889 4.008 20 0 EIADHM Cc1cc(C(=O)NCc2ccc([O-])c(F)c2)c(C)n1C1CCCCC1 ZINC000606536793 1038149883 /nfs/dbraw/zinc/14/98/83/1038149883.db2.gz IGUOCSJWXGQPKC-UHFFFAOYSA-N -1 3 344.430 4.385 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)NC1CCC(c2ccccc2)CC1 ZINC000606636885 1038193781 /nfs/dbraw/zinc/19/37/81/1038193781.db2.gz KDLBOMOFJBMCFC-UHFFFAOYSA-N -1 3 342.414 4.057 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1ccccc1Oc1ccncc1 ZINC000513807998 1038207755 /nfs/dbraw/zinc/20/77/55/1038207755.db2.gz LWSWOLBIXGCKEK-UHFFFAOYSA-N -1 3 340.766 4.485 20 0 EIADHM C[C@H](CC(C)(C)c1ccccc1)NC(=O)NCc1ccc([O-])c(F)c1 ZINC000606659584 1038209291 /nfs/dbraw/zinc/20/92/91/1038209291.db2.gz OBCKYXBDOBCDQZ-CQSZACIVSA-N -1 3 344.430 4.087 20 0 EIADHM Cc1oc([C@H](C)N(C)CCCOc2ccccc2C)cc1C(=O)[O-] ZINC000574406918 1038210264 /nfs/dbraw/zinc/21/02/64/1038210264.db2.gz XYFPWVWFHSNDLP-AWEZNQCLSA-N -1 3 331.412 4.057 20 0 EIADHM O=C(Nc1ccc(C(F)F)cc1)c1cc([O-])cc(Br)c1 ZINC000700845160 1038237977 /nfs/dbraw/zinc/23/79/77/1038237977.db2.gz UYECPYFYIUYNNW-UHFFFAOYSA-N -1 3 342.139 4.345 20 0 EIADHM CC(C)(C)Oc1ccc([N-]S(=O)(=O)c2ccc3c(c2)CCC3)cc1 ZINC000607615992 1038240384 /nfs/dbraw/zinc/24/03/84/1038240384.db2.gz KPDVAHGDSZCIPU-UHFFFAOYSA-N -1 3 345.464 4.153 20 0 EIADHM CC(C)c1ccc([N-]S(=O)(=O)c2ccc3ncccc3c2)cc1 ZINC000607031066 1038351636 /nfs/dbraw/zinc/35/16/36/1038351636.db2.gz BUIVOBXFVULLEM-UHFFFAOYSA-N -1 3 326.421 4.159 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@@H]3CC[C@@H]4CCC[C@H]4C3)nc2)n1 ZINC000608090889 1038591129 /nfs/dbraw/zinc/59/11/29/1038591129.db2.gz QPYQXEJNNVXWDX-GRDNDAEWSA-N -1 3 338.455 4.187 20 0 EIADHM CC(C)c1cc(Cl)ccc1NC(=O)c1cnc(C2CC2)[n-]c1=O ZINC000913014388 1038616602 /nfs/dbraw/zinc/61/66/02/1038616602.db2.gz RZQYDXMSQRGRGW-UHFFFAOYSA-N -1 3 331.803 4.089 20 0 EIADHM CCNc1cc(C)ccc1NC(=O)CCCc1ccc([O-])c(F)c1 ZINC000480802125 1038821683 /nfs/dbraw/zinc/82/16/83/1038821683.db2.gz QPKRYJOVRNSRRW-UHFFFAOYSA-N -1 3 330.403 4.233 20 0 EIADHM O=C([O-])[C@@H]1CCN(Cc2cccc(Cl)c2Cl)[C@@H]2CCC[C@@H]21 ZINC000629374235 1039044940 /nfs/dbraw/zinc/04/49/40/1039044940.db2.gz QESNBYZIYBKPQI-YRGRVCCFSA-N -1 3 328.239 4.069 20 0 EIADHM O=C(Nc1ccc([O-])c(C(F)(F)F)c1)[C@@H]1CC[C@@H](C(F)(F)F)C1 ZINC000552116033 1039146898 /nfs/dbraw/zinc/14/68/98/1039146898.db2.gz ZVQZDQPHPIRIOB-HTQZYQBOSA-N -1 3 341.251 4.328 20 0 EIADHM CCc1ccc([O-])c(C(=O)Nc2ccc(OC)cc2C(F)(F)F)c1 ZINC000552137800 1039171578 /nfs/dbraw/zinc/17/15/78/1039171578.db2.gz NKTBIFWYUYQOGJ-UHFFFAOYSA-N -1 3 339.313 4.234 20 0 EIADHM O=C(Cc1ccc([O-])c(F)c1)Nc1cccc(OC2CCCC2)c1 ZINC000448649409 1039205012 /nfs/dbraw/zinc/20/50/12/1039205012.db2.gz HRZBKSGFMDXPRR-UHFFFAOYSA-N -1 3 329.371 4.034 20 0 EIADHM CCN(c1ccc(C(=O)Nc2cccc(C(C)=O)c2[O-])cc1)C(C)C ZINC000552288118 1039339747 /nfs/dbraw/zinc/33/97/47/1039339747.db2.gz CSDAZEZGHLGMNE-UHFFFAOYSA-N -1 3 340.423 4.082 20 0 EIADHM CCc1ccc([O-])c(C(=O)N(c2ccc(OC)cc2)[C@@H](C)C2CC2)c1 ZINC000537637887 1039532962 /nfs/dbraw/zinc/53/29/62/1039532962.db2.gz AFWCRNNZRODZNT-AWEZNQCLSA-N -1 3 339.435 4.409 20 0 EIADHM Cc1ccc([O-])c(NC(=O)c2ccc(C(C)(C)C(F)(F)F)cc2)n1 ZINC000434546679 1039606974 /nfs/dbraw/zinc/60/69/74/1039606974.db2.gz IULFSMKASIODNF-UHFFFAOYSA-N -1 3 338.329 4.188 20 0 EIADHM CCc1cccc(C(=O)N(C)[C@@H](C)c2nc3ccccc3s2)c1[O-] ZINC000537650943 1039842303 /nfs/dbraw/zinc/84/23/03/1039842303.db2.gz DKBDTQVTOLWHHD-LBPRGKRZSA-N -1 3 340.448 4.398 20 0 EIADHM Cc1ccc(Cl)c(S(=O)(=O)[N-]c2cc(F)ccc2Cl)c1 ZINC000535025292 1039894271 /nfs/dbraw/zinc/89/42/71/1039894271.db2.gz MZIXPOPGDJDPGT-UHFFFAOYSA-N -1 3 334.199 4.242 20 0 EIADHM Cc1c(S(=O)(=O)[N-]c2ccsc2Cl)c2ccccc2n1C ZINC000551107859 1039981754 /nfs/dbraw/zinc/98/17/54/1039981754.db2.gz IXIVHJITNDCCSW-UHFFFAOYSA-N -1 3 340.857 4.002 20 0 EIADHM CCCCCc1nnc([N-]C(=O)c2cc3cccc(OC)c3o2)s1 ZINC000097256386 1040051739 /nfs/dbraw/zinc/05/17/39/1040051739.db2.gz RCNWIWAEKIBZBT-UHFFFAOYSA-N -1 3 345.424 4.278 20 0 EIADHM COc1ccc(C)cc1CSCc1noc(-c2ccccc2[O-])n1 ZINC000158845788 1040252049 /nfs/dbraw/zinc/25/20/49/1040252049.db2.gz RDPDFDDBTATDQL-UHFFFAOYSA-N -1 3 342.420 4.193 20 0 EIADHM CCCc1cc(=O)[n-]c(C(=Cc2cc(C)c(OC)c(C)c2)CC)n1 ZINC000435336116 1040292495 /nfs/dbraw/zinc/29/24/95/1040292495.db2.gz NAOSGQROBJAPMM-LFIBNONCSA-N -1 3 326.440 4.298 20 0 EIADHM CCCc1cc(=O)[n-]c(C(=Cc2ccc(OCC3CC3)cc2)CC)n1 ZINC000435340318 1040295110 /nfs/dbraw/zinc/29/51/10/1040295110.db2.gz GJEMFAPSYDUXPT-ATVHPVEESA-N -1 3 338.451 4.462 20 0 EIADHM O=C(N[C@@H](C1CCCCC1)C(F)(F)F)c1cc([O-])ccc1Cl ZINC000551511776 1040360752 /nfs/dbraw/zinc/36/07/52/1040360752.db2.gz FJIXNVYZDWUDRI-ZDUSSCGKSA-N -1 3 335.753 4.287 20 0 EIADHM Cn1ccnc1[C@H]([N-]c1nc2ccccc2o1)c1ccc(Cl)cc1 ZINC000514971284 1040394313 /nfs/dbraw/zinc/39/43/13/1040394313.db2.gz OIOCIDJOFRNFPK-MRXNPFEDSA-N -1 3 338.798 4.416 20 0 EIADHM Cc1cccc(S(=O)(=O)[N-]c2ccc(F)cc2Cl)c1Cl ZINC000539407679 1040419180 /nfs/dbraw/zinc/41/91/80/1040419180.db2.gz JLXTVTRDIYKSGW-UHFFFAOYSA-N -1 3 334.199 4.242 20 0 EIADHM CC[C@@H]1CCc2c(sc3[n-]c(-c4csc(C)n4)nc(=O)c23)C1 ZINC000668142510 1040519235 /nfs/dbraw/zinc/51/92/35/1040519235.db2.gz OHFOOZWYAMRFML-SECBINFHSA-N -1 3 331.466 4.344 20 0 EIADHM CCC(CC)[C@@H](NC(=O)c1cc(=O)[n-]c(C2CC2)n1)c1cccs1 ZINC000515310104 1040636239 /nfs/dbraw/zinc/63/62/39/1040636239.db2.gz NDXFATNNEYSIDJ-MRXNPFEDSA-N -1 3 345.468 4.028 20 0 EIADHM CSc1ccc([O-])c(C(=O)N(Cc2ccco2)C2CCCC2)c1 ZINC000667022341 1040664159 /nfs/dbraw/zinc/66/41/59/1040664159.db2.gz CWAGTMUKTCKADD-UHFFFAOYSA-N -1 3 331.437 4.292 20 0 EIADHM CCN(Cc1csc(CCC(C)C)n1)C1CCC(C(=O)[O-])CC1 ZINC000515501159 1040805576 /nfs/dbraw/zinc/80/55/76/1040805576.db2.gz WTBUKZSZNKOGMY-UHFFFAOYSA-N -1 3 338.517 4.197 20 0 EIADHM CCCN(Cc1csc(-c2cccc(C(=O)[O-])c2)n1)CC1CC1 ZINC000515491116 1040812565 /nfs/dbraw/zinc/81/25/65/1040812565.db2.gz XCNJRUBBDSZSHX-UHFFFAOYSA-N -1 3 330.453 4.130 20 0 EIADHM CCOc1ccc(-c2nc(=O)c3c4c(sc3[nH]2)CCCC4)c([O-])c1 ZINC000515597112 1040887219 /nfs/dbraw/zinc/88/72/19/1040887219.db2.gz IYTAPTDQVKXKDI-UHFFFAOYSA-N -1 3 342.420 4.047 20 0 EIADHM COc1ccc([N-]S(=O)(=O)c2ccccc2C(C)(C)C)c(C)c1 ZINC000460834926 1040995574 /nfs/dbraw/zinc/99/55/74/1040995574.db2.gz IITSWAWYALXMFU-UHFFFAOYSA-N -1 3 333.453 4.102 20 0 EIADHM O=c1nc(CO)[n-]c2scc(-c3ccc(-c4ccccc4)cc3)c21 ZINC000483844700 1041044631 /nfs/dbraw/zinc/04/46/31/1041044631.db2.gz AUBYIABVWBGBIZ-UHFFFAOYSA-N -1 3 334.400 4.223 20 0 EIADHM Cc1cc(CNCc2ccc(C(F)(F)F)s2)ccc1C(=O)[O-] ZINC000904021334 1041265174 /nfs/dbraw/zinc/26/51/74/1041265174.db2.gz TWIFAXGGVBEFCR-UHFFFAOYSA-N -1 3 329.343 4.063 20 0 EIADHM C[C@@H](C(=O)[O-])[C@H](NCc1ccc(C(F)(F)F)s1)c1ccccc1 ZINC000904005168 1041266946 /nfs/dbraw/zinc/26/69/46/1041266946.db2.gz PVPJAXQITYOARD-YGRLFVJLSA-N -1 3 343.370 4.319 20 0 EIADHM [O-]c1ccc(Cc2ccccc2)cc1-c1nc(Cc2cccnc2)no1 ZINC000436511884 1041297053 /nfs/dbraw/zinc/29/70/53/1041297053.db2.gz IGGCCMNYCLVDNR-UHFFFAOYSA-N -1 3 343.386 4.019 20 0 EIADHM CCC1(CC)CN(C(=O)c2cccc(OC)c2[O-])c2ccccc21 ZINC000436511269 1041297811 /nfs/dbraw/zinc/29/78/11/1041297811.db2.gz IKFMOIMXUYYABP-UHFFFAOYSA-N -1 3 325.408 4.119 20 0 EIADHM Cc1ccc(C(=O)N2CCC[C@@H](Oc3ccccc3Cl)C2)c([O-])c1 ZINC000436513315 1041300465 /nfs/dbraw/zinc/30/04/65/1041300465.db2.gz MMNSPLDYBMTMLM-CQSZACIVSA-N -1 3 345.826 4.038 20 0 EIADHM O=C(c1cc(CCc2ccccc2)ccc1[O-])N1C[C@@H]2CCC[C@@H]2C1 ZINC000436585943 1041360632 /nfs/dbraw/zinc/36/06/32/1041360632.db2.gz RUCUWSVFEVJDIC-KDURUIRLSA-N -1 3 335.447 4.050 20 0 EIADHM CN(Cc1ccc(O)cc1)C(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436584710 1041360869 /nfs/dbraw/zinc/36/08/69/1041360869.db2.gz JZXVBYRQGCXNHC-UHFFFAOYSA-N -1 3 349.386 4.162 20 0 EIADHM CC[C@@H]1CN(C(=O)c2ccc(OC)cc2[O-])CC[C@H]1c1ccccc1 ZINC000436587256 1041362317 /nfs/dbraw/zinc/36/23/17/1041362317.db2.gz OWPSDGPSSMESEO-CRAIPNDOSA-N -1 3 339.435 4.057 20 0 EIADHM CC(C)c1ccc(C(=O)NC[C@H]2CCO[C@H]2c2ccccc2)c([O-])c1 ZINC000436586194 1041363316 /nfs/dbraw/zinc/36/33/16/1041363316.db2.gz ATZJDGVCCLGLSS-XLIONFOSSA-N -1 3 339.435 4.023 20 0 EIADHM COc1ccc(C(=O)N2CCCC[C@H]2c2ccc(F)cc2F)c([O-])c1 ZINC000436604846 1041367404 /nfs/dbraw/zinc/36/74/04/1041367404.db2.gz OEJVWXXUZOUSFS-KRWDZBQOSA-N -1 3 347.361 4.046 20 0 EIADHM Cc1ccc(C(=O)Nc2ccccc2NC(=O)c2ccccc2)c([O-])c1 ZINC000436610707 1041373239 /nfs/dbraw/zinc/37/32/39/1041373239.db2.gz UOSXSMQVHFOWFW-UHFFFAOYSA-N -1 3 346.386 4.205 20 0 EIADHM CC(C)n1cc(NC(=O)N([O-])Cc2cc(Cl)cc(Cl)c2)cn1 ZINC000904197407 1041382171 /nfs/dbraw/zinc/38/21/71/1041382171.db2.gz BZXVMBOGXFNKCA-UHFFFAOYSA-N -1 3 343.214 4.194 20 0 EIADHM COCc1cccc2sc(NC(=O)c3ccc(C)c(C)c3[O-])nc21 ZINC000436676926 1041415896 /nfs/dbraw/zinc/41/58/96/1041415896.db2.gz ATHFEQPBTOXGJC-UHFFFAOYSA-N -1 3 342.420 4.017 20 0 EIADHM CCCC[C@H](C)N(CCCC)C(=O)c1cc(OC)c([O-])c(OC)c1 ZINC000436709393 1041428245 /nfs/dbraw/zinc/42/82/45/1041428245.db2.gz MXWDRCQPQNWNFR-AWEZNQCLSA-N -1 3 337.460 4.230 20 0 EIADHM Cc1ccc(C(=O)N(Cc2ccc([C@H]3C[C@@H]3C)o2)C2CC2)c([O-])c1 ZINC000436759888 1041457669 /nfs/dbraw/zinc/45/76/69/1041457669.db2.gz HVOLVPMKXGAVRY-GUYCJALGSA-N -1 3 325.408 4.222 20 0 EIADHM CCC[C@@H](Cc1ccccc1)N(CCC)C(=O)c1ccc(O)cc1[O-] ZINC000436750408 1041463473 /nfs/dbraw/zinc/46/34/73/1041463473.db2.gz WPSKOZJFXWYZMV-KRWDZBQOSA-N -1 3 341.451 4.361 20 0 EIADHM C[C@H]1CCN(C(=O)c2ccc3c(c2[O-])CCCC3)c2c(O)cccc21 ZINC000436818226 1041487432 /nfs/dbraw/zinc/48/74/32/1041487432.db2.gz JRMJXAKZLZLNTB-ZDUSSCGKSA-N -1 3 337.419 4.131 20 0 EIADHM C[C@@H]1CCN(C(=O)c2ccc3c(c2[O-])CCCC3)c2c(O)cccc21 ZINC000436818225 1041487629 /nfs/dbraw/zinc/48/76/29/1041487629.db2.gz JRMJXAKZLZLNTB-CYBMUJFWSA-N -1 3 337.419 4.131 20 0 EIADHM COC[C@H](C)Oc1ccc(Cl)cc1NC(=O)c1cccc(C)c1[O-] ZINC000436821069 1041500628 /nfs/dbraw/zinc/50/06/28/1041500628.db2.gz NZEWUDKRQLBINC-LBPRGKRZSA-N -1 3 349.814 4.020 20 0 EIADHM CCc1ccc(-c2nc(-c3cnc4ccccc4c3OC)no2)c([O-])c1 ZINC000436854471 1041507177 /nfs/dbraw/zinc/50/71/77/1041507177.db2.gz FUEIBBVYPRNSPX-UHFFFAOYSA-N -1 3 347.374 4.228 20 0 EIADHM Cn1cc(NC(=O)c2cc(Oc3ccccc3)ccc2[O-])c(C2CC2)n1 ZINC000436841091 1041508462 /nfs/dbraw/zinc/50/84/62/1041508462.db2.gz RJSRETWPVNKCPB-UHFFFAOYSA-N -1 3 349.390 4.048 20 0 EIADHM CCc1ccc([O-])c(C(=O)N2CCn3cccc3[C@@H]2c2ccccc2)c1 ZINC000538744156 1041519548 /nfs/dbraw/zinc/51/95/48/1041519548.db2.gz PGITVOMGTGLQGY-NRFANRHFSA-N -1 3 346.430 4.002 20 0 EIADHM CC(C)c1ccc(-c2nc(-c3cc(=O)[nH]c4ccccc43)no2)c([O-])c1 ZINC000436885517 1041542078 /nfs/dbraw/zinc/54/20/78/1041542078.db2.gz JOYXFJKGOGIPGD-UHFFFAOYSA-N -1 3 347.374 4.486 20 0 EIADHM CC(C)Oc1cc(-c2noc(-c3cc4ccccc4cc3[O-])n2)ccn1 ZINC000436916505 1041555920 /nfs/dbraw/zinc/55/59/20/1041555920.db2.gz WVEJRJIMGSXOCQ-UHFFFAOYSA-N -1 3 347.374 4.445 20 0 EIADHM Cc1cc([O-])ccc1-c1nc(=O)c2c3c(sc2[nH]1)C[C@H](C)CC3 ZINC000436920506 1041558640 /nfs/dbraw/zinc/55/86/40/1041558640.db2.gz PRYPENNVRKYDGA-SECBINFHSA-N -1 3 326.421 4.203 20 0 EIADHM C[C@@H](NC(=O)c1cc(Oc2ccccc2)ccc1[O-])c1ccccn1 ZINC000436924131 1041558942 /nfs/dbraw/zinc/55/89/42/1041558942.db2.gz FHPIDFGETGEFMU-CQSZACIVSA-N -1 3 334.375 4.071 20 0 EIADHM Cc1cc(-c2noc(-c3ccc(C(C)C)cc3[O-])n2)cc2[nH]cnc21 ZINC000436929211 1041562081 /nfs/dbraw/zinc/56/20/81/1041562081.db2.gz DRZMVTSXKROPJF-UHFFFAOYSA-N -1 3 334.379 4.417 20 0 EIADHM COc1ccc(N(C)C(=O)c2ccc3c(c2[O-])CCCC3)cc1Cl ZINC000436974965 1041577938 /nfs/dbraw/zinc/57/79/38/1041577938.db2.gz DYLBGMPEAKHVBK-UHFFFAOYSA-N -1 3 345.826 4.210 20 0 EIADHM Cc1ccc(Oc2ccccc2)c(NC(=O)c2cccc3n[n-]nc32)c1 ZINC000540963041 1041754888 /nfs/dbraw/zinc/75/48/88/1041754888.db2.gz BSBYRXDLQVSFHD-UHFFFAOYSA-N -1 3 344.374 4.311 20 0 EIADHM O=S(=O)([N-][C@@H](c1ccccc1)C1CCC1)c1ccc(Cl)s1 ZINC000517086316 1041863452 /nfs/dbraw/zinc/86/34/52/1041863452.db2.gz BZIBPHNBZMEXRP-HNNXBMFYSA-N -1 3 341.885 4.221 20 0 EIADHM CCC(CC)(CC)NC(=O)Nc1ccc(-c2cc(=O)[n-]c(C)n2)cc1 ZINC000437757762 1041896856 /nfs/dbraw/zinc/89/68/56/1041896856.db2.gz KNLQPLRYCSNNJR-UHFFFAOYSA-N -1 3 342.443 4.248 20 0 EIADHM C[C@@H](c1cccc(NCc2cccc([O-])c2Cl)c1)N1CCOCC1 ZINC000293202988 1042221182 /nfs/dbraw/zinc/22/11/82/1042221182.db2.gz ITYIBUJHRNQEKL-AWEZNQCLSA-N -1 3 346.858 4.051 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@H](CC)Cc3ccccc3)nc2)n1 ZINC000518318027 1042465110 /nfs/dbraw/zinc/46/51/10/1042465110.db2.gz DPUYEUCYVHYXKX-QGZVFWFLSA-N -1 3 348.450 4.240 20 0 EIADHM COc1cccc(C(=O)Nc2cccc(NC3CCCC3)c2)c1[O-] ZINC000303678105 1042496278 /nfs/dbraw/zinc/49/62/78/1042496278.db2.gz IGKSQSPIMRMPSP-UHFFFAOYSA-N -1 3 326.396 4.008 20 0 EIADHM CCc1cccc(NC(=O)Nc2ccc(-c3cc(=O)[n-]c(C)n3)cc2)c1 ZINC000518908409 1042748266 /nfs/dbraw/zinc/74/82/66/1042748266.db2.gz RVXPSKXIKNTUKO-UHFFFAOYSA-N -1 3 348.406 4.364 20 0 EIADHM Cc1cc(C)c(C(=O)Nc2cc(Br)ccc2[O-])c(C)c1 ZINC000536432754 1042860176 /nfs/dbraw/zinc/86/01/76/1042860176.db2.gz VAQHYBXGYIOKPO-UHFFFAOYSA-N -1 3 334.213 4.332 20 0 EIADHM O=C([N-]c1c(F)cccc1F)c1cnc(Cc2ccccc2)s1 ZINC000087024498 1042889285 /nfs/dbraw/zinc/88/92/85/1042889285.db2.gz QDSFUXHVUTYENF-UHFFFAOYSA-N -1 3 330.359 4.264 20 0 EIADHM CCOc1ccccc1[N-]S(=O)(=O)/C=C\c1ccccc1Cl ZINC000727349827 1043204034 /nfs/dbraw/zinc/20/40/34/1043204034.db2.gz KWGNQIVETRPJNP-QXMHVHEDSA-N -1 3 337.828 4.151 20 0 EIADHM COc1cc(C)c(NC(=O)c2cc([O-])c3ccccc3c2)cc1OC ZINC000525913067 1043234635 /nfs/dbraw/zinc/23/46/35/1043234635.db2.gz NGGWVQPQDDSSNZ-UHFFFAOYSA-N -1 3 337.375 4.123 20 0 EIADHM C[C@H](c1ccccc1Cl)N(C)C(=O)NCc1ccc([O-])c(F)c1 ZINC000163720284 1043260278 /nfs/dbraw/zinc/26/02/78/1043260278.db2.gz LZTUCNHJMPVJCU-LLVKDONJSA-N -1 3 336.794 4.087 20 0 EIADHM Cc1nc(S(=O)(=O)[C@@H](C)c2ccccc2F)[n-]c1-c1ccccc1 ZINC000186838603 1043311383 /nfs/dbraw/zinc/31/13/83/1043311383.db2.gz YJGWYOSWQHRSQL-ZDUSSCGKSA-N -1 3 344.411 4.059 20 0 EIADHM Cc1[n-]c(S(=O)(=O)[C@@H](C)c2ccccc2F)nc1-c1ccccc1 ZINC000186838603 1043311393 /nfs/dbraw/zinc/31/13/93/1043311393.db2.gz YJGWYOSWQHRSQL-ZDUSSCGKSA-N -1 3 344.411 4.059 20 0 EIADHM C[C@H]1C[C@H](CCNC(=O)c2c[n-]c3ccccc3c2=O)CC(C)(C)C1 ZINC001128609581 1043414549 /nfs/dbraw/zinc/41/45/49/1043414549.db2.gz ZSAGKENWMUIUFA-GJZGRUSLSA-N -1 3 340.467 4.110 20 0 EIADHM [O-]c1c(F)cc(F)cc1Nc1cc(Cl)cc(Br)n1 ZINC001212482091 1043457137 /nfs/dbraw/zinc/45/71/37/1043457137.db2.gz ZVTHPTNUKRWPEI-UHFFFAOYSA-N -1 3 335.535 4.225 20 0 EIADHM [O-]c1c(F)cc(F)cc1Nc1nc(Cl)c(Cl)nc1Cl ZINC001212484205 1043483028 /nfs/dbraw/zinc/48/30/28/1043483028.db2.gz QEMOMOJTACIDRA-UHFFFAOYSA-N -1 3 326.517 4.164 20 0 EIADHM O=C([N-][C@@H]1CCCc2ccc(F)cc21)C(F)(F)c1ccccc1F ZINC001128726574 1043686354 /nfs/dbraw/zinc/68/63/54/1043686354.db2.gz RLMFDZSIOCDYOG-MRXNPFEDSA-N -1 3 337.316 4.250 20 0 EIADHM Cc1sc(Br)c(C(=O)Nc2cc(F)ccc2[O-])c1C ZINC000442567839 1043749648 /nfs/dbraw/zinc/74/96/48/1043749648.db2.gz NPAXYORVWVDMPR-UHFFFAOYSA-N -1 3 344.205 4.224 20 0 EIADHM O=C(Nc1ccc(-c2ccccc2)cc1)c1nnc2ccccc2c1[O-] ZINC000732258637 1043892444 /nfs/dbraw/zinc/89/24/44/1043892444.db2.gz OOWCGURUXYACIV-UHFFFAOYSA-N -1 3 341.370 4.255 20 0 EIADHM [O-]c1ccc(CNCc2ccc(F)cc2Br)cc1Cl ZINC000733325182 1044190272 /nfs/dbraw/zinc/19/02/72/1044190272.db2.gz CBUHEANNWKXNSK-UHFFFAOYSA-N -1 3 344.611 4.237 20 0 EIADHM [O-]c1ccc(-c2nc(-c3cccc(OCc4ccccc4)c3)no2)nc1 ZINC001212557837 1044305531 /nfs/dbraw/zinc/30/55/31/1044305531.db2.gz CXLNMJDHBUBLAQ-UHFFFAOYSA-N -1 3 345.358 4.083 20 0 EIADHM [O-]c1ccc(-c2nc(-c3ccc(Oc4ccccc4)cc3)no2)nc1 ZINC001212558016 1044307304 /nfs/dbraw/zinc/30/73/04/1044307304.db2.gz NDWYFLMJDXRGEE-UHFFFAOYSA-N -1 3 331.331 4.297 20 0 EIADHM COC(=O)c1cnc(SC[C@@H](C)c2ccc(C(F)(F)F)cc2)[n-]1 ZINC000443467894 1044356573 /nfs/dbraw/zinc/35/65/73/1044356573.db2.gz NMWWGFNMPCQNTN-SECBINFHSA-N -1 3 344.358 4.111 20 0 EIADHM O=C(CCC1CCCCC1)[N-]OCc1ncc(-c2ccc(F)cc2)o1 ZINC000733997820 1044456008 /nfs/dbraw/zinc/45/60/08/1044456008.db2.gz GFJBJPGFDUXVDG-UHFFFAOYSA-N -1 3 346.402 4.389 20 0 EIADHM CCCCn1nccc1NC(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC001626076607 1044561165 /nfs/dbraw/zinc/56/11/65/1044561165.db2.gz BBLAQGUAIFOCMC-UHFFFAOYSA-N -1 3 349.434 4.232 20 0 EIADHM CCCc1cc(Cl)nc([N-][C@H](c2ccccn2)C(F)(F)F)n1 ZINC001168482403 1044814911 /nfs/dbraw/zinc/81/49/11/1044814911.db2.gz VVSYWXZGMZUPOM-GFCCVEGCSA-N -1 3 330.741 4.193 20 0 EIADHM COc1ccc(Cc2noc(-c3cc4ccccc4cc3[O-])n2)cc1 ZINC000327341170 1044846971 /nfs/dbraw/zinc/84/69/71/1044846971.db2.gz SDRCZBMPEHDBDI-UHFFFAOYSA-N -1 3 332.359 4.195 20 0 EIADHM Cc1ccc(Cl)c([N-]S(=O)(=O)c2cc(F)ccc2Cl)c1 ZINC000474311519 1044849006 /nfs/dbraw/zinc/84/90/06/1044849006.db2.gz ZQEMHGWJKRCCSS-UHFFFAOYSA-N -1 3 334.199 4.242 20 0 EIADHM Cc1cccc(NC(=O)[C@@H](C)OC(=O)c2cc3ccsc3[n-]2)c1C ZINC000914890137 1044853018 /nfs/dbraw/zinc/85/30/18/1044853018.db2.gz CHISAHVBGISCKM-GFCCVEGCSA-N -1 3 342.420 4.030 20 0 EIADHM CCO[C@H](C)c1nc(COC(=O)c2cc(Cl)c(Cl)[n-]2)cs1 ZINC000736771085 1044975348 /nfs/dbraw/zinc/97/53/48/1044975348.db2.gz MGQFMEGPARNWFD-SSDOTTSWSA-N -1 3 349.239 4.233 20 0 EIADHM CCc1cccc2c(CC(=O)Nc3cc(Cl)ccc3[O-])c[nH]c21 ZINC000303420301 1045001128 /nfs/dbraw/zinc/00/11/28/1045001128.db2.gz XUZSXGGBOPFPKS-UHFFFAOYSA-N -1 3 328.799 4.271 20 0 EIADHM CC(C)(C)[C@@H]1CCCN(Cn2[n-]c(-c3ccccn3)nc2=S)CC1 ZINC000738237633 1045050156 /nfs/dbraw/zinc/05/01/56/1045050156.db2.gz AOMCJJFVHVWBCX-CQSZACIVSA-N -1 3 345.516 4.108 20 0 EIADHM COc1ccc2cc(/C=C/C(=O)Nc3cccc([O-])c3F)ccc2c1 ZINC000762321219 1045184875 /nfs/dbraw/zinc/18/48/75/1045184875.db2.gz ZIACQRCEYGEKNR-UXBLZVDNSA-N -1 3 337.350 4.345 20 0 EIADHM [O-]c1coc2cc(OCc3cc4ccccc4nc3Cl)ccc12 ZINC000915662812 1045444514 /nfs/dbraw/zinc/44/45/14/1045444514.db2.gz KMUMFXGDTLBKGU-UHFFFAOYSA-N -1 3 325.751 4.042 20 0 EIADHM CCO[N-]C(=O)C12C[C@@H]3C[C@H](C1)CC(c1ccc(C)c(C)c1)(C3)C2 ZINC000790926680 1045622288 /nfs/dbraw/zinc/62/22/88/1045622288.db2.gz NFNIQTMEYARBDX-AGXSTUJCSA-N -1 3 327.468 4.209 20 0 EIADHM O=C(Nc1ccc(Cl)cc1[O-])c1cc(F)cc(Br)c1 ZINC000533618477 1045638604 /nfs/dbraw/zinc/63/86/04/1045638604.db2.gz NBDCSOGUKOUJBU-UHFFFAOYSA-N -1 3 344.567 4.200 20 0 EIADHM CCS[C@H]1CCC[C@H](NC(=O)c2cc3sccc3c([O-])c2)C1 ZINC000791378554 1045726768 /nfs/dbraw/zinc/72/67/68/1045726768.db2.gz KHULNZQPJZKUGS-STQMWFEESA-N -1 3 335.494 4.401 20 0 EIADHM CCS[C@H]1CCCC[C@@H]1NC(=O)c1cc2sccc2c([O-])c1 ZINC000791382387 1045728730 /nfs/dbraw/zinc/72/87/30/1045728730.db2.gz YOMWXYLUJTZICV-ZFWWWQNUSA-N -1 3 335.494 4.401 20 0 EIADHM O=C(c1cc2sccc2c([O-])c1)N(CCC(F)(F)F)CC1CC1 ZINC000791387594 1045733989 /nfs/dbraw/zinc/73/39/89/1045733989.db2.gz VZKMSWZSZVIMLX-UHFFFAOYSA-N -1 3 343.370 4.412 20 0 EIADHM CC(=O)Nc1cccc([C@H](C)OC(=O)c2cc3ccsc3[n-]2)c1 ZINC000747029067 1045792054 /nfs/dbraw/zinc/79/20/54/1045792054.db2.gz GTSFMFQVNOWKKT-JTQLQIEISA-N -1 3 328.393 4.106 20 0 EIADHM CCCN1C(=O)c2ccc(Cl)cc2N[C@H]1c1ccc([O-])c(F)c1 ZINC000533713547 1045808603 /nfs/dbraw/zinc/80/86/03/1045808603.db2.gz GQUKSHGPHBICPB-MRXNPFEDSA-N -1 3 334.778 4.161 20 0 EIADHM COc1ccc(Nc2ccc([O-])c(F)c2F)cc1Br ZINC001212009913 1045832328 /nfs/dbraw/zinc/83/23/28/1045832328.db2.gz YTBJKDXNDYIWPQ-UHFFFAOYSA-N -1 3 330.128 4.185 20 0 EIADHM [O-]c1ccc(Nc2ccc(OC[C@@H]3CCCO3)c(F)c2)c(F)c1F ZINC001212009468 1045832432 /nfs/dbraw/zinc/83/24/32/1045832432.db2.gz PSXCWEBMORJOOU-NSHDSACASA-N -1 3 339.313 4.111 20 0 EIADHM O=c1cc(Oc2ccc(Nc3ccc([O-])c(F)c3F)cc2)cc[nH]1 ZINC001212011147 1045832502 /nfs/dbraw/zinc/83/25/02/1045832502.db2.gz VCVSZAFTBNDSFL-UHFFFAOYSA-N -1 3 330.290 4.307 20 0 EIADHM Nc1ccc(-c2ccc(Nc3ccc([O-])c(F)c3F)c(O)c2)cc1O ZINC001212014013 1045834614 /nfs/dbraw/zinc/83/46/14/1045834614.db2.gz VISBZHVVLXWSAL-UHFFFAOYSA-N -1 3 344.317 4.074 20 0 EIADHM [O-]c1ccc(Nc2cc(F)c(F)c(Br)c2)c(F)c1F ZINC001212013843 1045835410 /nfs/dbraw/zinc/83/54/10/1045835410.db2.gz MAEZQLORRZEOET-UHFFFAOYSA-N -1 3 336.082 4.455 20 0 EIADHM CCCCN(CCOc1ccccc1C(=O)[O-])Cc1ccccc1F ZINC000768785052 1045841858 /nfs/dbraw/zinc/84/18/58/1045841858.db2.gz YAJUUMFIOCDFQP-UHFFFAOYSA-N -1 3 345.414 4.205 20 0 EIADHM C[C@@H](NCc1cc(Cl)cc([N+](=O)[O-])c1[O-])c1ccccc1Cl ZINC000237456684 1046122845 /nfs/dbraw/zinc/12/28/45/1046122845.db2.gz HGRQWZJAFPELDC-SECBINFHSA-N -1 3 341.194 4.458 20 0 EIADHM COc1ccc(N(C(=O)c2cccc(C)c2[O-])[C@H](C)C2CC2)cc1 ZINC000124597462 1046252012 /nfs/dbraw/zinc/25/20/12/1046252012.db2.gz VOIXCLUSLZZTAN-CQSZACIVSA-N -1 3 325.408 4.155 20 0 EIADHM CCCCC[C@@](C)(CC)C(=O)Nc1nc2c(cccc2C(=O)OC)[n-]1 ZINC001127419635 1046369321 /nfs/dbraw/zinc/36/93/21/1046369321.db2.gz QFRPVJCIHVMKDJ-LJQANCHMSA-N -1 3 345.443 4.285 20 0 EIADHM O=[S@](Cc1cc(Br)ccc1Cl)c1ccc([O-])cc1 ZINC000080140476 1046455144 /nfs/dbraw/zinc/45/51/44/1046455144.db2.gz USHIBJIWYDKNOW-SFHVURJKSA-N -1 3 345.645 4.116 20 0 EIADHM [O-]c1cccc(CN[C@@H]2CCCOc3ccccc32)c1Br ZINC000459420134 1046649692 /nfs/dbraw/zinc/64/96/92/1046649692.db2.gz XXBZTFJKFYWSBL-CQSZACIVSA-N -1 3 348.240 4.158 20 0 EIADHM CC(C)Cn1cc(C(=O)Nc2cccc([O-])c2F)c2ccccc21 ZINC000128200242 1046780439 /nfs/dbraw/zinc/78/04/39/1046780439.db2.gz VKQZUSIJMYOJHM-UHFFFAOYSA-N -1 3 326.371 4.394 20 0 EIADHM O=C(OCc1coc(-c2ccc(Cl)cc2)n1)c1cc2occc2[n-]1 ZINC000786030771 1046804187 /nfs/dbraw/zinc/80/41/87/1046804187.db2.gz BRLDSASDIFWINK-UHFFFAOYSA-N -1 3 342.738 4.426 20 0 EIADHM CC(C)[C@@H](SCc1ccccc1)C(=O)Nc1cccc([O-])c1F ZINC000128387841 1046847621 /nfs/dbraw/zinc/84/76/21/1046847621.db2.gz OAALMNUNKBRYTO-QGZVFWFLSA-N -1 3 333.428 4.428 20 0 EIADHM CCN(CC)c1ccc(NC(=O)CCCc2ccc([O-])c(F)c2)cc1 ZINC000786720978 1046866416 /nfs/dbraw/zinc/86/64/16/1046866416.db2.gz YDEGZUBYZYBNTD-UHFFFAOYSA-N -1 3 344.430 4.339 20 0 EIADHM C[C@@H](Cc1ccc(C(F)(F)F)cc1)C(=O)Nc1cccc([O-])c1F ZINC000128671264 1047012546 /nfs/dbraw/zinc/01/25/46/1047012546.db2.gz OIUFGUQBAGVRTG-JTQLQIEISA-N -1 3 341.304 4.367 20 0 EIADHM CCOCCC1(CNC(=O)c2cc3sccc3c([O-])c2)CCCC1 ZINC000788305413 1047153349 /nfs/dbraw/zinc/15/33/49/1047153349.db2.gz AJGZTWFVWZXNIN-UHFFFAOYSA-N -1 3 347.480 4.324 20 0 EIADHM CCS[C@H]1CCCCN(C(=O)c2cc3sccc3c([O-])c2)C1 ZINC000788300643 1047154915 /nfs/dbraw/zinc/15/49/15/1047154915.db2.gz COWUEIRMLQVAGP-ZDUSSCGKSA-N -1 3 335.494 4.355 20 0 EIADHM O=C(NCC1(c2ccc(F)cc2)CC1)c1cc2sccc2c([O-])c1 ZINC000788283980 1047157385 /nfs/dbraw/zinc/15/73/85/1047157385.db2.gz RCVKISZSKYNBBE-UHFFFAOYSA-N -1 3 341.407 4.208 20 0 EIADHM CCOCc1ccccc1CNC(=O)c1cc2sccc2c([O-])c1 ZINC000788280028 1047157834 /nfs/dbraw/zinc/15/78/34/1047157834.db2.gz JJPGONPPLITSPK-UHFFFAOYSA-N -1 3 341.432 4.073 20 0 EIADHM C[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)Nc1cccc([O-])c1F ZINC000129449531 1047394008 /nfs/dbraw/zinc/39/40/08/1047394008.db2.gz ANPVGRLFZSNYRR-LBPRGKRZSA-N -1 3 331.387 4.235 20 0 EIADHM CC(C)COc1ccc(C(C)(C)C(=O)Nc2cccc([O-])c2F)cc1 ZINC000129560887 1047430351 /nfs/dbraw/zinc/43/03/51/1047430351.db2.gz BDRXHQUSDVKLKD-UHFFFAOYSA-N -1 3 345.414 4.482 20 0 EIADHM CCCOc1cc(OC)ccc1C(=O)Nc1cc(Cl)ccc1[O-] ZINC000476316087 1047468675 /nfs/dbraw/zinc/46/86/75/1047468675.db2.gz SXSGSADTQRJGCS-UHFFFAOYSA-N -1 3 335.787 4.095 20 0 EIADHM CC1(C)CN(C(=O)c2cc([O-])cc(Br)c2)c2ccccc21 ZINC001170121902 1047486546 /nfs/dbraw/zinc/48/65/46/1047486546.db2.gz MSVKBINSSYMNGR-UHFFFAOYSA-N -1 3 346.224 4.093 20 0 EIADHM O=C(Nc1cccc([O-])c1F)c1ccc(CCC(F)(F)F)cc1 ZINC000129776834 1047507005 /nfs/dbraw/zinc/50/70/05/1047507005.db2.gz KWHXWQOQKYZHEI-UHFFFAOYSA-N -1 3 327.277 4.279 20 0 EIADHM C[C@@H]1C[C@H](c2ccc(F)cc2)CN1C(=O)c1cc([O-])ccc1Cl ZINC000556266314 1047645393 /nfs/dbraw/zinc/64/53/93/1047645393.db2.gz LFWLLEKFFDDUJN-YPMHNXCESA-N -1 3 333.790 4.203 20 0 EIADHM CCOc1cc(CNc2cccc(-c3cc[nH]n3)c2)cc(Cl)c1[O-] ZINC000556270897 1047646114 /nfs/dbraw/zinc/64/61/14/1047646114.db2.gz HNEIRDLDJHYHDP-UHFFFAOYSA-N -1 3 343.814 4.447 20 0 EIADHM O=C(N[C@@H]1C[C@@H]1c1c(F)cccc1Cl)c1cc([O-])ccc1Cl ZINC000556306122 1047668083 /nfs/dbraw/zinc/66/80/83/1047668083.db2.gz PMVPAKUGQKVRMF-IINYFYTJSA-N -1 3 340.181 4.124 20 0 EIADHM CSc1ccsc1C(=O)Nc1ccc(Br)cc1[O-] ZINC000107218836 1047716460 /nfs/dbraw/zinc/71/64/60/1047716460.db2.gz JCQQSNHXMZRLKZ-UHFFFAOYSA-N -1 3 344.255 4.190 20 0 EIADHM Cc1ccc(O[C@@H](C)CNC(=O)c2ccc(C(C)C)cc2[O-])cc1 ZINC001137011219 1048059563 /nfs/dbraw/zinc/05/95/63/1048059563.db2.gz PIVBWWIKLVNACF-HNNXBMFYSA-N -1 3 327.424 4.021 20 0 EIADHM CC(=O)c1cccc(NC(=O)[C@H](C)Sc2ccc(C)cc2)c1[O-] ZINC000556894352 1048118770 /nfs/dbraw/zinc/11/87/70/1048118770.db2.gz YQRVPXJKLHPXPG-ZDUSSCGKSA-N -1 3 329.421 4.023 20 0 EIADHM COC(=O)c1cccc([C@@H](C)Nc2[n-]c(=O)c(Cl)cc2Cl)c1 ZINC001171104519 1048197002 /nfs/dbraw/zinc/19/70/02/1048197002.db2.gz ZVDDPTFTOCBWPJ-MRVPVSSYSA-N -1 3 341.194 4.054 20 0 EIADHM O=C(NCCn1ccc2cc(Cl)ccc21)c1cc([O-])ccc1Cl ZINC000556926891 1048242737 /nfs/dbraw/zinc/24/27/37/1048242737.db2.gz GNOVBQJVWXITPM-UHFFFAOYSA-N -1 3 349.217 4.084 20 0 EIADHM Cc1c(-c2ccccc2)sc2[n-]c(-c3cccc(F)n3)nc(=O)c12 ZINC000155145140 1048331649 /nfs/dbraw/zinc/33/16/49/1048331649.db2.gz MWAUFANTJLGOTM-UHFFFAOYSA-N -1 3 337.379 4.161 20 0 EIADHM Cc1cc(C)cc(-c2ccc(CNC3(c4nn[n-]n4)CCCC3)cc2)c1 ZINC000499246586 1048500216 /nfs/dbraw/zinc/50/02/16/1048500216.db2.gz CZXBGDFJCNABBA-UHFFFAOYSA-N -1 3 347.466 4.043 20 0 EIADHM Cc1cc(C)cc(-c2ccc(CNC3(c4nnn[n-]4)CCCC3)cc2)c1 ZINC000499246586 1048500233 /nfs/dbraw/zinc/50/02/33/1048500233.db2.gz CZXBGDFJCNABBA-UHFFFAOYSA-N -1 3 347.466 4.043 20 0 EIADHM C[C@@H]1CO[C@@H](c2ccccc2)[C@@H](C)N1C(=O)c1cc([O-])ccc1Cl ZINC000815553563 1048505326 /nfs/dbraw/zinc/50/53/26/1048505326.db2.gz CYZFXESYNWPMNL-SNUQEOBHSA-N -1 3 345.826 4.036 20 0 EIADHM CC(C)c1scnc1C(=O)[N-]c1nnc(C2CCCCC2)s1 ZINC000810030625 1048613621 /nfs/dbraw/zinc/61/36/21/1048613621.db2.gz CQTMGUIBJUTXMZ-UHFFFAOYSA-N -1 3 336.486 4.418 20 0 EIADHM CCc1noc(C)c1[N-]C(=O)c1csc(-c2ccc(C)cc2)n1 ZINC000133291690 1048693807 /nfs/dbraw/zinc/69/38/07/1048693807.db2.gz IPVUIBBIZVKCJG-UHFFFAOYSA-N -1 3 327.409 4.230 20 0 EIADHM Cc1ccc(NC(=O)c2c[n-]c3cc(F)c(F)cc3c2=O)cc1Cl ZINC001135507998 1048757542 /nfs/dbraw/zinc/75/75/42/1048757542.db2.gz PYYUFWXOAVBTEZ-UHFFFAOYSA-N -1 3 348.736 4.020 20 0 EIADHM Cc1c(NC(=O)Cc2ccc([O-])c(F)c2)snc1-c1ccccc1 ZINC001144623334 1048760084 /nfs/dbraw/zinc/76/00/84/1048760084.db2.gz LESTUOAPRJDJTB-UHFFFAOYSA-N -1 3 342.395 4.144 20 0 EIADHM O=C(Cc1ccc([O-])c(F)c1)NCc1cccc(-c2cccs2)c1 ZINC001144633213 1048766447 /nfs/dbraw/zinc/76/64/47/1048766447.db2.gz KDCCTHJMSXHVIU-UHFFFAOYSA-N -1 3 341.407 4.119 20 0 EIADHM CC(C)Cc1ccc([C@@H](C)NC(=O)Cc2ccc([O-])c(F)c2)cc1 ZINC001144633310 1048767265 /nfs/dbraw/zinc/76/72/65/1048767265.db2.gz PGWVBAACNGYSDM-CQSZACIVSA-N -1 3 329.415 4.150 20 0 EIADHM O=C(Cc1ccc([O-])c(F)c1)N[C@H](c1ccccc1)C1CCCC1 ZINC001144632068 1048768259 /nfs/dbraw/zinc/76/82/59/1048768259.db2.gz FPIPLOABFVCVRI-HXUWFJFHSA-N -1 3 327.399 4.122 20 0 EIADHM COc1ccccc1CC1CCN(Cc2cc(F)c([O-])cc2F)CC1 ZINC001144647206 1048770780 /nfs/dbraw/zinc/77/07/80/1048770780.db2.gz COYDDBSQHCZZQE-UHFFFAOYSA-N -1 3 347.405 4.134 20 0 EIADHM COc1ccccc1C1CCN(Cc2cc(F)c([O-])cc2F)CC1 ZINC001144657752 1048778462 /nfs/dbraw/zinc/77/84/62/1048778462.db2.gz GSSZJJRPENTQRU-UHFFFAOYSA-N -1 3 333.378 4.059 20 0 EIADHM Cn1c(COC(=O)c2cc3cc(Cl)sc3[n-]2)nc2ccccc21 ZINC000810544669 1048818115 /nfs/dbraw/zinc/81/81/15/1048818115.db2.gz BFAJYBXXCOFNST-UHFFFAOYSA-N -1 3 345.811 4.127 20 0 EIADHM O=C([N-]Cc1ccccc1Cl)C(F)(F)c1cccc(Cl)c1 ZINC000920999437 1048827504 /nfs/dbraw/zinc/82/75/04/1048827504.db2.gz KVAMJQGOKSJXTJ-UHFFFAOYSA-N -1 3 330.161 4.402 20 0 EIADHM O=C([O-])c1ccc(-c2nc(CN3CCCCCCC3)cs2)cc1 ZINC000846229978 1048844130 /nfs/dbraw/zinc/84/41/30/1048844130.db2.gz AKYHNLXRSYDLKW-UHFFFAOYSA-N -1 3 330.453 4.274 20 0 EIADHM [O-]c1cccc(CN2CC[C@@]3(C2)CCc2ccccc2O3)c1Cl ZINC000816615109 1048845707 /nfs/dbraw/zinc/84/57/07/1048845707.db2.gz NDWASNYGCBZOOL-LJQANCHMSA-N -1 3 329.827 4.015 20 0 EIADHM CCOc1cccc2cc([C@@H](C)NC(=O)c3ccc(C)cc3[O-])oc21 ZINC001135662814 1048852719 /nfs/dbraw/zinc/85/27/19/1048852719.db2.gz YYKJTSPQDLJPCE-CYBMUJFWSA-N -1 3 339.391 4.337 20 0 EIADHM Cc1cccc2cc(C(=O)Nc3cc(F)ccc3[O-])c(Cl)nc12 ZINC000816944145 1048884127 /nfs/dbraw/zinc/88/41/27/1048884127.db2.gz SUNBZRFHWJWOKQ-UHFFFAOYSA-N -1 3 330.746 4.294 20 0 EIADHM CCc1cc2c(CSc3ccccc3OC)cc(=O)oc2cc1[O-] ZINC000921265006 1048897097 /nfs/dbraw/zinc/89/70/97/1048897097.db2.gz IMDJHFXLESCXNQ-UHFFFAOYSA-N -1 3 342.416 4.362 20 0 EIADHM Cc1ccc(C[C@H]2CCCN2C(=O)c2cc([O-])ccc2Cl)cc1 ZINC001146421753 1049023450 /nfs/dbraw/zinc/02/34/50/1049023450.db2.gz ZAJKQPCOMKRALJ-OAHLLOKOSA-N -1 3 329.827 4.201 20 0 EIADHM Cc1ccc(C(=O)Nc2ccc3c(c2)[C@@H](O)CCCC3)c([O-])c1C ZINC001146454117 1049027634 /nfs/dbraw/zinc/02/76/34/1049027634.db2.gz IBEZBNKSTFAPSP-SFHVURJKSA-N -1 3 325.408 4.021 20 0 EIADHM O=C(CCCn1ccc2cc(Cl)ccc21)[N-]OCc1ccccc1 ZINC001136106223 1049093635 /nfs/dbraw/zinc/09/36/35/1049093635.db2.gz BBWIWRZYOMGRLU-UHFFFAOYSA-N -1 3 342.826 4.323 20 0 EIADHM CCC[C@H](CCc1ccccc1)NC(=O)c1ccc(C(C)=O)c([O-])c1 ZINC001147814647 1049216108 /nfs/dbraw/zinc/21/61/08/1049216108.db2.gz IPWJEDRGNXYNBP-GOSISDBHSA-N -1 3 339.435 4.126 20 0 EIADHM CSc1ccc([O-])c(C(=O)N[C@@H](C(F)F)C2CCCCC2)c1 ZINC001148014376 1049249789 /nfs/dbraw/zinc/24/97/89/1049249789.db2.gz FVSKGLOMNUQFCK-CQSZACIVSA-N -1 3 329.412 4.058 20 0 EIADHM CCc1ccc([O-])c(C(=O)N2C[C@H](C)C[C@H]2c2cccc(F)c2)c1 ZINC001148097859 1049264139 /nfs/dbraw/zinc/26/41/39/1049264139.db2.gz XEUVMJPRIGKGJG-ACJLOTCBSA-N -1 3 327.399 4.317 20 0 EIADHM CCc1ccc(C(=O)NCCc2ccc(C(C)(C)C)cc2)c([O-])c1 ZINC001136217197 1049302826 /nfs/dbraw/zinc/30/28/26/1049302826.db2.gz PBBKVUIDOYOMPH-UHFFFAOYSA-N -1 3 325.452 4.225 20 0 EIADHM CC(=O)c1cc(C(=O)Nc2cc(C)cc(C(F)(F)F)c2)ccc1[O-] ZINC001148664440 1049356886 /nfs/dbraw/zinc/35/68/86/1049356886.db2.gz NCHFZBRSQOMJFB-UHFFFAOYSA-N -1 3 337.297 4.174 20 0 EIADHM O=C(Nc1[nH][n-]c2cc(=O)ccc1-2)c1ccc(-c2ccccc2)cc1 ZINC000820218463 1049465037 /nfs/dbraw/zinc/46/50/37/1049465037.db2.gz KNFPHJPXJBZJPO-UHFFFAOYSA-N -1 3 329.359 4.188 20 0 EIADHM Cc1nc(C(F)(F)F)sc1C(=O)[N-]c1cc(F)cc(F)c1F ZINC000348178480 1049474488 /nfs/dbraw/zinc/47/44/88/1049474488.db2.gz DQHNEWODCZVQBI-UHFFFAOYSA-N -1 3 340.248 4.140 20 0 EIADHM C[C@H](CC(=O)[N-]OC1CCCC1)c1ccc(F)c(Br)c1 ZINC000812543955 1049512505 /nfs/dbraw/zinc/51/25/05/1049512505.db2.gz WKWXCLDLPXHLMK-SNVBAGLBSA-N -1 3 344.224 4.072 20 0 EIADHM O=C(Nc1c([O-])cccc1Cl)[C@@H](O)c1cc(Cl)cc(Cl)c1 ZINC000820511121 1049518049 /nfs/dbraw/zinc/51/80/49/1049518049.db2.gz WFEODEAGHTUXBN-ZDUSSCGKSA-N -1 3 346.597 4.025 20 0 EIADHM COc1c(Cl)cccc1NC(=O)c1cc2c(cc1[O-])CCCC2 ZINC001136398402 1049588142 /nfs/dbraw/zinc/58/81/42/1049588142.db2.gz HGVVODUWRUWGGX-UHFFFAOYSA-N -1 3 331.799 4.185 20 0 EIADHM O=C(Cc1cccc(OCc2ccccc2Cl)c1)[N-]OC1CCC1 ZINC000812793246 1049592226 /nfs/dbraw/zinc/59/22/26/1049592226.db2.gz QDRXCXOMUXFHNM-UHFFFAOYSA-N -1 3 345.826 4.062 20 0 EIADHM CSc1ccc([O-])c(C(=O)N(C2CC2)[C@H]2CCc3ccccc32)c1 ZINC001136431070 1049621793 /nfs/dbraw/zinc/62/17/93/1049621793.db2.gz PYELBWHDSYYAPY-SFHVURJKSA-N -1 3 339.460 4.406 20 0 EIADHM CC[C@H](CNC(=O)c1cc([O-])cc(Br)c1)c1ccccc1 ZINC001136514121 1049712072 /nfs/dbraw/zinc/71/20/72/1049712072.db2.gz VQYOXLIWRKJQBF-GFCCVEGCSA-N -1 3 348.240 4.078 20 0 EIADHM CCc1cccc2c1OCC[C@H]2NC(=O)c1ccc(C(C)C)cc1[O-] ZINC001136521737 1049716416 /nfs/dbraw/zinc/71/64/16/1049716416.db2.gz PIFCWXFJOUVZIW-GOSISDBHSA-N -1 3 339.435 4.332 20 0 EIADHM CCCOc1ccc(NC(=O)c2[n-]cnc2C(F)(F)F)cc1Cl ZINC000822830613 1049801143 /nfs/dbraw/zinc/80/11/43/1049801143.db2.gz QEGCRHLAAPCXSA-UHFFFAOYSA-N -1 3 347.724 4.123 20 0 EIADHM CCCOc1ccc(NC(=O)c2nc[n-]c2C(F)(F)F)cc1Cl ZINC000822830613 1049801144 /nfs/dbraw/zinc/80/11/44/1049801144.db2.gz QEGCRHLAAPCXSA-UHFFFAOYSA-N -1 3 347.724 4.123 20 0 EIADHM O=S(=O)([N-]c1cc(F)ccc1F)c1ccc(-c2ccccc2)cc1 ZINC000615919808 1049810411 /nfs/dbraw/zinc/81/04/11/1049810411.db2.gz OAVQYXLJMAXPGZ-UHFFFAOYSA-N -1 3 345.370 4.433 20 0 EIADHM CC(C)c1ccc(C(=O)NCCCc2c[nH]c3ccccc23)c([O-])c1 ZINC001136695470 1049832334 /nfs/dbraw/zinc/83/23/34/1049832334.db2.gz AMYIWWBBIUUYRJ-UHFFFAOYSA-N -1 3 336.435 4.360 20 0 EIADHM O=C(OC[C@H]1CC[C@@H](c2ccccc2)O1)c1cc(Cl)c(Cl)[n-]1 ZINC000814056479 1049866306 /nfs/dbraw/zinc/86/63/06/1049866306.db2.gz POGKPWQNSNMMNW-RISCZKNCSA-N -1 3 340.206 4.399 20 0 EIADHM CC(C)CCOc1cccc(NC(=O)c2[n-]cnc2C(F)(F)F)c1 ZINC000823749715 1049873576 /nfs/dbraw/zinc/87/35/76/1049873576.db2.gz DAQZPIDMEZLUMY-UHFFFAOYSA-N -1 3 341.333 4.106 20 0 EIADHM CC(C)CCOc1cccc(NC(=O)c2nc[n-]c2C(F)(F)F)c1 ZINC000823749715 1049873578 /nfs/dbraw/zinc/87/35/78/1049873578.db2.gz DAQZPIDMEZLUMY-UHFFFAOYSA-N -1 3 341.333 4.106 20 0 EIADHM CCc1ccc([O-])c(C(=O)N(Cc2ccc(F)cc2)CC2CC2)c1 ZINC001136792662 1049885737 /nfs/dbraw/zinc/88/57/37/1049885737.db2.gz HSQIUMXDYPRTNC-UHFFFAOYSA-N -1 3 327.399 4.146 20 0 EIADHM [O-]c1ccc(Cl)cc1/C=N/C[C@@H](O)c1ccccc1C(F)(F)F ZINC000068722815 1049899424 /nfs/dbraw/zinc/89/94/24/1049899424.db2.gz SLIGDLMGAAXVFE-JURJYWISSA-N -1 3 343.732 4.217 20 0 EIADHM CC1(C)CCC(CC(=O)Nc2ncc([O-])cc2Br)CC1 ZINC001185972567 1050205119 /nfs/dbraw/zinc/20/51/19/1050205119.db2.gz BZYNDGGSVSVAHU-UHFFFAOYSA-N -1 3 341.249 4.095 20 0 EIADHM O=C(Nc1nc2c(cccc2[O-])s1)N[C@@H]1CCCc2ccccc21 ZINC001186415392 1050322672 /nfs/dbraw/zinc/32/26/72/1050322672.db2.gz AUYASUJNRYAXKQ-CYBMUJFWSA-N -1 3 339.420 4.201 20 0 EIADHM [O-]c1cncc(-c2nc(-c3ccc(C(F)(F)F)c(Cl)c3)no2)c1 ZINC001212708277 1050329891 /nfs/dbraw/zinc/32/98/91/1050329891.db2.gz CHCNYUXPRSHXML-UHFFFAOYSA-N -1 3 341.676 4.176 20 0 EIADHM [O-]c1cncc(-c2nc(-c3ccccc3Oc3ccccc3)no2)c1 ZINC001212708999 1050330038 /nfs/dbraw/zinc/33/00/38/1050330038.db2.gz ZCQAVSZBJXKMSY-UHFFFAOYSA-N -1 3 331.331 4.297 20 0 EIADHM [O-]c1cncc(-c2nc(-c3ccc(-c4ccc(F)cc4)cc3)no2)c1 ZINC001212709978 1050334215 /nfs/dbraw/zinc/33/42/15/1050334215.db2.gz YIBQZZBYCFCPLW-UHFFFAOYSA-N -1 3 333.322 4.310 20 0 EIADHM CC[C@H]1CCC[C@H]([N-]S(=O)(=O)c2cccc(Cl)c2Cl)C1 ZINC001187137852 1050490743 /nfs/dbraw/zinc/49/07/43/1050490743.db2.gz KIPVWYMCGLQMNT-QWRGUYRKSA-N -1 3 336.284 4.241 20 0 EIADHM O=C(NCC1CCC=CCC1)c1cc(Cc2ccccc2)ccc1[O-] ZINC001178581112 1050499321 /nfs/dbraw/zinc/49/93/21/1050499321.db2.gz PDJBNKWZRFJRQY-UHFFFAOYSA-N -1 3 335.447 4.459 20 0 EIADHM O=C(Nc1cc(F)cc(F)c1)Nc1ccc(C(F)(F)F)cc1[O-] ZINC001187570201 1050574383 /nfs/dbraw/zinc/57/43/83/1050574383.db2.gz LGIXGWCANNBNDA-UHFFFAOYSA-N -1 3 332.228 4.333 20 0 EIADHM O=C([N-]c1cc(F)cc2cccnc21)c1ncsc1C(F)(F)F ZINC001188215335 1050728790 /nfs/dbraw/zinc/72/87/90/1050728790.db2.gz XAKOFORZUQDRGA-UHFFFAOYSA-N -1 3 341.289 4.102 20 0 EIADHM O=C(NC1CCCCC1)c1ccc(Nc2ncc(Cl)cc2[O-])cc1 ZINC001174080586 1050755846 /nfs/dbraw/zinc/75/58/46/1050755846.db2.gz ADIKPNXPQQGZOJ-UHFFFAOYSA-N -1 3 345.830 4.247 20 0 EIADHM COc1ccc(NC(=O)Nc2c([O-])cccc2Cl)cc1Cl ZINC001188472288 1050780374 /nfs/dbraw/zinc/78/03/74/1050780374.db2.gz CVIGVRNISPKJJM-UHFFFAOYSA-N -1 3 327.167 4.352 20 0 EIADHM O=C(Nc1cc([O-])cc(Cl)c1)c1ccc(Oc2cccnc2)cc1 ZINC001188619979 1050816431 /nfs/dbraw/zinc/81/64/31/1050816431.db2.gz NFWFZEICJYKXDC-UHFFFAOYSA-N -1 3 340.766 4.485 20 0 EIADHM Cc1cccc([O-])c1C(=O)Nc1cc(-c2ccc(Cl)s2)on1 ZINC001188640292 1050820527 /nfs/dbraw/zinc/82/05/27/1050820527.db2.gz MGLWRXPLOUSPNL-UHFFFAOYSA-N -1 3 334.784 4.323 20 0 EIADHM O=C(NCc1ccco1)c1cccc(Nc2cccc(Cl)c2[O-])c1 ZINC001174199424 1050834993 /nfs/dbraw/zinc/83/49/93/1050834993.db2.gz NOSROYLLMWLTPF-UHFFFAOYSA-N -1 3 342.782 4.312 20 0 EIADHM Cc1ccc(Nc2ccc(S(=O)(=O)C(C)C)cc2)c(Cl)c1[O-] ZINC001174270737 1050873881 /nfs/dbraw/zinc/87/38/81/1050873881.db2.gz JESHRBQXAHTTDM-UHFFFAOYSA-N -1 3 339.844 4.280 20 0 EIADHM Cc1ccc([O-])c(NC(=O)Nc2ccc(Cl)cc2C(F)(F)F)n1 ZINC001189095630 1050907300 /nfs/dbraw/zinc/90/73/00/1050907300.db2.gz VERCLTLLBDJUCV-UHFFFAOYSA-N -1 3 345.708 4.412 20 0 EIADHM CC(C)n1cnc2cc(Nc3cc(=O)n(-c4ccccc4)[n-]3)ccc21 ZINC001174382601 1050946024 /nfs/dbraw/zinc/94/60/24/1050946024.db2.gz YEHWLPAYDJWPPU-UHFFFAOYSA-N -1 3 333.395 4.252 20 0 EIADHM Cc1ccc(F)c([N-]S(=O)(=O)c2ccc(F)c3ccccc32)c1 ZINC001189385151 1050975319 /nfs/dbraw/zinc/97/53/19/1050975319.db2.gz HJBOJUDERDYWCL-UHFFFAOYSA-N -1 3 333.359 4.227 20 0 EIADHM Cc1ccc2c(cccc2[N-]S(=O)(=O)Cc2cccc(F)c2F)c1 ZINC001189469368 1050990928 /nfs/dbraw/zinc/99/09/28/1050990928.db2.gz KWVADGKIMCOVLM-UHFFFAOYSA-N -1 3 347.386 4.368 20 0 EIADHM COc1cc(Cl)ccc1[N-]S(=O)(=O)/C=C\c1ccc(C)cc1 ZINC000775294938 1051042725 /nfs/dbraw/zinc/04/27/25/1051042725.db2.gz ITVQBWLBAHRLQX-KTKRTIGZSA-N -1 3 337.828 4.070 20 0 EIADHM C[C@@H](Sc1nc2c(cnn2C)c(=O)[n-]1)c1cccc2ccccc21 ZINC001189738459 1051055603 /nfs/dbraw/zinc/05/56/03/1051055603.db2.gz UZFOCGIYSMVPHA-LLVKDONJSA-N -1 3 336.420 4.075 20 0 EIADHM O=c1cc(CN2CCCCc3cc(Cl)ccc32)nc(C2CC2)[n-]1 ZINC001174605180 1051104385 /nfs/dbraw/zinc/10/43/85/1051104385.db2.gz VTYIWXGSGFARID-UHFFFAOYSA-N -1 3 329.831 4.056 20 0 EIADHM O=C(CCc1ccc(C(F)(F)F)cc1)Nc1ccc(F)c([O-])c1 ZINC001180916672 1051107903 /nfs/dbraw/zinc/10/79/03/1051107903.db2.gz SFWUOOXDQALMRY-UHFFFAOYSA-N -1 3 327.277 4.121 20 0 EIADHM Brc1ccc2oc([N-]c3cnc(C4CC4)nc3)nc2c1 ZINC001174610699 1051108316 /nfs/dbraw/zinc/10/83/16/1051108316.db2.gz FZFPXNHRLUPKON-UHFFFAOYSA-N -1 3 331.173 4.001 20 0 EIADHM O=C(N=c1cc(-c2ccccc2)[n-][nH]1)c1cc2cc(Cl)ccc2o1 ZINC000620494667 1051141911 /nfs/dbraw/zinc/14/19/11/1051141911.db2.gz DFXXCNHERMWHGK-UHFFFAOYSA-N -1 3 337.766 4.151 20 0 EIADHM [O-]c1c(F)cc(Br)cc1Nc1ccc2c(c1)CCCO2 ZINC001174722481 1051151791 /nfs/dbraw/zinc/15/17/91/1051151791.db2.gz KWBVSSPDGAFTAW-UHFFFAOYSA-N -1 3 338.176 4.362 20 0 EIADHM CC(=O)c1cccc([O-])c1NC(=O)Cc1cccc(-c2ccccc2)c1 ZINC001181110310 1051152751 /nfs/dbraw/zinc/15/27/51/1051152751.db2.gz ZZOSNMOBZUJOST-UHFFFAOYSA-N -1 3 345.398 4.443 20 0 EIADHM [O-]c1cccc(Nc2cccc(CO)c2Cl)c1Br ZINC001212766454 1051183202 /nfs/dbraw/zinc/18/32/02/1051183202.db2.gz HXZWQIXTRTXVMG-UHFFFAOYSA-N -1 3 328.593 4.044 20 0 EIADHM CCc1cccc(CC)c1[N-]S(=O)(=O)c1ccc(C2CC2)cc1 ZINC001190499427 1051194566 /nfs/dbraw/zinc/19/45/66/1051194566.db2.gz FPTWNICMCTZNKT-UHFFFAOYSA-N -1 3 329.465 4.490 20 0 EIADHM CC(C)(C)[C@H]1CCN1C(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC001181282071 1051196309 /nfs/dbraw/zinc/19/63/09/1051196309.db2.gz NIVSYQHJNHNUGJ-GOSISDBHSA-N -1 3 325.408 4.445 20 0 EIADHM COc1ccc([N-]S(=O)(=O)c2ccc(C3CC3)cc2)cc1C(C)C ZINC001190506730 1051197655 /nfs/dbraw/zinc/19/76/55/1051197655.db2.gz LAYYXVKOZPBGFE-UHFFFAOYSA-N -1 3 345.464 4.497 20 0 EIADHM O=S(=O)([N-]c1cc(F)c(Cl)cc1F)c1ccc(C2CC2)cc1 ZINC001190506136 1051197668 /nfs/dbraw/zinc/19/76/68/1051197668.db2.gz ICQYCZFGHGPEEK-UHFFFAOYSA-N -1 3 343.782 4.296 20 0 EIADHM COc1cc(F)c(Nc2cc(Br)cc(F)c2[O-])cc1F ZINC001174930252 1051229228 /nfs/dbraw/zinc/22/92/28/1051229228.db2.gz JFDVMLKZMIWHNB-UHFFFAOYSA-N -1 3 348.118 4.324 20 0 EIADHM COCc1ccc(Nc2cc(Br)cc(F)c2[O-])cc1 ZINC001174922890 1051252072 /nfs/dbraw/zinc/25/20/72/1051252072.db2.gz QVDRMQTXGIFSGD-UHFFFAOYSA-N -1 3 326.165 4.184 20 0 EIADHM CCc1cccc(C(=O)N2CCC3(C=Cc4ccccc4O3)CC2)c1[O-] ZINC000620719377 1051253943 /nfs/dbraw/zinc/25/39/43/1051253943.db2.gz ATXQDWJVSAPWCL-UHFFFAOYSA-N -1 3 349.430 4.035 20 0 EIADHM O=C(Nc1cc([O-])cc(Cl)c1)c1cc(OC(F)(F)F)ccc1F ZINC001190672357 1051254735 /nfs/dbraw/zinc/25/47/35/1051254735.db2.gz XYAJCJGZIYKZHS-UHFFFAOYSA-N -1 3 349.667 4.336 20 0 EIADHM [O-]C(=NO[C@H]1CCCCO1)Nc1ccc2oc3ccccc3c2c1 ZINC000775423045 1051308040 /nfs/dbraw/zinc/30/80/40/1051308040.db2.gz RWWFHCVZKOCASC-KRWDZBQOSA-N -1 3 326.352 4.166 20 0 EIADHM O=C([N-]O[C@H]1CCCCO1)Nc1ccc2oc3ccccc3c2c1 ZINC000775423045 1051308056 /nfs/dbraw/zinc/30/80/56/1051308056.db2.gz RWWFHCVZKOCASC-KRWDZBQOSA-N -1 3 326.352 4.166 20 0 EIADHM Nc1ccc(-c2ccc(Nc3c(F)cc([O-])cc3F)c(O)c2)cc1O ZINC001175099390 1051344587 /nfs/dbraw/zinc/34/45/87/1051344587.db2.gz DSOYLLOGWVJTEJ-UHFFFAOYSA-N -1 3 344.317 4.074 20 0 EIADHM COc1cccc(Nc2c(F)cc([O-])cc2F)c1Br ZINC001175099644 1051344874 /nfs/dbraw/zinc/34/48/74/1051344874.db2.gz BKFNZBPUGAHGDB-UHFFFAOYSA-N -1 3 330.128 4.185 20 0 EIADHM [O-]c1cc(F)c(Nc2ccc3c(cnn3[C@H]3CCCCO3)c2)c(F)c1 ZINC001175100297 1051348212 /nfs/dbraw/zinc/34/82/12/1051348212.db2.gz PBTFEMLHXCGNRM-QGZVFWFLSA-N -1 3 345.349 4.463 20 0 EIADHM CN1C(=O)CC(C)(C)c2cc(Nc3c(F)cc([O-])cc3F)ccc21 ZINC001175102285 1051350747 /nfs/dbraw/zinc/35/07/47/1051350747.db2.gz GIEAIYIZIGMCNL-UHFFFAOYSA-N -1 3 332.350 4.058 20 0 EIADHM COCCCNc1cccc(F)c1Nc1c(F)cc([O-])cc1F ZINC001175103707 1051352013 /nfs/dbraw/zinc/35/20/13/1051352013.db2.gz WSWGSWVAMQWFAL-UHFFFAOYSA-N -1 3 326.318 4.002 20 0 EIADHM O=C(Nc1cccnc1)c1cccc(Nc2c(F)cc([O-])cc2F)c1 ZINC001175097618 1051379948 /nfs/dbraw/zinc/37/99/48/1051379948.db2.gz QRDMHQKUVMLZRP-UHFFFAOYSA-N -1 3 341.317 4.061 20 0 EIADHM Cc1cccc(Oc2ccccc2NC([O-])=NO[C@@H]2CCCCO2)c1 ZINC000775450567 1051427137 /nfs/dbraw/zinc/42/71/37/1051427137.db2.gz OUFFVOMQBCSJBE-GOSISDBHSA-N -1 3 342.395 4.367 20 0 EIADHM Cc1cccc(Oc2ccccc2NC(=O)[N-]O[C@@H]2CCCCO2)c1 ZINC000775450567 1051427143 /nfs/dbraw/zinc/42/71/43/1051427143.db2.gz OUFFVOMQBCSJBE-GOSISDBHSA-N -1 3 342.395 4.367 20 0 EIADHM [O-]c1ccc(CNc2nc3cc(F)ccc3o2)cc1Br ZINC000155582216 1051434531 /nfs/dbraw/zinc/43/45/31/1051434531.db2.gz JHDJPHDWWTTYHE-UHFFFAOYSA-N -1 3 337.148 4.047 20 0 EIADHM CCOC(=O)c1coc2cc(Nc3c(F)ccc([O-])c3F)ccc12 ZINC001175270448 1051505869 /nfs/dbraw/zinc/50/58/69/1051505869.db2.gz ZHMAECOECBQUDX-UHFFFAOYSA-N -1 3 333.290 4.337 20 0 EIADHM COc1cc(Nc2c(F)ccc([O-])c2F)c(Br)cc1F ZINC001175269148 1051506902 /nfs/dbraw/zinc/50/69/02/1051506902.db2.gz DTJVIDNQHXWMTN-UHFFFAOYSA-N -1 3 348.118 4.324 20 0 EIADHM O=c1cc(CN2CCCSc3ccc(Cl)cc32)nc(C2CC2)[n-]1 ZINC001191811032 1051540292 /nfs/dbraw/zinc/54/02/92/1051540292.db2.gz GGGJBSQKSWHFKX-UHFFFAOYSA-N -1 3 347.871 4.215 20 0 EIADHM Cc1cc(-c2ccccc2)ccc1NC([O-])=NO[C@@H]1CCCCO1 ZINC000775487200 1051557285 /nfs/dbraw/zinc/55/72/85/1051557285.db2.gz KOWTXNNWBIJJAJ-GOSISDBHSA-N -1 3 326.396 4.242 20 0 EIADHM Cc1cc(-c2ccccc2)ccc1NC(=O)[N-]O[C@@H]1CCCCO1 ZINC000775487200 1051557295 /nfs/dbraw/zinc/55/72/95/1051557295.db2.gz KOWTXNNWBIJJAJ-GOSISDBHSA-N -1 3 326.396 4.242 20 0 EIADHM Cc1c([O-])ccc2c(CN(CC3CC3)c3ccccc3)cc(=O)oc12 ZINC001191822087 1051562765 /nfs/dbraw/zinc/56/27/65/1051562765.db2.gz SPHITAHOCZLUNG-UHFFFAOYSA-N -1 3 335.403 4.224 20 0 EIADHM Cc1cccc([O-])c1C(=O)Nc1nc(-c2ccccc2F)cs1 ZINC001182454431 1051583871 /nfs/dbraw/zinc/58/38/71/1051583871.db2.gz MFQLAUIJZUXDBQ-UHFFFAOYSA-N -1 3 328.368 4.216 20 0 EIADHM CCOc1cc(Nc2ccc(-c3nn[n-]n3)cc2)cc(C(F)(F)F)c1 ZINC001175433499 1051590672 /nfs/dbraw/zinc/59/06/72/1051590672.db2.gz ZLVZPLXKGWKHMC-UHFFFAOYSA-N -1 3 349.316 4.028 20 0 EIADHM CC(C)(C)OC(=O)Nc1ccc(Nc2cc(=O)[n-]c(C3CC3)n2)cc1 ZINC001175548322 1051632860 /nfs/dbraw/zinc/63/28/60/1051632860.db2.gz JRFYPTOZWQLOIA-UHFFFAOYSA-N -1 3 342.399 4.150 20 0 EIADHM Cc1ccc2[nH]ncc2c1Nc1ccc(F)c(Br)c1[O-] ZINC001175527468 1051652409 /nfs/dbraw/zinc/65/24/09/1051652409.db2.gz OZGIXZZIGJOGSS-UHFFFAOYSA-N -1 3 336.164 4.222 20 0 EIADHM CC(C)(C)c1ccc(C(=O)Nc2ccc(Cn3ccnc3)cc2)c([O-])c1 ZINC001192322761 1051689770 /nfs/dbraw/zinc/68/97/70/1051689770.db2.gz MTKOSBOFPUKLIR-UHFFFAOYSA-N -1 3 349.434 4.187 20 0 EIADHM CSc1cc(C)nc(SC)c1[N-]C(=O)c1ccc([C@H](C)O)cc1 ZINC001192340175 1051694854 /nfs/dbraw/zinc/69/48/54/1051694854.db2.gz OFEMFPFJXBASOA-NSHDSACASA-N -1 3 348.493 4.139 20 0 EIADHM Nc1cc(C(F)(F)F)c(Nc2cc(Cl)c([O-])cc2Cl)cn1 ZINC001175717804 1051738397 /nfs/dbraw/zinc/73/83/97/1051738397.db2.gz QMTUKCCSEZMEIQ-UHFFFAOYSA-N -1 3 338.116 4.439 20 0 EIADHM Cc1ccc2c(c1Br)CN(Cc1ccc([O-])c(F)c1)C2 ZINC001183045607 1051769083 /nfs/dbraw/zinc/76/90/83/1051769083.db2.gz KDCDATTWBAAUIE-UHFFFAOYSA-N -1 3 336.204 4.118 20 0 EIADHM CC(=O)c1cccc([O-])c1NC(=O)c1cccnc1Oc1ccccc1 ZINC001192705692 1051803438 /nfs/dbraw/zinc/80/34/38/1051803438.db2.gz AVQZKUZWYIBIPP-UHFFFAOYSA-N -1 3 348.358 4.034 20 0 EIADHM [O-]c1ccc(CN2CCc3cc(C(F)(F)F)ccc3C2)cc1F ZINC001183204853 1051811111 /nfs/dbraw/zinc/81/11/11/1051811111.db2.gz CVYFKKMDZMEOSW-UHFFFAOYSA-N -1 3 325.305 4.108 20 0 EIADHM CCc1ccc(OC)c(S(=O)(=O)[N-]c2cccc(C)c2Cl)c1 ZINC001192818678 1051813816 /nfs/dbraw/zinc/81/38/16/1051813816.db2.gz RSQSBVNNPBNWOM-UHFFFAOYSA-N -1 3 339.844 4.020 20 0 EIADHM CN(Cc1cscc1Br)Cc1c(F)ccc([O-])c1F ZINC001183573922 1051867833 /nfs/dbraw/zinc/86/78/33/1051867833.db2.gz XMGPTQIMWDJGAL-UHFFFAOYSA-N -1 3 348.212 4.126 20 0 EIADHM CCCCOc1ccc(C(=O)NCC(C)(C)C2=CCCC2)c([O-])c1 ZINC001183658228 1051884720 /nfs/dbraw/zinc/88/47/20/1051884720.db2.gz FDRMDNOLXNLNHW-UHFFFAOYSA-N -1 3 331.456 4.437 20 0 EIADHM Cc1ccc2ccc(F)c(Nc3ncc(Br)cc3[O-])c2n1 ZINC001176114924 1051916816 /nfs/dbraw/zinc/91/68/16/1051916816.db2.gz ZNWHBJYXPJWHJJ-UHFFFAOYSA-N -1 3 348.175 4.289 20 0 EIADHM C[C@H]1c2ccccc2CCN1C(=O)c1ccc([O-])cc1C(F)(F)F ZINC001193734534 1051977530 /nfs/dbraw/zinc/97/75/30/1051977530.db2.gz VKHMWGPUVCEKIE-NSHDSACASA-N -1 3 335.325 4.171 20 0 EIADHM C[C@@H]1c2ccccc2CCN1C(=O)c1ccc([O-])cc1C(F)(F)F ZINC001193734533 1051977612 /nfs/dbraw/zinc/97/76/12/1051977612.db2.gz VKHMWGPUVCEKIE-LLVKDONJSA-N -1 3 335.325 4.171 20 0 EIADHM O=C(Nc1nc2ccccc2s1)c1ccc([O-])cc1C(F)(F)F ZINC001193734223 1051977954 /nfs/dbraw/zinc/97/79/54/1051977954.db2.gz SIJIZWANAIHBJC-UHFFFAOYSA-N -1 3 338.310 4.273 20 0 EIADHM CCN(CC)C(=O)c1cc(F)cc(Nc2cc([O-])c(F)cc2F)c1 ZINC001176297696 1052003778 /nfs/dbraw/zinc/00/37/78/1052003778.db2.gz HDYGBQFPDPDRSQ-UHFFFAOYSA-N -1 3 338.329 4.035 20 0 EIADHM Cc1ccc([N-]S(=O)(=O)c2ccc(C)c3ccccc32)c(F)c1 ZINC001193825284 1052004066 /nfs/dbraw/zinc/00/40/66/1052004066.db2.gz WHBXXYDZHVNWMQ-UHFFFAOYSA-N -1 3 329.396 4.397 20 0 EIADHM Cc1cc(O)cc([O-])c1C(=O)Nc1ccc(C(F)(F)F)cc1Cl ZINC001193935759 1052023862 /nfs/dbraw/zinc/02/38/62/1052023862.db2.gz CLYYIRGBHXFMED-UHFFFAOYSA-N -1 3 345.704 4.331 20 0 EIADHM Cc1cc(O)cc([O-])c1C(=O)Nc1ccccc1Cc1ccccc1 ZINC001193936581 1052024002 /nfs/dbraw/zinc/02/40/02/1052024002.db2.gz OKKMRFDJYWPDMK-UHFFFAOYSA-N -1 3 333.387 4.249 20 0 EIADHM CC(C)N(Cc1ccco1)C(=O)c1cc([O-])cc(C(F)(F)F)c1 ZINC000621930950 1052032008 /nfs/dbraw/zinc/03/20/08/1052032008.db2.gz HWZCQWXDZNJLME-UHFFFAOYSA-N -1 3 327.302 4.055 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2ccc(C)c(-c3ncco3)c2)cc1C ZINC000164718018 1052037386 /nfs/dbraw/zinc/03/73/86/1052037386.db2.gz DXDLWOBFGUQHAZ-UHFFFAOYSA-N -1 3 342.420 4.068 20 0 EIADHM Cc1cc(O)cc([O-])c1C(=O)N[C@@H](c1ccccc1)C1CCCC1 ZINC001193945992 1052045025 /nfs/dbraw/zinc/04/50/25/1052045025.db2.gz LZPFWTLNDCTKAX-IBGZPJMESA-N -1 3 325.408 4.068 20 0 EIADHM O=C([O-])C[C@@H](NCc1cnc(-c2ccccc2)s1)c1cccs1 ZINC000671162089 1052059948 /nfs/dbraw/zinc/05/99/48/1052059948.db2.gz KNHRRVQOFJZHQL-CQSZACIVSA-N -1 3 344.461 4.177 20 0 EIADHM CCCCOc1ccccc1CN[C@H](CC(=O)[O-])c1cccs1 ZINC000671162555 1052072243 /nfs/dbraw/zinc/07/22/43/1052072243.db2.gz LGANGTRXIRQJLI-OAHLLOKOSA-N -1 3 333.453 4.233 20 0 EIADHM CC(C)Oc1cc(Nc2cccc([O-])c2Br)c(F)cn1 ZINC001176485123 1052090551 /nfs/dbraw/zinc/09/05/51/1052090551.db2.gz LUNXPZDMOHCVCM-UHFFFAOYSA-N -1 3 341.180 4.220 20 0 EIADHM CC(C)CCc1nnc([N-]C(=O)c2cscc2C(F)(F)F)s1 ZINC000622134408 1052126986 /nfs/dbraw/zinc/12/69/86/1052126986.db2.gz COSMLBNJDHVCTM-UHFFFAOYSA-N -1 3 349.403 4.459 20 0 EIADHM Cc1ccnc(NC(=O)CCCc2ccc([O-])c(F)c2)c1C1CC1 ZINC000622147987 1052129026 /nfs/dbraw/zinc/12/90/26/1052129026.db2.gz WVMOXAZNSSUWOJ-UHFFFAOYSA-N -1 3 328.387 4.074 20 0 EIADHM Cc1cc(S(=O)(=O)[N-][C@@H]2CC[C@@H]3CCCC[C@@H]3C2)sc1Cl ZINC001184928601 1052132063 /nfs/dbraw/zinc/13/20/63/1052132063.db2.gz RLANXSVPPLSSQQ-YNEHKIRRSA-N -1 3 347.933 4.347 20 0 EIADHM C[C@@H](NC(=O)Nc1ccc(Br)cc1[O-])c1ccccc1 ZINC001185012318 1052143928 /nfs/dbraw/zinc/14/39/28/1052143928.db2.gz AOKHBALBGITJTD-SNVBAGLBSA-N -1 3 335.201 4.037 20 0 EIADHM CC(C)(CNC(=O)c1cc([O-])cc(C(F)(F)F)c1)CC(F)(F)F ZINC000622188024 1052148838 /nfs/dbraw/zinc/14/88/38/1052148838.db2.gz SZXXOEXMMZOJEJ-UHFFFAOYSA-N -1 3 343.267 4.119 20 0 EIADHM Cc1cc(F)c([N-]S(=O)(=O)Cc2cc(F)cc(F)c2)cc1Cl ZINC001185135780 1052183276 /nfs/dbraw/zinc/18/32/76/1052183276.db2.gz WUNGHCKYZLIPJN-UHFFFAOYSA-N -1 3 349.761 4.008 20 0 EIADHM Cc1ccc(NC(=O)Cc2ccc([O-])c(F)c2)cc1C(F)(F)F ZINC000622288437 1052183728 /nfs/dbraw/zinc/18/37/28/1052183728.db2.gz AAJJMZXWFDNBNE-UHFFFAOYSA-N -1 3 327.277 4.040 20 0 EIADHM Cc1cccc(C)c1S(=O)(=O)[N-]c1cccc(-c2ccncc2)c1 ZINC001194639380 1052183881 /nfs/dbraw/zinc/18/38/81/1052183881.db2.gz QMSXGDLWVJDNOY-UHFFFAOYSA-N -1 3 338.432 4.166 20 0 EIADHM CC(C)[C@H](C[N-]S(=O)(=O)c1ccc(Cl)s1)c1ccccc1 ZINC001185251554 1052203083 /nfs/dbraw/zinc/20/30/83/1052203083.db2.gz KSZWTJNTLVVANH-ZDUSSCGKSA-N -1 3 343.901 4.120 20 0 EIADHM Cc1ccc(F)c(NC(=O)Nc2cc(Br)ccc2[O-])c1 ZINC001185254889 1052203790 /nfs/dbraw/zinc/20/37/90/1052203790.db2.gz DVGPQCLLNJHGQA-UHFFFAOYSA-N -1 3 339.164 4.246 20 0 EIADHM CCc1cccc(C(=O)N(C)CCCOc2cccc(Cl)c2)c1[O-] ZINC000622320256 1052205840 /nfs/dbraw/zinc/20/58/40/1052205840.db2.gz BLZCDSPAFRGNMA-UHFFFAOYSA-N -1 3 347.842 4.149 20 0 EIADHM O=C(CCOc1ccccc1-c1ccccc1)[N-]OC1CCCC1 ZINC000774866550 1052226823 /nfs/dbraw/zinc/22/68/23/1052226823.db2.gz FCLFZJNUGVWPIP-UHFFFAOYSA-N -1 3 325.408 4.113 20 0 EIADHM O=S(=O)([N-]c1cccc(C(F)(F)F)c1Cl)c1ccsc1 ZINC001185391832 1052228298 /nfs/dbraw/zinc/22/82/98/1052228298.db2.gz SRJUPFJQQHPRFY-UHFFFAOYSA-N -1 3 341.763 4.221 20 0 EIADHM CCc1cccc(C(=O)N(C)[C@H](CC)Cc2ccc(C)cc2)c1[O-] ZINC000622396438 1052243157 /nfs/dbraw/zinc/24/31/57/1052243157.db2.gz KQYMTSYLXYLBHN-GOSISDBHSA-N -1 3 325.452 4.356 20 0 EIADHM CCc1ccc([O-])c(C(=O)N(C)[C@H](Cc2ccc(F)cc2)C(C)C)c1 ZINC000622401573 1052246155 /nfs/dbraw/zinc/24/61/55/1052246155.db2.gz XIULMPBAKHWJJS-LJQANCHMSA-N -1 3 343.442 4.433 20 0 EIADHM CN(C(=O)c1cc([O-])cc(C(F)(F)F)c1)C1CCC(C)(C)CC1 ZINC000622424815 1052261891 /nfs/dbraw/zinc/26/18/91/1052261891.db2.gz KDKXTOZECXBXHS-UHFFFAOYSA-N -1 3 329.362 4.452 20 0 EIADHM CC(C)c1ccc(C(=O)N2CCOC3(C2)CCCCCC3)c([O-])c1 ZINC000622443148 1052278473 /nfs/dbraw/zinc/27/84/73/1052278473.db2.gz KZJNOKBTTMENPC-UHFFFAOYSA-N -1 3 331.456 4.081 20 0 EIADHM CCCc1csc(NC(=O)c2cc([O-])cc(C(F)(F)F)c2)n1 ZINC000622476241 1052286799 /nfs/dbraw/zinc/28/67/99/1052286799.db2.gz FDFIOUBFOJJFGV-UHFFFAOYSA-N -1 3 330.331 4.072 20 0 EIADHM O=C(c1cc([O-])cc(C(F)(F)F)c1)N(CC1CC1)CC1CCC1 ZINC000622576038 1052341595 /nfs/dbraw/zinc/34/15/95/1052341595.db2.gz MGCORFFAAZIVCZ-UHFFFAOYSA-N -1 3 327.346 4.063 20 0 EIADHM O=C(NC(C1CCC1)C1CCC1)c1cc([O-])cc(C(F)(F)F)c1 ZINC000622598474 1052351204 /nfs/dbraw/zinc/35/12/04/1052351204.db2.gz XFWNIRXAFRSMJC-UHFFFAOYSA-N -1 3 327.346 4.110 20 0 EIADHM CC(C)N(C(=O)c1cc([O-])cc(C(F)(F)F)c1)C1CC(C)(C)C1 ZINC000622675790 1052385722 /nfs/dbraw/zinc/38/57/22/1052385722.db2.gz ZFJLVHNMOICKCU-UHFFFAOYSA-N -1 3 329.362 4.450 20 0 EIADHM Cc1ccc(-c2nc(CNCc3cc(Cl)ccc3[O-])co2)cc1 ZINC000072927127 1052637637 /nfs/dbraw/zinc/63/76/37/1052637637.db2.gz RSYKRYNHDTYLIS-UHFFFAOYSA-N -1 3 328.799 4.299 20 0 EIADHM CCOc1cccc2cc([C@@H](C)N[C@@H](C)c3nc(C)cc(=O)[n-]3)oc21 ZINC000192779879 1052638359 /nfs/dbraw/zinc/63/83/59/1052638359.db2.gz WIXUJKZEMIEQES-OLZOCXBDSA-N -1 3 341.411 4.047 20 0 EIADHM C[C@H](Oc1cccc2ccccc21)C(=O)Nc1cccc([O-])c1F ZINC000192833208 1052641535 /nfs/dbraw/zinc/64/15/35/1052641535.db2.gz HQCXGACLVIBENT-LBPRGKRZSA-N -1 3 325.339 4.091 20 0 EIADHM COc1ccc(C(=O)CCCC(=O)Nc2ccc(Cl)cc2[O-])cc1 ZINC000179641694 1052745544 /nfs/dbraw/zinc/74/55/44/1052745544.db2.gz JYRVFDQJIRQVNV-UHFFFAOYSA-N -1 3 347.798 4.046 20 0 EIADHM CCc1cc(=O)[n-]c(CN[C@H](C)c2cc(F)c(Cl)cc2Cl)n1 ZINC000181643299 1052890453 /nfs/dbraw/zinc/89/04/53/1052890453.db2.gz KEUZDVONMLEIRD-MRVPVSSYSA-N -1 3 344.217 4.041 20 0 EIADHM CCc1cc(=O)[n-]c(CN[C@@H](C)c2cc(F)c(Cl)cc2Cl)n1 ZINC000181643283 1052890534 /nfs/dbraw/zinc/89/05/34/1052890534.db2.gz KEUZDVONMLEIRD-QMMMGPOBSA-N -1 3 344.217 4.041 20 0 EIADHM O=C(Nc1cc(F)ccc1[O-])c1ccc(C(F)(F)F)cc1Cl ZINC000181912452 1052903290 /nfs/dbraw/zinc/90/32/90/1052903290.db2.gz CSIFFEZIUBITOK-UHFFFAOYSA-N -1 3 333.668 4.456 20 0 EIADHM CCc1cc(=O)[n-]c(CN[C@H](c2ccc(Cl)cc2)C2CCC2)n1 ZINC000182571993 1052940645 /nfs/dbraw/zinc/94/06/45/1052940645.db2.gz ZJTFTEBAMVTZLS-SFHVURJKSA-N -1 3 331.847 4.029 20 0 EIADHM O=c1ccnc(C=Cc2ccc(-c3ccc(Br)cc3)o2)[n-]1 ZINC000764433168 1053099810 /nfs/dbraw/zinc/09/98/10/1053099810.db2.gz DHSNTPUOGRUDOM-SOFGYWHQSA-N -1 3 343.180 4.375 20 0 EIADHM Cc1cc(Oc2ccccc2)ccc1NC([O-])=NO[C@@H]1CCCCO1 ZINC000775615113 1053113331 /nfs/dbraw/zinc/11/33/31/1053113331.db2.gz TYQSPFRMGBTFQG-GOSISDBHSA-N -1 3 342.395 4.367 20 0 EIADHM Cc1cc(Oc2ccccc2)ccc1NC(=O)[N-]O[C@@H]1CCCCO1 ZINC000775615113 1053113352 /nfs/dbraw/zinc/11/33/52/1053113352.db2.gz TYQSPFRMGBTFQG-GOSISDBHSA-N -1 3 342.395 4.367 20 0 EIADHM O=C([O-])c1ccc(CN2CCC(Cc3ccc(Cl)cc3)CC2)o1 ZINC000864361670 1053250102 /nfs/dbraw/zinc/25/01/02/1053250102.db2.gz MRWVFLXCUYELGW-UHFFFAOYSA-N -1 3 333.815 4.086 20 0 EIADHM CC(C)c1nc(-c2nc(=O)c3c4c(sc3[n-]2)CCCC4)cs1 ZINC000079913680 1053392641 /nfs/dbraw/zinc/39/26/41/1053392641.db2.gz JMIJSPBPJVAOLW-UHFFFAOYSA-N -1 3 331.466 4.110 20 0 EIADHM O=C([N-]c1cc(Cl)cc2ncoc21)c1nccc(Cl)c1Cl ZINC001195459395 1053405691 /nfs/dbraw/zinc/40/56/91/1053405691.db2.gz ONXKBXSCVPRDCR-UHFFFAOYSA-N -1 3 342.569 4.435 20 0 EIADHM Cc1ccc(-c2ccccc2)cc1[N-]S(=O)(=O)c1ccc(O)cc1 ZINC001195794826 1053488008 /nfs/dbraw/zinc/48/80/08/1053488008.db2.gz IVKKIPWNNJMNPG-UHFFFAOYSA-N -1 3 339.416 4.168 20 0 EIADHM Cc1ccc(-c2ccccc2)cc1NS(=O)(=O)c1ccc([O-])cc1 ZINC001195794826 1053488016 /nfs/dbraw/zinc/48/80/16/1053488016.db2.gz IVKKIPWNNJMNPG-UHFFFAOYSA-N -1 3 339.416 4.168 20 0 EIADHM CCC[C@@H](CCCCNCc1cscc1Br)C(=O)[O-] ZINC000417643077 1053551800 /nfs/dbraw/zinc/55/18/00/1053551800.db2.gz YRHIWXCOFXQJPN-NSHDSACASA-N -1 3 348.306 4.271 20 0 EIADHM O=C(NCC1(c2ccc(F)cc2)CC1)c1cc([O-])c2ccccc2c1 ZINC000471741270 1053700297 /nfs/dbraw/zinc/70/02/97/1053700297.db2.gz LTQXLBVGJNTYJM-UHFFFAOYSA-N -1 3 335.378 4.146 20 0 EIADHM Cc1nc(Cl)cc(Cl)c1C(=O)Nc1cc([O-])cc(Cl)c1 ZINC001196692353 1053739835 /nfs/dbraw/zinc/73/98/35/1053739835.db2.gz FQYODOLHXKFOPG-UHFFFAOYSA-N -1 3 331.586 4.308 20 0 EIADHM CSc1cc(C(=O)Nc2nc(C)ccc2[O-])cc(C(F)(F)F)c1 ZINC001196975619 1053808678 /nfs/dbraw/zinc/80/86/78/1053808678.db2.gz OWPDABXVLABGII-UHFFFAOYSA-N -1 3 342.342 4.089 20 0 EIADHM [O-]c1ccc(Br)cc1NC(=S)Nc1ccc(F)cc1 ZINC001196939480 1053810286 /nfs/dbraw/zinc/81/02/86/1053810286.db2.gz BBALHJDKVKVFJQ-UHFFFAOYSA-N -1 3 341.205 4.103 20 0 EIADHM O=C(Nc1cc2ccccc2cc1[O-])c1ncc(-c2ccccc2)cn1 ZINC001197250414 1053860396 /nfs/dbraw/zinc/86/03/96/1053860396.db2.gz BIQYFYFVDGLTOR-UHFFFAOYSA-N -1 3 341.370 4.255 20 0 EIADHM CCCCN(CC(F)(F)F)C(=O)c1cc([O-])c2ccccc2c1 ZINC000471859138 1053913667 /nfs/dbraw/zinc/91/36/67/1053913667.db2.gz UWYRNUSLOZRXGN-UHFFFAOYSA-N -1 3 325.330 4.350 20 0 EIADHM CCc1ccccc1[N-]S(=O)(=O)c1ccc(OCC(C)C)cc1 ZINC000029046993 1053988568 /nfs/dbraw/zinc/98/85/68/1053988568.db2.gz QYUKLCLYTLKRSI-UHFFFAOYSA-N -1 3 333.453 4.085 20 0 EIADHM Cc1ccccc1NC(=S)Nc1ccc([O-])c(Br)c1 ZINC001198427988 1054140243 /nfs/dbraw/zinc/14/02/43/1054140243.db2.gz WMNCWJKZVPTITO-UHFFFAOYSA-N -1 3 337.242 4.272 20 0 EIADHM Cc1cccc(NC(=S)Nc2cc(Br)ccc2[O-])c1 ZINC001198682161 1054232259 /nfs/dbraw/zinc/23/22/59/1054232259.db2.gz GRVMQRLONUAJRP-UHFFFAOYSA-N -1 3 337.242 4.272 20 0 EIADHM CN(OCc1ccccc1)C(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000857475903 1054264856 /nfs/dbraw/zinc/26/48/56/1054264856.db2.gz RKAKAYATSCFULS-UHFFFAOYSA-N -1 3 347.414 4.187 20 0 EIADHM CCN(CC)c1ccc([N-]S(=O)(=O)c2ccc3occc3c2)cc1 ZINC001198817119 1054271823 /nfs/dbraw/zinc/27/18/23/1054271823.db2.gz WZGPSRYWWBJSSP-UHFFFAOYSA-N -1 3 344.436 4.080 20 0 EIADHM O=S(=O)([N-]c1ccc(F)c(Cl)c1F)c1ccc2occc2c1 ZINC001198860670 1054287850 /nfs/dbraw/zinc/28/78/50/1054287850.db2.gz ABRRKYOBNMLHAP-UHFFFAOYSA-N -1 3 343.738 4.165 20 0 EIADHM C[C@H]1CCN(C(=O)c2cc([O-])c3ccccc3c2)c2c(O)cccc21 ZINC000472499503 1054334857 /nfs/dbraw/zinc/33/48/57/1054334857.db2.gz MEVVIODPLKWOTD-ZDUSSCGKSA-N -1 3 333.387 4.405 20 0 EIADHM C[C@@H](NCc1ccc(OC2CCCC2)nc1)c1cccc([O-])c1F ZINC000872025572 1054340606 /nfs/dbraw/zinc/34/06/06/1054340606.db2.gz PAKUENGQWWNEKL-CYBMUJFWSA-N -1 3 330.403 4.099 20 0 EIADHM C[C@@H](N[C@@H](C)c1cccc([O-])c1F)c1cccc(N2CCCC2=O)c1 ZINC000872027780 1054343363 /nfs/dbraw/zinc/34/33/63/1054343363.db2.gz LSYRQBSWFPQEQE-KGLIPLIRSA-N -1 3 342.414 4.070 20 0 EIADHM C[C@@H](N[C@@H](C)c1cccc(N2CCCC2=O)c1)c1cccc([O-])c1F ZINC000872027782 1054344961 /nfs/dbraw/zinc/34/49/61/1054344961.db2.gz LSYRQBSWFPQEQE-UONOGXRCSA-N -1 3 342.414 4.070 20 0 EIADHM C[C@H](N[C@@H](C)c1cccc([O-])c1F)c1cccc(N2CCCC2=O)c1 ZINC000872027778 1054345145 /nfs/dbraw/zinc/34/51/45/1054345145.db2.gz LSYRQBSWFPQEQE-KBPBESRZSA-N -1 3 342.414 4.070 20 0 EIADHM C[C@@H](N[C@@H](C)c1ccc(Br)cn1)c1cccc([O-])c1F ZINC000872067697 1054374123 /nfs/dbraw/zinc/37/41/23/1054374123.db2.gz BKCQEWDVLMPXPG-ZJUUUORDSA-N -1 3 339.208 4.101 20 0 EIADHM O=C(Nc1ccc(F)c([O-])c1)c1cnc(Cl)c(Cl)c1Cl ZINC001199335628 1054395079 /nfs/dbraw/zinc/39/50/79/1054395079.db2.gz YXCBGWCMSQRXBY-UHFFFAOYSA-N -1 3 335.549 4.139 20 0 EIADHM CCCn1c2ccccc2nc1CNCc1ccc([O-])c(Cl)c1 ZINC000873179842 1054500618 /nfs/dbraw/zinc/50/06/18/1054500618.db2.gz XEZYYHBOQVWBGQ-UHFFFAOYSA-N -1 3 329.831 4.095 20 0 EIADHM CCCCCCNC(=S)Nc1ccc([O-])c(Br)c1 ZINC001200954176 1054605268 /nfs/dbraw/zinc/60/52/68/1054605268.db2.gz JVTWGFMYNBRVKM-UHFFFAOYSA-N -1 3 331.279 4.021 20 0 EIADHM O=C(Nc1ccc([N-]c2nnc(-c3ccco3)o2)cc1)c1ccccc1 ZINC001201307388 1054749837 /nfs/dbraw/zinc/74/98/37/1054749837.db2.gz NUIRRMWEWHAXHY-UHFFFAOYSA-N -1 3 346.346 4.326 20 0 EIADHM COc1cc(OC(F)(F)F)ccc1Nc1ccc([O-])c(F)c1F ZINC001201357174 1054772852 /nfs/dbraw/zinc/77/28/52/1054772852.db2.gz PANWGRYVRBPIPI-UHFFFAOYSA-N -1 3 335.228 4.321 20 0 EIADHM CCCOc1cccc(NCc2cc(=O)oc3c(C)c([O-])ccc23)c1 ZINC000030494860 1054892838 /nfs/dbraw/zinc/89/28/38/1054892838.db2.gz WVFZGUJBKQXYPM-UHFFFAOYSA-N -1 3 339.391 4.208 20 0 EIADHM O=C([N-]c1cc(-c2cccc(F)c2)no1)Nc1ccc(F)cc1F ZINC001202015146 1054980377 /nfs/dbraw/zinc/98/03/77/1054980377.db2.gz UMUCDQHIGGIVHV-UHFFFAOYSA-N -1 3 333.269 4.403 20 0 EIADHM O=C(Nc1ccc(Cl)c(Cl)c1)Nc1ncc([O-])cc1Cl ZINC001202255735 1055099778 /nfs/dbraw/zinc/09/97/78/1055099778.db2.gz BIKGVAIYRBKDOP-UHFFFAOYSA-N -1 3 332.574 4.391 20 0 EIADHM Cc1cccc([C@@H]2CCCN2Cc2nnc(-c3ccccc3[O-])o2)c1 ZINC000877986552 1055169251 /nfs/dbraw/zinc/16/92/51/1055169251.db2.gz QCVQFNRUDPJKMY-KRWDZBQOSA-N -1 3 335.407 4.088 20 0 EIADHM Cc1sc2[n-]c([C@H](C)OC(=O)CC3CCCCC3)nc(=O)c2c1C ZINC000022617877 1055237296 /nfs/dbraw/zinc/23/72/96/1055237296.db2.gz IYBKVHVZCUEOLM-NSHDSACASA-N -1 3 348.468 4.176 20 0 EIADHM O=C([N-]c1nnc(CC2CCCCC2)s1)c1ncsc1C1CC1 ZINC000878731437 1055386145 /nfs/dbraw/zinc/38/61/45/1055386145.db2.gz MUGBSPUZQZGGSR-UHFFFAOYSA-N -1 3 348.497 4.247 20 0 EIADHM COC[C@H](/N=C/c1cc(Cl)ccc1[O-])c1ccc(F)c(F)c1 ZINC000090987728 1055537750 /nfs/dbraw/zinc/53/77/50/1055537750.db2.gz XHNBVJUWERIYKF-IGSPZPEDSA-N -1 3 325.742 4.130 20 0 EIADHM O=C(N[C@H]1CCC[C@H]1Cc1ccccc1)c1cc(=O)c2ccccc2[n-]1 ZINC000265709302 1055643975 /nfs/dbraw/zinc/64/39/75/1055643975.db2.gz UQFMMJQDEINGJE-WMZOPIPTSA-N -1 3 346.430 4.082 20 0 EIADHM Cc1ccc(-c2csc3[nH]c(-c4ccc([O-])cc4)nc(=O)c23)s1 ZINC000055490937 1055796757 /nfs/dbraw/zinc/79/67/57/1055796757.db2.gz LVTBIMNXQUNSPU-UHFFFAOYSA-N -1 3 340.429 4.394 20 0 EIADHM CC(C)c1ccc([C@@H](C)CC(=O)Nc2nnc(C(F)(F)F)[n-]2)cc1 ZINC000303752491 1056275165 /nfs/dbraw/zinc/27/51/65/1056275165.db2.gz MDEJSFCBXWQXLH-JTQLQIEISA-N -1 3 340.349 4.079 20 0 EIADHM CC(C)c1ccc([C@@H](C)CC(=O)Nc2nc(C(F)(F)F)n[n-]2)cc1 ZINC000303752491 1056275188 /nfs/dbraw/zinc/27/51/88/1056275188.db2.gz MDEJSFCBXWQXLH-JTQLQIEISA-N -1 3 340.349 4.079 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2ccc(Cl)cc2Cl)c(F)c1 ZINC000404967956 1056334771 /nfs/dbraw/zinc/33/47/71/1056334771.db2.gz JSAWYAVPJDOWNI-UHFFFAOYSA-N -1 3 334.199 4.242 20 0 EIADHM CC(C)Oc1ncc(C(=O)Nc2cc(Cl)ccc2[O-])cc1Cl ZINC000111210657 1056772018 /nfs/dbraw/zinc/77/20/18/1056772018.db2.gz DFNHGKISWWUFQF-UHFFFAOYSA-N -1 3 341.194 4.134 20 0 EIADHM CC[C@H](C)c1ccc(S(=O)(=O)[N-]c2ccc(F)c(F)c2F)cc1 ZINC000007405031 1056792285 /nfs/dbraw/zinc/79/22/85/1056792285.db2.gz XYLKDTLPFIWSIK-JTQLQIEISA-N -1 3 343.370 4.418 20 0 EIADHM Cc1ccnc(-c2nc(=O)c3c(-c4ccc(F)cc4)csc3[n-]2)c1 ZINC000111664992 1056812198 /nfs/dbraw/zinc/81/21/98/1056812198.db2.gz VBAKTBSFSSWCKC-UHFFFAOYSA-N -1 3 337.379 4.161 20 0 EIADHM C[C@@H](OC(=O)c1cc(-c2ccco2)[n-]n1)c1ncc(-c2ccccc2)o1 ZINC000741326706 1058201770 /nfs/dbraw/zinc/20/17/70/1058201770.db2.gz STBDOMXTEJMTET-GFCCVEGCSA-N -1 3 349.346 4.243 20 0 EIADHM C[C@@H](OC(=O)c1cc(-c2ccco2)n[n-]1)c1ncc(-c2ccccc2)o1 ZINC000741326706 1058201790 /nfs/dbraw/zinc/20/17/90/1058201790.db2.gz STBDOMXTEJMTET-GFCCVEGCSA-N -1 3 349.346 4.243 20 0 EIADHM CC(C)(C)C(=O)c1ccsc1[N-]C(=O)c1scnc1Cl ZINC000741938318 1058471198 /nfs/dbraw/zinc/47/11/98/1058471198.db2.gz VYKYAHVESIHQPY-UHFFFAOYSA-N -1 3 328.846 4.339 20 0 EIADHM Cc1cc(C)c(NC(=S)NCc2ccc([O-])c(F)c2)c(Cl)c1 ZINC000737461262 1058554967 /nfs/dbraw/zinc/55/49/67/1058554967.db2.gz LMPLKKKXUVLANF-UHFFFAOYSA-N -1 3 338.835 4.288 20 0 EIADHM Cc1cccc([C@@H](C)C(=O)Oc2cccc(-c3nc(C)cc(=O)[n-]3)c2)c1 ZINC000744217955 1059335945 /nfs/dbraw/zinc/33/59/45/1059335945.db2.gz GHGOLFBWWCNVDI-OAHLLOKOSA-N -1 3 348.402 4.175 20 0 EIADHM Cc1sc2[n-]c([C@H](C)OC(=O)[C@H]3CCC[C@H](C)C3)nc(=O)c2c1C ZINC000745157868 1059761286 /nfs/dbraw/zinc/76/12/86/1059761286.db2.gz LAGDXQHAZKKHFH-GAFUQQFSSA-N -1 3 348.468 4.444 20 0 EIADHM Cc1cc(Nc2ccc(Cl)c([O-])c2)n(Cc2ccc(F)cc2)n1 ZINC001212590330 1060820718 /nfs/dbraw/zinc/82/07/18/1060820718.db2.gz HLSKCECJOIRERV-UHFFFAOYSA-N -1 3 331.778 4.482 20 0 EIADHM C[C@H]1CCc2sc(Nc3ccc(Cl)c([O-])c3)c(C(N)=O)c2C1 ZINC001212590438 1060825769 /nfs/dbraw/zinc/82/57/69/1060825769.db2.gz MLNPXMHILRKOMX-QMMMGPOBSA-N -1 3 336.844 4.074 20 0 EIADHM CC(C)(C)OC(=O)NCc1cc(Nc2ccc(Cl)c([O-])c2)ccn1 ZINC001212590587 1060831717 /nfs/dbraw/zinc/83/17/17/1060831717.db2.gz SYICUBVPQKYUAV-UHFFFAOYSA-N -1 3 349.818 4.209 20 0 EIADHM Cc1cc(N)c(Nc2ccc(Cl)c([O-])c2)c(Br)c1 ZINC001212593257 1060885849 /nfs/dbraw/zinc/88/58/49/1060885849.db2.gz HWCJCIOEPTXTSI-UHFFFAOYSA-N -1 3 327.609 4.442 20 0 EIADHM COC(=O)c1cc(Nc2ccc(Cl)c([O-])c2)c(OC)cc1Cl ZINC001212594000 1060912758 /nfs/dbraw/zinc/91/27/58/1060912758.db2.gz PHKZZPTWGUZIJE-UHFFFAOYSA-N -1 3 342.178 4.238 20 0 EIADHM Cc1nc2scc(-c3ccccc3)c2c(NCc2ncccc2[O-])n1 ZINC001169734368 1060936251 /nfs/dbraw/zinc/93/62/51/1060936251.db2.gz VNYMPLKGXLYPFD-UHFFFAOYSA-N -1 3 348.431 4.379 20 0 EIADHM Cc1cccc2nc(-c3ccccc3)nc(NCc3ncccc3[O-])c12 ZINC001169734009 1060937793 /nfs/dbraw/zinc/93/77/93/1060937793.db2.gz SWPQILPBROUPPS-UHFFFAOYSA-N -1 3 342.402 4.318 20 0 EIADHM CC(C)[C@@H]1CN(Cc2nnc(-c3ccccc3[O-])o2)c2ccccc21 ZINC001169907805 1061030873 /nfs/dbraw/zinc/03/08/73/1061030873.db2.gz KTGWYRFJLRBIIO-INIZCTEOSA-N -1 3 335.407 4.202 20 0 EIADHM Cc1cc2sc(NC(=O)c3c[n-]c4ccccc4c3=O)nc2c(C)c1 ZINC000040176889 213279973 /nfs/dbraw/zinc/27/99/73/213279973.db2.gz YAQLWKUCJLZBSZ-UHFFFAOYSA-N -1 3 349.415 4.007 20 0 EIADHM Cc1cc2sc(NC(=O)c3cnc4ccccc4c3[O-])nc2c(C)c1 ZINC000040176889 213279975 /nfs/dbraw/zinc/27/99/75/213279975.db2.gz YAQLWKUCJLZBSZ-UHFFFAOYSA-N -1 3 349.415 4.007 20 0 EIADHM O=C(Nc1ccccc1[O-])c1cc2ccccc2cc1NC(=O)C1CC1 ZINC000022279389 212287539 /nfs/dbraw/zinc/28/75/39/212287539.db2.gz IPWIVFBDIKEDGK-UHFFFAOYSA-N -1 3 346.386 4.146 20 0 EIADHM C[C@@H]([N-]S(=O)(=O)c1cc(F)ccc1F)c1ccc2ccccc2c1 ZINC000021175692 212213925 /nfs/dbraw/zinc/21/39/25/212213925.db2.gz DEZXUFRARZORCL-GFCCVEGCSA-N -1 3 347.386 4.158 20 0 EIADHM Cc1sc2[n-]c(-c3ccccn3)nc(=O)c2c1-c1ccc(C)cc1 ZINC000020369442 212123257 /nfs/dbraw/zinc/12/32/57/212123257.db2.gz HZIPTCGNWCHJOW-UHFFFAOYSA-N -1 3 333.416 4.330 20 0 EIADHM COc1cc(CNc2ccc3c(c2)CCC3)cc(Br)c1[O-] ZINC000019913717 212083586 /nfs/dbraw/zinc/08/35/86/212083586.db2.gz DRNSDGFKVIGBGT-UHFFFAOYSA-N -1 3 348.240 4.264 20 0 EIADHM O=c1[n-]c(CSc2ncc3ccccn32)nc2c3ccccc3oc21 ZINC000078989153 217167798 /nfs/dbraw/zinc/16/77/98/217167798.db2.gz ZQRLEZARZRWKPZ-UHFFFAOYSA-N -1 3 348.387 4.022 20 0 EIADHM CC[C@H](C)c1ccc(S(=O)(=O)[N-]c2cc(F)ccc2F)cc1 ZINC000007405110 210794803 /nfs/dbraw/zinc/79/48/03/210794803.db2.gz NXRQMDBMIASCJG-NSHDSACASA-N -1 3 325.380 4.279 20 0 EIADHM CN(c1ccc(Cl)c([O-])c1)c1cc(Br)ccc1N ZINC001212593498 1060887127 /nfs/dbraw/zinc/88/71/27/1060887127.db2.gz USAOCNOOPGWHDK-UHFFFAOYSA-N -1 3 327.609 4.158 20 0 EIADHM C[C@@H](NCc1cc(=O)[n-]c(C2CC2)n1)c1cccc(Cl)c1Cl ZINC000459381069 1032234417 /nfs/dbraw/zinc/23/44/17/1032234417.db2.gz CEHAIFZKIVAMTK-SECBINFHSA-N -1 3 338.238 4.217 20 0 EIADHM O=C(Nc1ccc([O-])c(C(F)(F)F)c1)c1cnc2ccsc2c1 ZINC000532382266 1032496541 /nfs/dbraw/zinc/49/65/41/1032496541.db2.gz ZCUQEWSOEHICHU-UHFFFAOYSA-N -1 3 338.310 4.273 20 0 EIADHM Cc1nc(C)c(CC(=O)Nc2cccc(C3CCCCC3)c2)c(=O)[n-]1 ZINC000529649110 1032508380 /nfs/dbraw/zinc/50/83/80/1032508380.db2.gz LZWNKRKMIOQEQY-UHFFFAOYSA-N -1 3 339.439 4.028 20 0 EIADHM CC(C)c1nc(C(=O)[N-]c2nnc(/C=C/c3ccco3)s2)cs1 ZINC000152519974 1032561366 /nfs/dbraw/zinc/56/13/66/1032561366.db2.gz CHYNIEVLDFEWCB-AATRIKPKSA-N -1 3 346.437 4.134 20 0 EIADHM CN(C)Cc1ccccc1Nc1ccc(C(=O)[O-])c(C(F)(F)F)c1 ZINC001211487932 1018795511 /nfs/dbraw/zinc/79/55/11/1018795511.db2.gz XDTAHRNOZKTDIM-UHFFFAOYSA-N -1 3 338.329 4.209 20 0 EIADHM O=[S@](Cc1ccc(Br)cc1Cl)c1ccc([O-])cc1 ZINC000108085886 1019335487 /nfs/dbraw/zinc/33/54/87/1019335487.db2.gz DJXJSXYVWJKCFE-SFHVURJKSA-N -1 3 345.645 4.116 20 0 EIADHM CC(C)CCOc1ccccc1NC(=O)Cc1ccc([O-])c(F)c1 ZINC000655228462 1019618005 /nfs/dbraw/zinc/61/80/05/1019618005.db2.gz DZKYDLHTFAJDGX-UHFFFAOYSA-N -1 3 331.387 4.137 20 0 EIADHM CCCOc1ccc(C(=O)Nc2cccc([O-])c2F)c(OCCC)c1 ZINC000683251182 1019764971 /nfs/dbraw/zinc/76/49/71/1019764971.db2.gz VAGIVNIGBGEERW-UHFFFAOYSA-N -1 3 347.386 4.361 20 0 EIADHM O=C([N-]c1nnc(CC2CCCCC2)s1)c1csc(C2CC2)n1 ZINC000349078898 1019860988 /nfs/dbraw/zinc/86/09/88/1019860988.db2.gz PCBWZJZBGQRCSW-UHFFFAOYSA-N -1 3 348.497 4.247 20 0 EIADHM COCc1cccc2sc(NC(=O)c3cc([O-])ccc3Cl)nc21 ZINC000339970018 1020210911 /nfs/dbraw/zinc/21/09/11/1020210911.db2.gz XMSXQOIXFBXVRC-UHFFFAOYSA-N -1 3 348.811 4.054 20 0 EIADHM CC[C@@H]1CCc2nc(NC(=O)c3cc([O-])ccc3Cl)sc2C1 ZINC000683373479 1020450596 /nfs/dbraw/zinc/45/05/96/1020450596.db2.gz ISWPLKXRBWOLEF-SECBINFHSA-N -1 3 336.844 4.269 20 0 EIADHM Cc1ccc2c(c1)CC[C@@H]2[N-]C(=O)C(F)(F)c1cc(F)cc(F)c1 ZINC001125351787 1020730298 /nfs/dbraw/zinc/73/02/98/1020730298.db2.gz MIZHZPIYVPOBBC-INIZCTEOSA-N -1 3 337.316 4.169 20 0 EIADHM CC(=O)c1ccc(C(=O)N2CCC[C@@H](c3ccccc3)CC2)cc1[O-] ZINC000579928687 1020849595 /nfs/dbraw/zinc/84/95/95/1020849595.db2.gz SQRQDYIHIZXDMO-QGZVFWFLSA-N -1 3 337.419 4.005 20 0 EIADHM CC(C)c1nc2cc(NC(=O)c3c[n-]c4ccccc4c3=O)ccc2o1 ZINC000025302437 1020968649 /nfs/dbraw/zinc/96/86/49/1020968649.db2.gz ZVSRGAFICQFQJK-UHFFFAOYSA-N -1 3 347.374 4.045 20 0 EIADHM CCOc1ccc(F)c([N-]C(=O)c2cnc(C(C)C)s2)c1F ZINC000340446386 1021042118 /nfs/dbraw/zinc/04/21/18/1021042118.db2.gz NVMUGKXBDKSRKY-UHFFFAOYSA-N -1 3 326.368 4.196 20 0 EIADHM CC[C@@H](CC(F)(F)F)C(=O)Nc1ccc(Br)cc1[O-] ZINC000580033995 1021323281 /nfs/dbraw/zinc/32/32/81/1021323281.db2.gz OHZGFZVQUIALAA-ZETCQYMHSA-N -1 3 340.139 4.072 20 0 EIADHM CC(C)c1nc(C(=O)[N-]c2nnc(/C=C\c3ccco3)s2)cs1 ZINC000255512957 1022013135 /nfs/dbraw/zinc/01/31/35/1022013135.db2.gz CHYNIEVLDFEWCB-WAYWQWQTSA-N -1 3 346.437 4.134 20 0 EIADHM O=C1CCc2ccc(-c3nc4cc(Cl)c(Cl)cc4c(=O)[n-]3)cc21 ZINC000685896738 1022341657 /nfs/dbraw/zinc/34/16/57/1022341657.db2.gz SUSBBKPUDKLJHA-UHFFFAOYSA-N -1 3 345.185 4.026 20 0 EIADHM CC(C)c1ccc(C(=O)N2CCC[C@@H]2[C@@H]2CCCC[C@]2(C)O)c([O-])c1 ZINC000408409714 1033047331 /nfs/dbraw/zinc/04/73/31/1033047331.db2.gz BXHHVXOUIDWWGN-UEXGIBASSA-N -1 3 345.483 4.061 20 0 EIADHM CC(C)c1ccc(C(=O)N2CCC[C@@H]2[C@@H]2CCCC[C@@]2(C)O)c([O-])c1 ZINC000408409715 1033048523 /nfs/dbraw/zinc/04/85/23/1033048523.db2.gz BXHHVXOUIDWWGN-WAOWUJCRSA-N -1 3 345.483 4.061 20 0 EIADHM Cc1sc2[n-]c([C@H](C)OC(=O)[C@@H]3CCC(C)(C)C3)nc(=O)c2c1C ZINC000781698550 1022423497 /nfs/dbraw/zinc/42/34/97/1022423497.db2.gz PUDADLIJUGLBHQ-CMPLNLGQSA-N -1 3 348.468 4.444 20 0 EIADHM CCS[C@H]1CC[C@@H](N(C)Cc2cc(C(=O)[O-])ccc2Cl)C1 ZINC000580777964 1022487406 /nfs/dbraw/zinc/48/74/06/1022487406.db2.gz AUHBBCROVOBRBZ-KGLIPLIRSA-N -1 3 327.877 4.144 20 0 EIADHM CCS[C@@H]1CC[C@H](N(C)Cc2cc(C(=O)[O-])ccc2Cl)C1 ZINC000580777966 1022489737 /nfs/dbraw/zinc/48/97/37/1022489737.db2.gz AUHBBCROVOBRBZ-UONOGXRCSA-N -1 3 327.877 4.144 20 0 EIADHM CCCCO[C@H]1C[C@H](N(C)C(=O)c2cc([O-])ccc2Cl)C1(C)C ZINC001149273691 1022689836 /nfs/dbraw/zinc/68/98/36/1022689836.db2.gz JVWDIQMUYDDCMA-HOTGVXAUSA-N -1 3 339.863 4.101 20 0 EIADHM CC(=O)c1cccc(NC(=O)CCCOc2ccc(Cl)cc2)c1[O-] ZINC000581122049 1022845003 /nfs/dbraw/zinc/84/50/03/1022845003.db2.gz JPDMFAOFFFUALP-UHFFFAOYSA-N -1 3 347.798 4.046 20 0 EIADHM CCOc1ccc([N-]S(=O)(=O)c2ccc(C(C)C)cc2)cc1OC ZINC000018895741 1022899913 /nfs/dbraw/zinc/89/99/13/1022899913.db2.gz LEUSPRXAEKBTCK-UHFFFAOYSA-N -1 3 349.452 4.018 20 0 EIADHM O=C(CCC1CCCCC1)N[N-]C(=O)c1ccc(Cl)cc1Cl ZINC000023712063 1022919402 /nfs/dbraw/zinc/91/94/02/1022919402.db2.gz BGHVUBLDIDNALY-UHFFFAOYSA-N -1 3 343.254 4.115 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2ccc(COC(C)(C)C)cc2)cc1 ZINC000084461117 1023051378 /nfs/dbraw/zinc/05/13/78/1023051378.db2.gz SPZAIZWFWWNDBE-UHFFFAOYSA-N -1 3 333.453 4.111 20 0 EIADHM Cc1cccc(-c2noc(C=C([O-])c3ccccc3Cl)n2)c1F ZINC001211644889 1023116018 /nfs/dbraw/zinc/11/60/18/1023116018.db2.gz ISVOGUDBHROOAW-UHFFFAOYSA-N -1 3 330.746 4.263 20 0 EIADHM C[C@@H](c1ccccn1)N(C)C(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000179483394 1023214048 /nfs/dbraw/zinc/21/40/48/1023214048.db2.gz CORYOXKKAITWME-HNNXBMFYSA-N -1 3 348.402 4.413 20 0 EIADHM Cc1csc(N(C)C(=O)c2cc(Oc3ccccc3)ccc2[O-])n1 ZINC000179557429 1023216092 /nfs/dbraw/zinc/21/60/92/1023216092.db2.gz SYRFVKDWAYBSJA-UHFFFAOYSA-N -1 3 340.404 4.226 20 0 EIADHM Cc1cc(F)c(F)c(-c2noc(C=C([O-])c3ccccc3Cl)n2)c1 ZINC001211647567 1023229865 /nfs/dbraw/zinc/22/98/65/1023229865.db2.gz VYZMOUAMQYSVNP-UHFFFAOYSA-N -1 3 348.736 4.402 20 0 EIADHM CC(C)Sc1cccc(Cl)c1CN[C@H](CC(F)F)C(=O)[O-] ZINC000417596066 1023367573 /nfs/dbraw/zinc/36/75/73/1023367573.db2.gz PFTLAOZMNUOABG-LLVKDONJSA-N -1 3 337.819 4.039 20 0 EIADHM CC1(C)Cc2cccc(CN[C@H](CCC(=O)[O-])c3ccccc3)c2O1 ZINC000417605029 1023369035 /nfs/dbraw/zinc/36/90/35/1023369035.db2.gz WUMHLCCMKXRTMH-GOSISDBHSA-N -1 3 339.435 4.096 20 0 EIADHM CC(C)(C)c1ccc(-c2ccc(CN[C@H]3C=C[C@H](C(=O)[O-])C3)o2)cc1 ZINC000417613060 1023378973 /nfs/dbraw/zinc/37/89/73/1023378973.db2.gz CHXUNOOHDKMIBG-RDJZCZTQSA-N -1 3 339.435 4.363 20 0 EIADHM CCC[C@H](CCCCNCc1nc2c(s1)C[C@H](C)CC2)C(=O)[O-] ZINC000417641416 1023395160 /nfs/dbraw/zinc/39/51/60/1023395160.db2.gz PXDXVIBRMRSLGZ-ZIAGYGMSSA-N -1 3 338.517 4.029 20 0 EIADHM O=C([O-])CC1(CCNCc2coc(-c3ccccc3)n2)CCCCC1 ZINC000417657103 1023399458 /nfs/dbraw/zinc/39/94/58/1023399458.db2.gz XOQGQFYFRNRGNG-UHFFFAOYSA-N -1 3 342.439 4.247 20 0 EIADHM C[C@H]1CC(C)(C)N(C(=O)c2c[n-]c3ccccc3c2=O)c2ccccc21 ZINC001266773850 1023450746 /nfs/dbraw/zinc/45/07/46/1023450746.db2.gz BYXSXPAKPGJOFI-AWEZNQCLSA-N -1 3 346.430 4.461 20 0 EIADHM CC1(CC(F)(F)F)CN(C(=O)c2cc3sccc3c([O-])c2)C1 ZINC000837185617 1023453190 /nfs/dbraw/zinc/45/31/90/1023453190.db2.gz BZGGMKXVORIIIB-UHFFFAOYSA-N -1 3 329.343 4.021 20 0 EIADHM O=C([O-])[C@@H]1CCN(Cc2ccc(Cl)cc2Cl)[C@H]2CCCC[C@@H]12 ZINC000656763439 1023502933 /nfs/dbraw/zinc/50/29/33/1023502933.db2.gz FSDAHIYCBJIHFH-LZWOXQAQSA-N -1 3 342.266 4.459 20 0 EIADHM O=C([O-])[C@@H]1CCN(Cc2csc(C3CCCC3)n2)[C@@H]2CCCC[C@H]12 ZINC000656767368 1023508060 /nfs/dbraw/zinc/50/80/60/1023508060.db2.gz UXDIXJOHNNXXCB-BRWVUGGUSA-N -1 3 348.512 4.266 20 0 EIADHM O=C(N[C@H]1CCc2sc(Cl)cc21)c1cc([O-])ccc1Cl ZINC000557126284 1023660293 /nfs/dbraw/zinc/66/02/93/1023660293.db2.gz HYLCGHXBCAOAJV-NSHDSACASA-N -1 3 328.220 4.178 20 0 EIADHM C[C@H]1CN(c2ccccc2NCc2c([O-])cccc2Cl)C[C@H](C)O1 ZINC000157360955 1023858762 /nfs/dbraw/zinc/85/87/62/1023858762.db2.gz GICYNZKWIDTXFX-KBPBESRZSA-N -1 3 346.858 4.271 20 0 EIADHM [O-]c1cc(F)cc(CN2CCCC[C@@H]2c2nc3ccccc3o2)c1 ZINC000473139552 1024383562 /nfs/dbraw/zinc/38/35/62/1024383562.db2.gz KEIQGGSKAXJCFK-QGZVFWFLSA-N -1 3 326.371 4.400 20 0 EIADHM Cc1cc(/C=C(/C#N)C(=O)Nc2ccccc2[O-])c(C)n1CC(C)C ZINC000053791305 1024393601 /nfs/dbraw/zinc/39/36/01/1024393601.db2.gz TXYNSJIDFKHRMC-YVLHZVERSA-N -1 3 337.423 4.012 20 0 EIADHM O=S(=O)([N-]C1(c2cccc(Cl)c2)CC1)c1ccc(Cl)s1 ZINC000041572472 1024725829 /nfs/dbraw/zinc/72/58/29/1024725829.db2.gz CNXJDLCYKJVZDZ-UHFFFAOYSA-N -1 3 348.276 4.023 20 0 EIADHM Cc1cccc(CCCN(CCC(=O)[O-])Cc2cccc(F)c2F)c1 ZINC000652483631 1024850984 /nfs/dbraw/zinc/85/09/84/1024850984.db2.gz RIIPJEWOXJAFAP-UHFFFAOYSA-N -1 3 347.405 4.183 20 0 EIADHM C[C@H]1CN(Cc2cccc(C(=O)[O-])c2Cl)CCc2ccc(F)cc21 ZINC000652510721 1024862163 /nfs/dbraw/zinc/86/21/63/1024862163.db2.gz IRPVGPMKFQLUQK-LBPRGKRZSA-N -1 3 347.817 4.339 20 0 EIADHM O=C([O-])[C@@H]1CN(C[C@@H]2CC[C@@H](c3ccccc3)C2)Cc2ccccc21 ZINC000662222187 1024974771 /nfs/dbraw/zinc/97/47/71/1024974771.db2.gz DVYKJKCLIXXTOZ-HGHGUNKESA-N -1 3 335.447 4.254 20 0 EIADHM O=c1nc(CN2CCC3(CC3)CC2)[n-]c2scc(-c3ccco3)c21 ZINC000663438325 1025339642 /nfs/dbraw/zinc/33/96/42/1025339642.db2.gz SFPIUABRRFOQDV-UHFFFAOYSA-N -1 3 341.436 4.033 20 0 EIADHM CC(C)c1nnc([N-]C(=O)c2c(Cl)cc(F)cc2Cl)s1 ZINC000277234743 1025367639 /nfs/dbraw/zinc/36/76/39/1025367639.db2.gz NJDLZWARCRRYNE-UHFFFAOYSA-N -1 3 334.203 4.360 20 0 EIADHM [O-]c1cc(F)cc(CNc2cc(F)ccc2OCC(F)(F)F)c1 ZINC000472075721 1025671739 /nfs/dbraw/zinc/67/17/39/1025671739.db2.gz SJXYKXIHCAREDA-UHFFFAOYSA-N -1 3 333.256 4.224 20 0 EIADHM CC[C@@H](CC(F)(F)F)Nc1ccc(-c2nc(C)c(C)c(=O)[n-]2)cn1 ZINC000546170078 1025711286 /nfs/dbraw/zinc/71/12/86/1025711286.db2.gz AZTZZEYJCQGQPW-LBPRGKRZSA-N -1 3 340.349 4.004 20 0 EIADHM CC(C)(C)OCc1cc(C(=O)[N-]c2c(F)cccc2Cl)no1 ZINC000637101867 1025771660 /nfs/dbraw/zinc/77/16/60/1025771660.db2.gz JHVFNMBVDWTZIV-UHFFFAOYSA-N -1 3 326.755 4.035 20 0 EIADHM CN(Cc1csc(-c2ccc(C(=O)[O-])cc2)n1)C(C1CC1)C1CC1 ZINC000519413044 1025809713 /nfs/dbraw/zinc/80/97/13/1025809713.db2.gz YSTYRTMYOQHXIV-UHFFFAOYSA-N -1 3 342.464 4.129 20 0 EIADHM C[C@H]1SCCN(Cc2c(C(=O)[O-])sc3cccc(F)c32)[C@H]1C ZINC000317238057 1025843157 /nfs/dbraw/zinc/84/31/57/1025843157.db2.gz VXAKGLRJEZMYJT-VHSXEESVSA-N -1 3 339.457 4.064 20 0 EIADHM O=C(Nc1cccc([O-])c1F)c1cc(-c2ccccc2Cl)on1 ZINC000536463593 1025850756 /nfs/dbraw/zinc/85/07/56/1025850756.db2.gz RFSKJHOMSVFUFW-UHFFFAOYSA-N -1 3 332.718 4.092 20 0 EIADHM Cc1ccc([O-])c(C(=O)Nc2ccc(COC3CCCC3)cc2)c1 ZINC000303800670 1026173788 /nfs/dbraw/zinc/17/37/88/1026173788.db2.gz LPEMVHKWAOGCKP-UHFFFAOYSA-N -1 3 325.408 4.412 20 0 EIADHM CC[C@]1(C)CCN(Cc2nc(=O)c3c(-c4ccco4)csc3[n-]2)C1 ZINC000344247177 1026174610 /nfs/dbraw/zinc/17/46/10/1026174610.db2.gz REYNSLVKULGUGC-GOSISDBHSA-N -1 3 343.452 4.279 20 0 EIADHM C[C@@H]1CCCCCN1Cc1csc(-c2ccc(C(=O)[O-])cc2)n1 ZINC000563276639 1026301253 /nfs/dbraw/zinc/30/12/53/1026301253.db2.gz AAOGJPYBSNDUHZ-CYBMUJFWSA-N -1 3 330.453 4.273 20 0 EIADHM Cc1oc(CN(C)[C@H](C)CCSc2ccccc2)cc1C(=O)[O-] ZINC000563283008 1026334648 /nfs/dbraw/zinc/33/46/48/1026334648.db2.gz VZXFIAGNFDHNMI-CYBMUJFWSA-N -1 3 333.453 4.289 20 0 EIADHM CSc1cccc(C)c1[N-]C(=O)c1cc(COC(C)(C)C)on1 ZINC000472218877 1026472876 /nfs/dbraw/zinc/47/28/76/1026472876.db2.gz GQKPWSJNFNESBT-UHFFFAOYSA-N -1 3 334.441 4.272 20 0 EIADHM O=C(Nc1ccccc1N1CCCCC1)c1cc([O-])ccc1Cl ZINC000277558578 1026493032 /nfs/dbraw/zinc/49/30/32/1026493032.db2.gz TZGZEWWQRHOLJW-UHFFFAOYSA-N -1 3 330.815 4.288 20 0 EIADHM C[C@@H](C(=O)[O-])[C@@H](NCc1cc2cc(F)ccc2o1)c1ccccc1 ZINC000426714688 1026496296 /nfs/dbraw/zinc/49/62/96/1026496296.db2.gz DTWIMWTYOSRAAS-KZULUSFZSA-N -1 3 327.355 4.124 20 0 EIADHM CC(C)CCOc1ccc(CN[C@@H](CC(=O)[O-])c2ccsc2)cc1 ZINC000426714184 1026509471 /nfs/dbraw/zinc/50/94/71/1026509471.db2.gz LUZBYVBLHZHLRQ-SFHVURJKSA-N -1 3 347.480 4.479 20 0 EIADHM O=C([O-])C[C@@H](NCc1ccsc1)c1cc(Cl)cc(Cl)c1 ZINC000426753122 1026538706 /nfs/dbraw/zinc/53/87/06/1026538706.db2.gz GYTHEYGCLDTGIW-CYBMUJFWSA-N -1 3 330.236 4.361 20 0 EIADHM O=C([O-])C[C@@H](NCc1cc2ccc(F)cc2[nH]1)c1cccc(Cl)c1 ZINC000426803213 1026570659 /nfs/dbraw/zinc/57/06/59/1026570659.db2.gz LDDDASMZQFVFLK-MRXNPFEDSA-N -1 3 346.789 4.266 20 0 EIADHM CC(C)Oc1cccc(CN[C@@H](CC(=O)[O-])c2cccc(Cl)c2)c1 ZINC000426826546 1026583450 /nfs/dbraw/zinc/58/34/50/1026583450.db2.gz FFQCYNPUGUKUAI-SFHVURJKSA-N -1 3 347.842 4.433 20 0 EIADHM Cc1cccc(-c2noc(-c3cc(Cc4ccccc4)ccc3[O-])n2)n1 ZINC000436907429 1026655062 /nfs/dbraw/zinc/65/50/62/1026655062.db2.gz GBPDTJOAWWEKRC-UHFFFAOYSA-N -1 3 343.386 4.403 20 0 EIADHM COC(=O)c1cnc(S[C@H](C)c2cc(Cl)ccc2Cl)[n-]1 ZINC000432657046 1026679355 /nfs/dbraw/zinc/67/93/55/1026679355.db2.gz JLXUDLGSYNFKJT-SSDOTTSWSA-N -1 3 331.224 4.356 20 0 EIADHM Cc1cc(S(=O)(=O)[N-]c2ccc(Cl)cc2)ccc1OC(C)C ZINC000511135899 1026704664 /nfs/dbraw/zinc/70/46/64/1026704664.db2.gz QYEDODMDRWBIMX-UHFFFAOYSA-N -1 3 339.844 4.236 20 0 EIADHM O=C([N-]c1cc(Cl)c(Cl)cc1F)c1ncoc1[C@@H]1CCCO1 ZINC000341960165 1026733108 /nfs/dbraw/zinc/73/31/08/1026733108.db2.gz JCYWUWCZKMQHGQ-NSHDSACASA-N -1 3 345.157 4.224 20 0 EIADHM CCCOc1cccc(C=C(Cc2ccccc2)c2nccc(=O)[n-]2)c1 ZINC000432693809 1026784069 /nfs/dbraw/zinc/78/40/69/1026784069.db2.gz KHRBJQBJGPINHK-XDJHFCHBSA-N -1 3 346.430 4.342 20 0 EIADHM CC(C)C1(C)CCN([C@H](C(=O)[O-])c2c(F)cccc2Cl)CC1 ZINC000582552186 1026787811 /nfs/dbraw/zinc/78/78/11/1026787811.db2.gz ZDSYQPVCFXHZGZ-HNNXBMFYSA-N -1 3 327.827 4.363 20 0 EIADHM CCCCOc1ccc(F)cc1[N-]c1nnc(Br)s1 ZINC001211717228 1026817191 /nfs/dbraw/zinc/81/71/91/1026817191.db2.gz UEFKMHJQDLUMGV-UHFFFAOYSA-N -1 3 346.225 4.362 20 0 EIADHM O=S(=O)([N-]Cc1cccc2ccccc21)c1cc(F)ccc1Cl ZINC000500498100 1026798937 /nfs/dbraw/zinc/79/89/37/1026798937.db2.gz NBRPXZXANNBKMR-UHFFFAOYSA-N -1 3 349.814 4.111 20 0 EIADHM O=c1ccnc(C(=Cc2ccsc2Cl)Cc2ccccc2)[n-]1 ZINC000432706870 1026805799 /nfs/dbraw/zinc/80/57/99/1026805799.db2.gz BYEGRPCMMFWQHE-SDNWHVSQSA-N -1 3 328.824 4.268 20 0 EIADHM O=C([O-])c1ccoc1CN1CCCCC[C@@H]1/C=C/c1cccs1 ZINC000582671553 1026924203 /nfs/dbraw/zinc/92/42/03/1026924203.db2.gz QRIRXFKGQVUKOM-HSBSLETESA-N -1 3 331.437 4.497 20 0 EIADHM COc1cc(-c2noc(-c3cc4ccccc4cc3[O-])n2)ccc1F ZINC000327508623 1027104572 /nfs/dbraw/zinc/10/45/72/1027104572.db2.gz IIPULGMGXGXMFX-UHFFFAOYSA-N -1 3 336.322 4.410 20 0 EIADHM Cc1nc(-c2ccc(CNC(=O)c3ccc(C)cc3[O-])cc2)cs1 ZINC000520032443 1027139528 /nfs/dbraw/zinc/13/95/28/1027139528.db2.gz FMDDMVNPAFRIAB-UHFFFAOYSA-N -1 3 338.432 4.063 20 0 EIADHM [O-]c1cccc(CNC[C@@H](OC2CCCC2)C(F)(F)F)c1Cl ZINC000657587618 1027214320 /nfs/dbraw/zinc/21/43/20/1027214320.db2.gz FTGULEZIYIUKMK-CYBMUJFWSA-N -1 3 337.769 4.025 20 0 EIADHM CCSc1cccc(F)c1[N-]S(=O)(=O)c1cc(F)ccc1C ZINC000582758255 1027259755 /nfs/dbraw/zinc/25/97/55/1027259755.db2.gz HIHMKOLLAZERFZ-UHFFFAOYSA-N -1 3 343.420 4.186 20 0 EIADHM COc1c(F)c(F)ccc1Nc1cc(Br)cc(F)c1[O-] ZINC001211898896 1027430716 /nfs/dbraw/zinc/43/07/16/1027430716.db2.gz SHLLZTLAFKJWRG-UHFFFAOYSA-N -1 3 348.118 4.324 20 0 EIADHM CC(C)c1ccc(S(=O)(=O)[N-]c2cc(Cl)ccc2F)cc1 ZINC000005126624 1027877407 /nfs/dbraw/zinc/87/74/07/1027877407.db2.gz ZUCJOXQHPOMEEU-UHFFFAOYSA-N -1 3 327.808 4.403 20 0 EIADHM CC(=O)c1cccc(NC(=O)c2oc3ccc(F)cc3c2C)c1[O-] ZINC000583040550 1027878728 /nfs/dbraw/zinc/87/87/28/1027878728.db2.gz QZKNXSSBBYELBX-UHFFFAOYSA-N -1 3 327.311 4.041 20 0 EIADHM Cc1nc(C)c([C@H](C)N(C)C(=O)c2ccc(C(C)C)cc2[O-])s1 ZINC000331229767 1027937266 /nfs/dbraw/zinc/93/72/66/1027937266.db2.gz GQTXWZNMETVWRL-LBPRGKRZSA-N -1 3 332.469 4.422 20 0 EIADHM O=S(=O)([N-][C@@H](c1ccccc1)c1ccc(Cl)cc1)c1ccco1 ZINC000188569192 1027981388 /nfs/dbraw/zinc/98/13/88/1027981388.db2.gz HQEHVBHPIHCFQG-KRWDZBQOSA-N -1 3 347.823 4.001 20 0 EIADHM COc1ccc([C@@H]2CCCN2C(=O)c2cc([O-])ccc2Cl)cc1 ZINC000431525592 1028196091 /nfs/dbraw/zinc/19/60/91/1028196091.db2.gz VONXZPNQWHQWQU-KRWDZBQOSA-N -1 3 331.799 4.032 20 0 EIADHM Cc1nc(-c2ccc(NC(=O)NCCCC(C)(C)C)cc2)cc(=O)[n-]1 ZINC000523568323 1028219408 /nfs/dbraw/zinc/21/94/08/1028219408.db2.gz WAZNBEGPIDQXNF-UHFFFAOYSA-N -1 3 342.443 4.105 20 0 EIADHM O=C([O-])CC[C@@H]1CCCCN1Cc1ncc(-c2cccc(Cl)c2)o1 ZINC000324282671 1028238432 /nfs/dbraw/zinc/23/84/32/1028238432.db2.gz PGIQQUKMRFZNFD-HNNXBMFYSA-N -1 3 348.830 4.214 20 0 EIADHM O=C(N[C@@H]1CC[C@@H](c2ccccc2F)C1)c1cc([O-])ccc1Cl ZINC000511235797 1028303349 /nfs/dbraw/zinc/30/33/49/1028303349.db2.gz PFDBAUNEKPDPMJ-VXGBXAGGSA-N -1 3 333.790 4.251 20 0 EIADHM COC(=O)c1cc(C(F)(F)F)ccc1Nc1cc(F)c([O-])c(F)c1 ZINC001213381851 1028514407 /nfs/dbraw/zinc/51/44/07/1028514407.db2.gz LAGDJIQDAOYLOK-UHFFFAOYSA-N -1 3 347.239 4.219 20 0 EIADHM O=S(=O)([N-]c1ccc(F)cc1F)c1ccc(Cl)c(Cl)c1 ZINC000016129352 1028786907 /nfs/dbraw/zinc/78/69/07/1028786907.db2.gz GWOSDXMWDGCGNJ-UHFFFAOYSA-N -1 3 338.162 4.072 20 0 EIADHM COc1ccc([O-])c(-c2nc(C(C)(C)c3ccccc3Cl)no2)c1 ZINC000445681064 1028841104 /nfs/dbraw/zinc/84/11/04/1028841104.db2.gz JSRFOTAKKNHUDL-UHFFFAOYSA-N -1 3 344.798 4.430 20 0 EIADHM CN(Cc1nc2c3ccccc3oc2c(=O)[n-]1)[C@@H]1CCc2ccccc21 ZINC000347181930 1028906102 /nfs/dbraw/zinc/90/61/02/1028906102.db2.gz VXJQOIPUKZDGOX-MRXNPFEDSA-N -1 3 345.402 4.201 20 0 EIADHM O=S(=O)([N-]c1ccc(F)cc1Cl)c1cc(F)ccc1Cl ZINC000103057813 1029160738 /nfs/dbraw/zinc/16/07/38/1029160738.db2.gz KIBFXRKXHIVJSF-UHFFFAOYSA-N -1 3 338.162 4.072 20 0 EIADHM Cc1cc(=O)[n-]c([C@@H](C)N[C@@H](c2ccc(Cl)cc2F)C(C)C)n1 ZINC000192774962 1029385073 /nfs/dbraw/zinc/38/50/73/1029385073.db2.gz LMMBKRCIOSDFBG-BDJLRTHQSA-N -1 3 337.826 4.331 20 0 EIADHM Fc1cccc([C@H]([N-]c2noc(-c3ccccc3)n2)c2ccccn2)c1 ZINC000158291111 1029429122 /nfs/dbraw/zinc/42/91/22/1029429122.db2.gz BUZUBZUOMBWQQY-SFHVURJKSA-N -1 3 346.365 4.472 20 0 EIADHM Cc1noc(C(C)C)c1[N-]C(=O)c1oc(-c2ccccc2)nc1C ZINC000928789435 1029480062 /nfs/dbraw/zinc/48/00/62/1029480062.db2.gz OGSZNZRVFNIYLJ-UHFFFAOYSA-N -1 3 325.368 4.322 20 0 EIADHM CC(C)N(Cc1csc(-c2cccc(C(=O)[O-])c2)n1)CC1CC1 ZINC000564739205 1029506892 /nfs/dbraw/zinc/50/68/92/1029506892.db2.gz WPNYMNJTVNODKZ-UHFFFAOYSA-N -1 3 330.453 4.129 20 0 EIADHM CCc1ccc(-c2nc([C@H]3CCOC4(CCCC4)C3)no2)c([O-])c1 ZINC000897187293 1029525129 /nfs/dbraw/zinc/52/51/29/1029525129.db2.gz SPQQMEASCHISNA-AWEZNQCLSA-N -1 3 328.412 4.211 20 0 EIADHM Cc1ccc(-c2nc(Cc3cccc(C(F)(F)F)c3)no2)c([O-])c1 ZINC000324922062 1029536653 /nfs/dbraw/zinc/53/66/53/1029536653.db2.gz SFAJLWQGQZGHQC-UHFFFAOYSA-N -1 3 334.297 4.360 20 0 EIADHM O=C(Nc1cc(F)ccc1[O-])c1ccc(Sc2ccccn2)cc1 ZINC000531133940 1029551746 /nfs/dbraw/zinc/55/17/46/1029551746.db2.gz JGPTXPNDPPOSLY-UHFFFAOYSA-N -1 3 340.379 4.330 20 0 EIADHM Cc1ccc(Cl)c([N-]S(=O)(=O)c2ccc(F)cc2F)c1C ZINC000446973982 1029662154 /nfs/dbraw/zinc/66/21/54/1029662154.db2.gz VVRRQHSHVZVEKT-UHFFFAOYSA-N -1 3 331.771 4.036 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(NC[C@H](C)c3ccc(C)cc3)nc2)n1 ZINC000301382417 1029721193 /nfs/dbraw/zinc/72/11/93/1029721193.db2.gz SUXPTHIAOLOFIV-HNNXBMFYSA-N -1 3 348.450 4.331 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N3CCC[C@H]3CC(C)(C)C)nc2)n1 ZINC000301409793 1029727891 /nfs/dbraw/zinc/72/78/91/1029727891.db2.gz OGMPUKLOZAXASX-INIZCTEOSA-N -1 3 340.471 4.212 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@@H]3CCC[C@H](C)[C@@H]3C)nc2)n1 ZINC000301490392 1029742101 /nfs/dbraw/zinc/74/21/01/1029742101.db2.gz ARIORJDUXZHVSS-HEHGZKQESA-N -1 3 326.444 4.043 20 0 EIADHM CCCC1(CNc2ccc(-c3nc(CC)cc(=O)[n-]3)cn2)CCC1 ZINC000301636212 1029778232 /nfs/dbraw/zinc/77/82/32/1029778232.db2.gz LLBBQZMEVWLXRM-UHFFFAOYSA-N -1 3 326.444 4.189 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(NCC(C)(C)C3CCCC3)nc2)n1 ZINC000301791135 1029809436 /nfs/dbraw/zinc/80/94/36/1029809436.db2.gz ZIFKVJCCFPLFMZ-UHFFFAOYSA-N -1 3 340.471 4.435 20 0 EIADHM CCCC(=O)Nc1cccc(NC(=O)c2cccc(CC)c2[O-])c1C ZINC000081756559 1029812212 /nfs/dbraw/zinc/81/22/12/1029812212.db2.gz AHHRFVPPXPFQJK-UHFFFAOYSA-N -1 3 340.423 4.254 20 0 EIADHM C[C@@H](c1ccc(Cl)c(Cl)c1)N1CCC(c2n[n-]c(=O)o2)CC1 ZINC000450911188 1030100957 /nfs/dbraw/zinc/10/09/57/1030100957.db2.gz CQWWUSNNMDNHND-VIFPVBQESA-N -1 3 342.226 4.023 20 0 EIADHM COc1cccc([C@H](C)CCCC(=O)NCc2ccc([O-])c(F)c2)c1 ZINC000447553277 1030133619 /nfs/dbraw/zinc/13/36/19/1030133619.db2.gz QKFCABXGADCJDS-CQSZACIVSA-N -1 3 345.414 4.130 20 0 EIADHM C[C@@H]1CCN(C(=O)CCCc2ccc([O-])c(F)c2)[C@@H]2CCCC[C@@H]12 ZINC000530332008 1030306065 /nfs/dbraw/zinc/30/60/65/1030306065.db2.gz QQNWSGIAZAZXOB-UWWQBHOKSA-N -1 3 333.447 4.281 20 0 EIADHM CC(C)(C)C1CCN(Cc2nc3c4ccccc4oc3c(=O)[n-]2)CC1 ZINC000530356452 1030334987 /nfs/dbraw/zinc/33/49/87/1030334987.db2.gz NFDLTDJIJFKGGT-UHFFFAOYSA-N -1 3 339.439 4.340 20 0 EIADHM CCc1cccc2c1N(C(=O)CCCc1ccc([O-])c(F)c1)CC2 ZINC000527043221 1030425425 /nfs/dbraw/zinc/42/54/25/1030425425.db2.gz VCKOWTQQTVMPMU-UHFFFAOYSA-N -1 3 327.399 4.006 20 0 EIADHM Cc1nn(-c2ccccc2)c(C)c1NC(=O)c1cc([O-])ccc1Cl ZINC000431617065 1030561124 /nfs/dbraw/zinc/56/11/24/1030561124.db2.gz LOSZXMWCPYBDTH-UHFFFAOYSA-N -1 3 341.798 4.100 20 0 EIADHM CC(C)[C@H]1C[C@@H](NC(=O)NCc2ccc([O-])c(F)c2)c2ccccc21 ZINC000448144659 1030587704 /nfs/dbraw/zinc/58/77/04/1030587704.db2.gz FMYQABPIHRWVFT-SJLPKXTDSA-N -1 3 342.414 4.215 20 0 EIADHM COc1ccc(C2(C(=O)Nc3cc(Cl)ccc3[O-])CCC2)cc1 ZINC000530673101 1030640014 /nfs/dbraw/zinc/64/00/14/1030640014.db2.gz NHXKUOXGFOXQJA-UHFFFAOYSA-N -1 3 331.799 4.115 20 0 EIADHM Cc1ccc([C@@H]2C[C@@H](C)N(Cc3nc(=O)c4sccc4[n-]3)C2)cc1 ZINC000278782641 1030710941 /nfs/dbraw/zinc/71/09/41/1030710941.db2.gz XLKHWNIEIWCMBR-UKRRQHHQSA-N -1 3 339.464 4.083 20 0 EIADHM CC(C)c1nnc([N-]C(=O)c2csc(-c3ccc(F)cc3)n2)s1 ZINC000025324160 1030719534 /nfs/dbraw/zinc/71/95/34/1030719534.db2.gz FECCYKRRAGKIHE-UHFFFAOYSA-N -1 3 348.428 4.176 20 0 EIADHM CCOc1ccc([C@@H](C)Oc2ncc(Br)cc2[O-])cc1 ZINC001228955929 1030737504 /nfs/dbraw/zinc/73/75/04/1030737504.db2.gz MNRZPERERJMVNR-SNVBAGLBSA-N -1 3 338.201 4.088 20 0 EIADHM Cc1c2ccccc2oc1C(=O)N=c1cc(-c2ccccc2F)o[n-]1 ZINC000448490729 1030818610 /nfs/dbraw/zinc/81/86/10/1030818610.db2.gz PVEITOVXKSFVBX-UHFFFAOYSA-N -1 3 336.322 4.210 20 0 EIADHM CCN(c1ccc([N-]S(=O)(=O)c2ccccc2C)cc1)C(C)C ZINC000321506395 1030835584 /nfs/dbraw/zinc/83/55/84/1030835584.db2.gz HMGXZBZTEXIEPY-UHFFFAOYSA-N -1 3 332.469 4.031 20 0 EIADHM CCc1cccc(C(=O)Nc2ccc(Oc3nccc(C)n3)cc2)c1[O-] ZINC000531245221 1031015507 /nfs/dbraw/zinc/01/55/07/1031015507.db2.gz HDNOHKPUMRHIAC-UHFFFAOYSA-N -1 3 349.390 4.098 20 0 EIADHM C[C@H](c1ccc(Cl)cc1)N(C(=O)Cc1ccc([O-])c(F)c1)C1CC1 ZINC000448745597 1031033009 /nfs/dbraw/zinc/03/30/09/1031033009.db2.gz FPHSXANEZUAPRO-GFCCVEGCSA-N -1 3 347.817 4.479 20 0 EIADHM CSCC1CCC(NC(=O)c2cc([O-])c3ccccc3c2)CC1 ZINC000452475986 1031054008 /nfs/dbraw/zinc/05/40/08/1031054008.db2.gz CEYQTRKEUVSWFP-UHFFFAOYSA-N -1 3 329.465 4.197 20 0 EIADHM Cc1ccc(C(=O)N2CCC(c3nc(C(C)C)cs3)CC2)c([O-])c1 ZINC000375790828 1031099991 /nfs/dbraw/zinc/09/99/91/1031099991.db2.gz DPCGJIQJDQCURD-UHFFFAOYSA-N -1 3 344.480 4.300 20 0 EIADHM Cc1ccc([C@H]2CCCN2C(=O)Cc2ccc([O-])c(F)c2)cc1C ZINC000448799236 1031110812 /nfs/dbraw/zinc/11/08/12/1031110812.db2.gz IYYHPYBEGFBWKD-GOSISDBHSA-N -1 3 327.399 4.054 20 0 EIADHM CC1(C)CN(C(=O)c2cc([O-])c3ccccc3c2)[C@@H]1c1cccnc1 ZINC000359263555 1031182542 /nfs/dbraw/zinc/18/25/42/1031182542.db2.gz NTMLRDROJUXODF-LJQANCHMSA-N -1 3 332.403 4.164 20 0 EIADHM O=C(Cc1ccc([O-])c(F)c1)Nc1ccc(NC2CCCCC2)cc1 ZINC000648229421 1031267995 /nfs/dbraw/zinc/26/79/95/1031267995.db2.gz IDIXZVXURTUHTA-UHFFFAOYSA-N -1 3 342.414 4.457 20 0 EIADHM O=C(CCc1cnc2ccccc2c1)Nc1cc(Cl)ccc1[O-] ZINC000472421227 1031428519 /nfs/dbraw/zinc/42/85/19/1031428519.db2.gz RTEOPLGRZUGRJM-UHFFFAOYSA-N -1 3 326.783 4.165 20 0 EIADHM CC(C)(C(=O)Nc1cccc([O-])c1F)c1ccc(Cl)cc1F ZINC000190916148 1031454106 /nfs/dbraw/zinc/45/41/06/1031454106.db2.gz NZURFCAGQZNQOZ-UHFFFAOYSA-N -1 3 325.742 4.240 20 0 EIADHM [O-]c1cccc(CN[C@H](c2cccs2)C2(CO)CCC2)c1Cl ZINC000449765701 1031988940 /nfs/dbraw/zinc/98/89/40/1031988940.db2.gz KCLPMECOEOLRBG-MRXNPFEDSA-N -1 3 337.872 4.101 20 0 EIADHM Cc1nc(CCCC(=O)Nc2ccc([O-])c(C(F)(F)F)c2)cs1 ZINC000134165884 1031994629 /nfs/dbraw/zinc/99/46/29/1031994629.db2.gz NXFDZQMTENRUJG-UHFFFAOYSA-N -1 3 344.358 4.137 20 0 EIADHM CC[C@H](NC(=O)c1c[n-]c2ccccc2c1=O)c1cccc(Cl)c1 ZINC000053799211 1032039683 /nfs/dbraw/zinc/03/96/83/1032039683.db2.gz IBJCIEIABVOOFK-INIZCTEOSA-N -1 3 340.810 4.063 20 0 EIADHM C[C@@H]1C[C@@]1(NC(=O)c1cc([O-])ccc1Cl)c1ccc(Cl)cc1 ZINC000512787836 1033946503 /nfs/dbraw/zinc/94/65/03/1033946503.db2.gz LEHLEGABNLWLCO-QGHHPUGFSA-N -1 3 336.218 4.364 20 0 EIADHM Cc1ccc([C@@H](C)N(C)Cc2nc3c4ccccc4oc3c(=O)[n-]2)cc1 ZINC000052907504 1034794767 /nfs/dbraw/zinc/79/47/67/1034794767.db2.gz GYFYAHHGGFDUQL-CQSZACIVSA-N -1 3 347.418 4.171 20 0 EIADHM [O-]c1ccc(F)c(CN2CCC(c3ncccc3Cl)CC2)c1F ZINC000513242527 1034855286 /nfs/dbraw/zinc/85/52/86/1034855286.db2.gz SPYVUYDUUWVPPS-UHFFFAOYSA-N -1 3 338.785 4.098 20 0 EIADHM COc1cccc(-c2nc(-c3ccc(C(F)(F)F)s3)no2)c1[O-] ZINC000904970380 1035688843 /nfs/dbraw/zinc/68/88/43/1035688843.db2.gz AVILGIAOTYKZPD-UHFFFAOYSA-N -1 3 342.298 4.198 20 0 EIADHM CCCc1cc(=O)[n-]c(C(=Cc2ccc(C(F)(F)F)[nH]2)CC)n1 ZINC000905072589 1035727192 /nfs/dbraw/zinc/72/71/92/1035727192.db2.gz GBMWMUQPVYIWPZ-CSKARUKUSA-N -1 3 325.334 4.432 20 0 EIADHM CC(C)=CCC[C@H](C)CCN1CCOc2c(cccc2C(=O)[O-])C1 ZINC000905739640 1035881086 /nfs/dbraw/zinc/88/10/86/1035881086.db2.gz MIGWHGQDOUTABV-INIZCTEOSA-N -1 3 331.456 4.352 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1ccc(OC(F)F)c(F)c1 ZINC000485511167 1035976897 /nfs/dbraw/zinc/97/68/97/1035976897.db2.gz ZSUDUHLTNQFYDM-UHFFFAOYSA-N -1 3 331.677 4.038 20 0 EIADHM Cc1oc(CN(C)CCc2cc(Cl)cc(Cl)c2)cc1C(=O)[O-] ZINC000571410878 1036040100 /nfs/dbraw/zinc/04/01/00/1036040100.db2.gz XITNQCJRFBHWSX-UHFFFAOYSA-N -1 3 342.222 4.268 20 0 EIADHM CSC1CCN(C(=O)c2cc(Oc3ccccc3)ccc2[O-])CC1 ZINC000601692021 1036195267 /nfs/dbraw/zinc/19/52/67/1036195267.db2.gz QNVMVSJYYRLDMT-UHFFFAOYSA-N -1 3 343.448 4.152 20 0 EIADHM O=C(COC(=O)c1ccc([O-])cc1)c1ccc2c(c1)Cc1ccccc1-2 ZINC000060787280 1036453977 /nfs/dbraw/zinc/45/39/77/1036453977.db2.gz YLXBLJCXTUONRB-UHFFFAOYSA-N -1 3 344.366 4.003 20 0 EIADHM CC(C)COc1cccc(C=Cc2cc(=O)[n-]c(-c3ccncc3)n2)c1 ZINC000486054009 1036458166 /nfs/dbraw/zinc/45/81/66/1036458166.db2.gz UTOLXPCLXJSXPJ-SREVYHEPSA-N -1 3 347.418 4.037 20 0 EIADHM CC(C)c1ccc(C(=O)N2CCC[C@H](CC(F)(F)F)C2)c([O-])c1 ZINC000421964866 1036861035 /nfs/dbraw/zinc/86/10/35/1036861035.db2.gz NVVHWGFEIJWBBT-GFCCVEGCSA-N -1 3 329.362 4.320 20 0 EIADHM O=C([N-]OCc1ccccc1)Nc1ncc(-c2ccccc2)s1 ZINC000043635788 1036864276 /nfs/dbraw/zinc/86/42/76/1036864276.db2.gz PWBFDWSPWSNAHV-UHFFFAOYSA-N -1 3 325.393 4.063 20 0 EIADHM CCC[C@@H]1CCCC[C@@H]1C[N-]S(=O)(=O)c1cccc(Cl)c1F ZINC001212162411 1036977586 /nfs/dbraw/zinc/97/75/86/1036977586.db2.gz MZLIZPRWUOGVEC-CHWSQXEVSA-N -1 3 347.883 4.364 20 0 EIADHM Cc1cccc([O-])c1C(=O)Nc1cccc(C[S@](=O)C(C)(C)C)c1 ZINC000599519172 1037049256 /nfs/dbraw/zinc/04/92/56/1037049256.db2.gz NQNQQJPUDNTARA-DEOSSOPVSA-N -1 3 345.464 4.000 20 0 EIADHM O=c1nc(CS[C@H]2CCCOC2)[n-]c2scc(-c3ccco3)c21 ZINC000272410122 1037182602 /nfs/dbraw/zinc/18/26/02/1037182602.db2.gz GMCLEFDBAKVEHH-JTQLQIEISA-N -1 3 348.449 4.069 20 0 EIADHM Cc1ccc([C@H]2CCCN2Cc2nc3c4ccccc4oc3c(=O)[n-]2)o1 ZINC000604761148 1037525992 /nfs/dbraw/zinc/52/59/92/1037525992.db2.gz IWARFZVZIPJAQI-CQSZACIVSA-N -1 3 349.390 4.320 20 0 EIADHM CC(C)[C@H](C(=O)NCc1ccc([O-])c(F)c1)c1cccc(Cl)c1 ZINC000488604099 1037688080 /nfs/dbraw/zinc/68/80/80/1037688080.db2.gz VVIOKIZDADDXIY-KRWDZBQOSA-N -1 3 335.806 4.241 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(NCc3cc(C)cc(C)c3)nc2)n1 ZINC000664319700 1037765127 /nfs/dbraw/zinc/76/51/27/1037765127.db2.gz QGRQHOWCXXYMNZ-UHFFFAOYSA-N -1 3 334.423 4.036 20 0 EIADHM CC(C)(COCc1ccccc1)C(=O)Nc1ccc(Cl)cc1[O-] ZINC000503538543 1037802170 /nfs/dbraw/zinc/80/21/70/1037802170.db2.gz JACMJTFTGUFQLU-UHFFFAOYSA-N -1 3 333.815 4.227 20 0 EIADHM CCN(CC)[C@H](C(=O)Nc1cccc(Cl)c1[O-])c1ccccc1 ZINC000605892610 1037870656 /nfs/dbraw/zinc/87/06/56/1037870656.db2.gz BIBMADITKOSZJN-INIZCTEOSA-N -1 3 332.831 4.067 20 0 EIADHM CCSc1ccc(Cl)cc1NC([O-])=NO[C@@H]1CCCCO1 ZINC000156013400 1037894368 /nfs/dbraw/zinc/89/43/68/1037894368.db2.gz HSPWRBUXHAWGFO-CYBMUJFWSA-N -1 3 330.837 4.032 20 0 EIADHM CCSc1ccc(Cl)cc1NC(=O)[N-]O[C@@H]1CCCCO1 ZINC000156013400 1037894398 /nfs/dbraw/zinc/89/43/98/1037894398.db2.gz HSPWRBUXHAWGFO-CYBMUJFWSA-N -1 3 330.837 4.032 20 0 EIADHM Cc1cc([N-]S(=O)(=O)c2ccc(Cl)cc2)ccc1OC(C)C ZINC000607616857 1038240405 /nfs/dbraw/zinc/24/04/05/1038240405.db2.gz YSQPYSFDMADJDC-UHFFFAOYSA-N -1 3 339.844 4.236 20 0 EIADHM CSc1ccccc1[C@@H](C)NC(=O)CCCc1ccc([O-])c(F)c1 ZINC000504331873 1038327693 /nfs/dbraw/zinc/32/76/93/1038327693.db2.gz KLGWDWIAYHEHSF-CYBMUJFWSA-N -1 3 347.455 4.453 20 0 EIADHM CSc1ccc(Cl)cc1[N-]C(=O)c1nc(C)ncc1Cl ZINC000607809827 1038345922 /nfs/dbraw/zinc/34/59/22/1038345922.db2.gz IALFGAHFZVYLJU-UHFFFAOYSA-N -1 3 328.224 4.066 20 0 EIADHM O=C([N-]c1nnc(CC2CCCCC2)s1)c1cc(F)ccc1F ZINC000504572965 1038418710 /nfs/dbraw/zinc/41/87/10/1038418710.db2.gz ONBZKNNXUFKEOP-UHFFFAOYSA-N -1 3 337.395 4.191 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@@H]3CC[C@H]4CCC[C@H]4C3)nc2)n1 ZINC000608090891 1038593650 /nfs/dbraw/zinc/59/36/50/1038593650.db2.gz QPYQXEJNNVXWDX-JKIFEVAISA-N -1 3 338.455 4.187 20 0 EIADHM Cc1nc(S(=O)(=O)[C@H](C)c2cccc(C)c2)[n-]c1-c1ccccc1 ZINC000490451414 1038644092 /nfs/dbraw/zinc/64/40/92/1038644092.db2.gz UMBYTZFFSUKBQL-OAHLLOKOSA-N -1 3 340.448 4.228 20 0 EIADHM Cc1[n-]c(S(=O)(=O)[C@H](C)c2cccc(C)c2)nc1-c1ccccc1 ZINC000490451414 1038644211 /nfs/dbraw/zinc/64/42/11/1038644211.db2.gz UMBYTZFFSUKBQL-OAHLLOKOSA-N -1 3 340.448 4.228 20 0 EIADHM O=C(CCC(=O)c1ccc(Cl)cc1)Nc1ccc(Cl)cc1[O-] ZINC000533972203 1038784084 /nfs/dbraw/zinc/78/40/84/1038784084.db2.gz NFHYJKABZPGNRY-UHFFFAOYSA-N -1 3 338.190 4.301 20 0 EIADHM CCOc1ccc([N-]S(=O)(=O)c2ccccc2C(C)(C)C)cc1 ZINC000460440097 1038797129 /nfs/dbraw/zinc/79/71/29/1038797129.db2.gz ONESVVBANRNTHR-UHFFFAOYSA-N -1 3 333.453 4.184 20 0 EIADHM Cc1ccc(Cl)cc1S(=O)(=O)[N-]c1cc(Cl)ccc1F ZINC000505003961 1038877424 /nfs/dbraw/zinc/87/74/24/1038877424.db2.gz ZZHQAIJEIMGUBI-UHFFFAOYSA-N -1 3 334.199 4.242 20 0 EIADHM CCC(C)(C)c1ccc(S(=O)(=O)[N-]c2c(O)cccc2F)cc1 ZINC000608755406 1038889099 /nfs/dbraw/zinc/88/90/99/1038889099.db2.gz HHUXBDBKLZRICK-UHFFFAOYSA-N -1 3 337.416 4.020 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1cc(C(F)(F)F)ccc1F ZINC000533993416 1039019489 /nfs/dbraw/zinc/01/94/89/1039019489.db2.gz YBOWXZUBZQGALY-UHFFFAOYSA-N -1 3 333.668 4.456 20 0 EIADHM CC(=O)c1cccc(NC(=O)c2cccc(OC3CCCC3)c2)c1[O-] ZINC000552069706 1039092370 /nfs/dbraw/zinc/09/23/70/1039092370.db2.gz FUKRKZSHYCPVAM-UHFFFAOYSA-N -1 3 339.391 4.169 20 0 EIADHM CC(=O)c1cccc(NC(=O)[C@@H]2C[C@@H]2c2cccc3ccccc32)c1[O-] ZINC000552069845 1039093425 /nfs/dbraw/zinc/09/34/25/1039093425.db2.gz MFZPNVHAMXJGSM-RTBURBONSA-N -1 3 345.398 4.490 20 0 EIADHM CC(C)(C)c1ccccc1NCc1nc(C(F)(F)F)cc(=O)[n-]1 ZINC000534172071 1039194120 /nfs/dbraw/zinc/19/41/20/1039194120.db2.gz LVJBTJWJPLWSKM-UHFFFAOYSA-N -1 3 325.334 4.111 20 0 EIADHM CCc1cc(=O)[n-]c(CSc2ncc(C(F)(F)F)cc2Cl)n1 ZINC000555429389 1039195861 /nfs/dbraw/zinc/19/58/61/1039195861.db2.gz FXAPKIHDTWBPNK-UHFFFAOYSA-N -1 3 349.765 4.104 20 0 EIADHM CC(=O)c1cccc(NC(=O)[C@@H](OC(C)(C)C)c2ccccc2)c1[O-] ZINC000552287644 1039339689 /nfs/dbraw/zinc/33/96/89/1039339689.db2.gz YEDRWVKMFCFVMJ-SFHVURJKSA-N -1 3 341.407 4.090 20 0 EIADHM CC(=O)c1cccc(NC(=O)c2cc(F)c(Cl)cc2Cl)c1[O-] ZINC000552287515 1039340632 /nfs/dbraw/zinc/34/06/32/1039340632.db2.gz UTAJFIKBCZBUGZ-UHFFFAOYSA-N -1 3 342.153 4.293 20 0 EIADHM CC(=O)c1cccc(NC(=O)CC2CCC(C(F)(F)F)CC2)c1[O-] ZINC000552287195 1039340971 /nfs/dbraw/zinc/34/09/71/1039340971.db2.gz KRBZMHITZHPHPG-UHFFFAOYSA-N -1 3 343.345 4.292 20 0 EIADHM CC(=O)c1cccc(NC(=O)CCCc2cc(C)sc2C)c1[O-] ZINC000552287680 1039341270 /nfs/dbraw/zinc/34/12/70/1039341270.db2.gz ZTTRGNRZRPOUEH-UHFFFAOYSA-N -1 3 331.437 4.235 20 0 EIADHM CCOc1ccc(OCCCC(=O)Nc2c([O-])cccc2Cl)cc1 ZINC000552436647 1039516093 /nfs/dbraw/zinc/51/60/93/1039516093.db2.gz PKMDJKWITOLYJR-UHFFFAOYSA-N -1 3 349.814 4.242 20 0 EIADHM Cc1nn(CC(C)C)c(C)c1CCC(=O)Nc1c([O-])cccc1Cl ZINC000552435417 1039516952 /nfs/dbraw/zinc/51/69/52/1039516952.db2.gz GIIQVSUZRZICDB-UHFFFAOYSA-N -1 3 349.862 4.086 20 0 EIADHM Cc1ccc(/C=C/S(=O)(=O)[N-]c2ccccc2C(F)(F)F)cc1 ZINC000078288702 1039791044 /nfs/dbraw/zinc/79/10/44/1039791044.db2.gz NJYSKBSRJVCWRP-ZHACJKMWSA-N -1 3 341.354 4.426 20 0 EIADHM O=C(c1ccccc1[O-])N1Cc2ccccc2[C@H](c2ccccc2)C1 ZINC000552767653 1039807700 /nfs/dbraw/zinc/80/77/00/1039807700.db2.gz YCAFYDAUHJILDL-FQEVSTJZSA-N -1 3 329.399 4.180 20 0 EIADHM [O-]c1cccc(CN[C@H](c2ccccc2)C2CC2)c1Br ZINC000314958362 1040197046 /nfs/dbraw/zinc/19/70/46/1040197046.db2.gz DIQQCGCIPDCIIE-QGZVFWFLSA-N -1 3 332.241 4.396 20 0 EIADHM COc1ccccc1[C@H](C)NCc1cccc([O-])c1Br ZINC000315150273 1040263423 /nfs/dbraw/zinc/26/34/23/1040263423.db2.gz DCSPSFUTKCDTMH-NSHDSACASA-N -1 3 336.229 4.014 20 0 EIADHM COc1ccc([C@H](CCC(=O)[O-])NCc2ccc(C)cc2Cl)cc1 ZINC000567986013 1040287414 /nfs/dbraw/zinc/28/74/14/1040287414.db2.gz GPKOYVHFJQBFIK-SFHVURJKSA-N -1 3 347.842 4.353 20 0 EIADHM COc1ccc([C@@H](CCC(=O)[O-])NCc2ccc(C)cc2Cl)cc1 ZINC000567986012 1040288551 /nfs/dbraw/zinc/28/85/51/1040288551.db2.gz GPKOYVHFJQBFIK-GOSISDBHSA-N -1 3 347.842 4.353 20 0 EIADHM CCCc1cc(=O)[n-]c(C(=Cc2ccc(OCC)c(F)c2)CC)n1 ZINC000435338973 1040295362 /nfs/dbraw/zinc/29/53/62/1040295362.db2.gz MFGHQAOVSJJGCI-GXDHUFHOSA-N -1 3 330.403 4.211 20 0 EIADHM CC[C@H](C)Oc1cc(C)ccc1CNC(=O)c1cc([O-])ccc1Cl ZINC000551562479 1040413638 /nfs/dbraw/zinc/41/36/38/1040413638.db2.gz GGWAQDQRNAXITM-ZDUSSCGKSA-N -1 3 347.842 4.461 20 0 EIADHM Cc1ccc(-c2nc(=O)c3c(C4CCCCC4)csc3[n-]2)nn1 ZINC000668142573 1040520125 /nfs/dbraw/zinc/52/01/25/1040520125.db2.gz VYALRTXEQVJWKJ-UHFFFAOYSA-N -1 3 326.425 4.210 20 0 EIADHM Cc1cccc(C(=O)Nc2c(-c3ccccc3)nc3ccccn32)c1[O-] ZINC000553901643 1040611819 /nfs/dbraw/zinc/61/18/19/1040611819.db2.gz PRXIZHMJMGUQDM-UHFFFAOYSA-N -1 3 343.386 4.268 20 0 EIADHM Oc1[n-]c(SCc2ccc(-c3ccsc3)cc2)nc2nncc1-2 ZINC000435796669 1040627109 /nfs/dbraw/zinc/62/71/09/1040627109.db2.gz ILGWVSPYHPDSQY-UHFFFAOYSA-N -1 3 340.433 4.079 20 0 EIADHM Cc1cnc([C@H](NC(=O)c2cc([O-])c3ccccc3c2)C2CC2)s1 ZINC000350006478 1040841869 /nfs/dbraw/zinc/84/18/69/1040841869.db2.gz UXRMRDLGEBYVKR-QGZVFWFLSA-N -1 3 338.432 4.191 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2c(C)cccc2C)cc1C(F)(F)F ZINC000303030302 1040914565 /nfs/dbraw/zinc/91/45/65/1040914565.db2.gz POIWMODXNCLIHJ-UHFFFAOYSA-N -1 3 343.370 4.431 20 0 EIADHM O=C(Nc1n[n-]c(-c2ccco2)n1)c1ccccc1Oc1ccccc1 ZINC000484034446 1041093974 /nfs/dbraw/zinc/09/39/74/1041093974.db2.gz LETGMDTZXXHRRG-UHFFFAOYSA-N -1 3 346.346 4.109 20 0 EIADHM O=C(Nc1n[n-]c(-c2ccco2)n1)c1ccccc1Nc1ccccc1 ZINC000484107948 1041129010 /nfs/dbraw/zinc/12/90/10/1041129010.db2.gz MUEDQJAGJLDBQG-UHFFFAOYSA-N -1 3 345.362 4.061 20 0 EIADHM O=C(OCc1ccccc1Br)c1cccc(Cl)c1[O-] ZINC001126970971 1041170041 /nfs/dbraw/zinc/17/00/41/1041170041.db2.gz KBYSCUNAGDPKTD-UHFFFAOYSA-N -1 3 341.588 4.165 20 0 EIADHM O=C(Nc1ncccc1[O-])c1ccc(Oc2ccc(F)cc2F)cc1 ZINC000484443167 1041239374 /nfs/dbraw/zinc/23/93/74/1041239374.db2.gz RCTGHUZGLTWVNI-UHFFFAOYSA-N -1 3 342.301 4.110 20 0 EIADHM Cc1ccc(C(=O)Nc2cccc(NC(=O)c3ccccc3)c2)c([O-])c1 ZINC000436510670 1041295133 /nfs/dbraw/zinc/29/51/33/1041295133.db2.gz JJCWEGGOGFYFFT-UHFFFAOYSA-N -1 3 346.386 4.205 20 0 EIADHM Cc1cccc([C@@H](CC(=O)[O-])NCc2csc(C(F)(F)F)c2)c1 ZINC000904044469 1041298670 /nfs/dbraw/zinc/29/86/70/1041298670.db2.gz APYJHLNHTWIUSK-CYBMUJFWSA-N -1 3 343.370 4.381 20 0 EIADHM COc1ccc(C(=O)NC(c2cccs2)c2cccs2)c([O-])c1 ZINC000436534415 1041318745 /nfs/dbraw/zinc/31/87/45/1041318745.db2.gz HYBDMXWEJSIJED-UHFFFAOYSA-N -1 3 345.445 4.043 20 0 EIADHM Cc1ccc(C(=O)Nc2ccc(Oc3ncccn3)cc2C)c([O-])c1C ZINC000436546740 1041323672 /nfs/dbraw/zinc/32/36/72/1041323672.db2.gz LGBULJUNPNWQAZ-UHFFFAOYSA-N -1 3 349.390 4.152 20 0 EIADHM O=S(=O)([N-]c1cccc(Cl)c1F)c1ccc(C(F)F)cc1 ZINC000554685899 1041325216 /nfs/dbraw/zinc/32/52/16/1041325216.db2.gz TZKDTYGHTBZQSM-UHFFFAOYSA-N -1 3 335.734 4.218 20 0 EIADHM Cc1ccc(C(=O)N2CCCc3cc(OC(F)F)ccc32)c([O-])c1C ZINC000436549780 1041326336 /nfs/dbraw/zinc/32/63/36/1041326336.db2.gz QKLUZNIVGAJOMJ-UHFFFAOYSA-N -1 3 347.361 4.203 20 0 EIADHM Cc1ccc(C(=O)N2CCc3[nH]c4ccc(Cl)cc4c3C2)c([O-])c1 ZINC000436552293 1041328612 /nfs/dbraw/zinc/32/86/12/1041328612.db2.gz BPPUHVTYAOAEMB-UHFFFAOYSA-N -1 3 340.810 4.034 20 0 EIADHM CC(C)OCCCN(C)C(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436563269 1041344260 /nfs/dbraw/zinc/34/42/60/1041344260.db2.gz PHGCFMLQKPGPBK-UHFFFAOYSA-N -1 3 343.423 4.072 20 0 EIADHM O=C(c1cc(Oc2ccccc2)ccc1[O-])N1CCC(C(F)F)CC1 ZINC000436593596 1041351858 /nfs/dbraw/zinc/35/18/58/1041351858.db2.gz BRMZLOJXZMTBJH-UHFFFAOYSA-N -1 3 347.361 4.302 20 0 EIADHM O=C(c1ccccc1[O-])N1CCC(c2ccccc2C(F)(F)F)CC1 ZINC000436581206 1041359670 /nfs/dbraw/zinc/35/96/70/1041359670.db2.gz AEOYJUVMJVJNSQ-UHFFFAOYSA-N -1 3 349.352 4.431 20 0 EIADHM CCc1ccc([C@@H]2CCCCN2CCOc2ccccc2C(=O)[O-])o1 ZINC000516076652 1041380048 /nfs/dbraw/zinc/38/00/48/1041380048.db2.gz UXXYIPMCPSNEMQ-KRWDZBQOSA-N -1 3 343.423 4.146 20 0 EIADHM [O-]c1ccc(Cc2nc(-c3c(Cl)cccc3Cl)no2)cc1F ZINC000904308522 1041428003 /nfs/dbraw/zinc/42/80/03/1041428003.db2.gz LWBSMELIOXDVPI-UHFFFAOYSA-N -1 3 339.153 4.479 20 0 EIADHM Cc1ccc(C(=O)N2CC=C(c3ccccc3Cl)CC2)c([O-])c1 ZINC000436699348 1041431883 /nfs/dbraw/zinc/43/18/83/1041431883.db2.gz UOUYUIDQFWEMHP-UHFFFAOYSA-N -1 3 327.811 4.284 20 0 EIADHM CCOCc1nc(=O)c2c3c(sc2[n-]1)C[C@@H](c1ccccc1)CC3 ZINC000463230621 1041437034 /nfs/dbraw/zinc/43/70/34/1041437034.db2.gz IRVPLFDTMJTLDV-ZDUSSCGKSA-N -1 3 340.448 4.206 20 0 EIADHM O=C([N-]c1csnc1-c1ccccc1)c1cc(F)c(F)cc1F ZINC000436723962 1041444299 /nfs/dbraw/zinc/44/42/99/1041444299.db2.gz OWKZLIMFKIONKX-UHFFFAOYSA-N -1 3 334.322 4.480 20 0 EIADHM O=C(c1ccccc1[O-])N1CCC(F)(c2cccc(Cl)c2)CC1 ZINC000436752207 1041463937 /nfs/dbraw/zinc/46/39/37/1041463937.db2.gz XGTPIMSNOZBLNW-UHFFFAOYSA-N -1 3 333.790 4.147 20 0 EIADHM CC(C)c1nn(C)cc1-c1noc(-c2cc3ccccc3cc2[O-])n1 ZINC000436777786 1041472236 /nfs/dbraw/zinc/47/22/36/1041472236.db2.gz DQZLUBLVAFDGRQ-UHFFFAOYSA-N -1 3 334.379 4.119 20 0 EIADHM O=C(Nc1cnn(C(F)F)c1)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436764990 1041474635 /nfs/dbraw/zinc/47/46/35/1041474635.db2.gz AEVNPAYGOMAXML-UHFFFAOYSA-N -1 3 345.305 4.028 20 0 EIADHM CC(C)c1cc(C(=O)Nc2cc(F)ccc2[O-])nn1-c1ccccc1 ZINC000436794115 1041484984 /nfs/dbraw/zinc/48/49/84/1041484984.db2.gz AACDPADLEBCYMW-UHFFFAOYSA-N -1 3 339.370 4.093 20 0 EIADHM Cc1ccc(CSCc2noc(-c3ccccc3[O-])n2)cc1C ZINC000436804258 1041489141 /nfs/dbraw/zinc/48/91/41/1041489141.db2.gz BIFRJRNMOBLAHI-UHFFFAOYSA-N -1 3 326.421 4.492 20 0 EIADHM COC[C@@H](C)Oc1ccc(Cl)cc1NC(=O)c1ccc(C)cc1[O-] ZINC000436819954 1041501721 /nfs/dbraw/zinc/50/17/21/1041501721.db2.gz KENZOAHALDFLLT-GFCCVEGCSA-N -1 3 349.814 4.020 20 0 EIADHM [O-]c1ccccc1-c1nc(CSCCCc2ccccc2)no1 ZINC000436822693 1041501938 /nfs/dbraw/zinc/50/19/38/1041501938.db2.gz WLCBJALWBWSUDY-UHFFFAOYSA-N -1 3 326.421 4.308 20 0 EIADHM Cc1c(NC(=O)c2cc3c(cc2[O-])CCCC3)cccc1-c1ncco1 ZINC000436824924 1041504857 /nfs/dbraw/zinc/50/48/57/1041504857.db2.gz JDKAEPNZKCVBSE-UHFFFAOYSA-N -1 3 348.402 4.487 20 0 EIADHM CCc1ccc(-c2nc(CCCOc3ccc(F)cc3)no2)c([O-])c1 ZINC000436849333 1041517523 /nfs/dbraw/zinc/51/75/23/1041517523.db2.gz RZBNRMKYKMUABV-UHFFFAOYSA-N -1 3 342.370 4.155 20 0 EIADHM CCc1ccc([O-])c(C(=O)N2CCCCC[C@H]2[C@@H]2CCCCC2=O)c1 ZINC000538784917 1041542088 /nfs/dbraw/zinc/54/20/88/1041542088.db2.gz QVMADPFZVWPUBA-WMZOPIPTSA-N -1 3 343.467 4.099 20 0 EIADHM COc1ccc(N(CCC(C)C)C(=O)c2cccc(OC)c2[O-])cc1 ZINC000436905534 1041546866 /nfs/dbraw/zinc/54/68/66/1041546866.db2.gz AKNDYFBZVOOUOS-UHFFFAOYSA-N -1 3 343.423 4.102 20 0 EIADHM CCOc1ccc(-c2noc(-c3ccc(C(C)C)cc3[O-])n2)cn1 ZINC000436918720 1041557754 /nfs/dbraw/zinc/55/77/54/1041557754.db2.gz JSPWCSVZQKHZKE-UHFFFAOYSA-N -1 3 325.368 4.026 20 0 EIADHM COc1cccc(C(=O)Nc2cccc(COC(C)(C)C)c2C)c1[O-] ZINC000436921726 1041559396 /nfs/dbraw/zinc/55/93/96/1041559396.db2.gz KYOWIUPFKBZCSZ-UHFFFAOYSA-N -1 3 343.423 4.277 20 0 EIADHM CC(C)c1ccc(-c2nc(-c3ccc4nccnc4c3)no2)c([O-])c1 ZINC000436933910 1041565725 /nfs/dbraw/zinc/56/57/25/1041565725.db2.gz VXVXBTDIGTUJOJ-UHFFFAOYSA-N -1 3 332.363 4.176 20 0 EIADHM CC(C)c1ccc(C(=O)N(C)[C@@H](c2ncc[nH]2)c2ccccc2)c([O-])c1 ZINC000436968909 1041571302 /nfs/dbraw/zinc/57/13/02/1041571302.db2.gz VUHNXKWPFJBGNN-LJQANCHMSA-N -1 3 349.434 4.100 20 0 EIADHM CC(C)c1ccc(-c2nc(COc3ccccc3F)no2)c([O-])c1 ZINC000437002312 1041595595 /nfs/dbraw/zinc/59/55/95/1041595595.db2.gz XERSYOSVDSLSMX-UHFFFAOYSA-N -1 3 328.343 4.284 20 0 EIADHM CSc1ccc(S(=O)(=O)[N-]c2ccc(F)cc2F)cc1Cl ZINC000463524441 1041604460 /nfs/dbraw/zinc/60/44/60/1041604460.db2.gz QDKSTDMUFGXYCL-UHFFFAOYSA-N -1 3 349.811 4.141 20 0 EIADHM Cc1ccc(Cl)c([N-]S(=O)(=O)c2ccccc2-c2ccno2)c1 ZINC000541085025 1041804044 /nfs/dbraw/zinc/80/40/44/1041804044.db2.gz UYYKULLTYBVKLG-UHFFFAOYSA-N -1 3 348.811 4.104 20 0 EIADHM COc1cccc(C(=O)Nc2ccc(OCc3ccccc3)cc2)c1[O-] ZINC000301944571 1042039013 /nfs/dbraw/zinc/03/90/13/1042039013.db2.gz IYEDPFPOJDFXAD-UHFFFAOYSA-N -1 3 349.386 4.232 20 0 EIADHM CC(C)Sc1ccccc1C(=O)N=c1cc(-c2ccccc2)[n-][nH]1 ZINC000541774847 1042099324 /nfs/dbraw/zinc/09/93/24/1042099324.db2.gz NEBQYJZKLUPYCO-UHFFFAOYSA-N -1 3 337.448 4.251 20 0 EIADHM O=C(NCc1ncccc1[O-])c1csc(-c2ccc(Cl)cc2)c1 ZINC000510126271 1042204101 /nfs/dbraw/zinc/20/41/01/1042204101.db2.gz ATXXUHNLPLRNEY-UHFFFAOYSA-N -1 3 344.823 4.099 20 0 EIADHM Cc1cc(F)ccc1S(=O)(=O)[N-]c1cccc(CC(F)(F)F)c1 ZINC000438754926 1042334128 /nfs/dbraw/zinc/33/41/28/1042334128.db2.gz LNRFUIVMCSMIBC-UHFFFAOYSA-N -1 3 347.333 4.040 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@H]3CCc4c3cccc4C)nc2)n1 ZINC000518317548 1042465044 /nfs/dbraw/zinc/46/50/44/1042465044.db2.gz UFQKKFQKUNSANX-SFHVURJKSA-N -1 3 346.434 4.214 20 0 EIADHM CC=C(C=CC(=O)Nc1cccc(-c2nc(CC)cc(=O)[n-]2)c1)CC ZINC000492111304 1042559093 /nfs/dbraw/zinc/55/90/93/1042559093.db2.gz LSZWLDMASIPJEP-XMBQOZGZSA-N -1 3 337.423 4.263 20 0 EIADHM CC(C)C1CCN(Cc2cc(Br)ccc2C(=O)[O-])CC1 ZINC000578448402 1042561488 /nfs/dbraw/zinc/56/14/88/1042561488.db2.gz WAVBPWTVJROXNW-UHFFFAOYSA-N -1 3 340.261 4.015 20 0 EIADHM CCCOc1ccc(S(=O)(=O)[N-]c2cccc(C(F)F)c2)cc1 ZINC000509611381 1042689729 /nfs/dbraw/zinc/68/97/29/1042689729.db2.gz PKWRPDKQLIOKMJ-UHFFFAOYSA-N -1 3 341.379 4.214 20 0 EIADHM O=c1nc(CN2CC[C@@H]3CCC[C@H]32)[n-]c2scc(-c3ccco3)c21 ZINC000426461856 1042728507 /nfs/dbraw/zinc/72/85/07/1042728507.db2.gz PSZHHFTXWZSTAI-WCQYABFASA-N -1 3 341.436 4.031 20 0 EIADHM O=C(NCCc1cc2ccccc2s1)c1cc([O-])ccc1Cl ZINC000506698531 1042790354 /nfs/dbraw/zinc/79/03/54/1042790354.db2.gz HOXQXFDWJAMGIQ-UHFFFAOYSA-N -1 3 331.824 4.233 20 0 EIADHM Cc1cc(S(=O)(=O)[N-]c2cc(F)c(F)cc2Cl)c(C)s1 ZINC000176727731 1042816776 /nfs/dbraw/zinc/81/67/76/1042816776.db2.gz KJHGQPUAVFXRCA-UHFFFAOYSA-N -1 3 337.800 4.097 20 0 EIADHM CCn1ncc2ccc(NC(=O)c3cc([O-])cc(C(F)(F)F)c3)cc21 ZINC000646780254 1042866510 /nfs/dbraw/zinc/86/65/10/1042866510.db2.gz ZYKZAXWLEJIPHH-UHFFFAOYSA-N -1 3 349.312 4.033 20 0 EIADHM Cc1oc(-c2ccccc2)nc1Cc1noc(-c2ccc(C)cc2[O-])n1 ZINC000761501761 1042871572 /nfs/dbraw/zinc/87/15/72/1042871572.db2.gz GPGHWZVWYJXFQV-UHFFFAOYSA-N -1 3 347.374 4.305 20 0 EIADHM O=C([N-]c1cc(Cl)cc(F)c1F)c1cnc([C@@H]2CCCO2)s1 ZINC000441567777 1042886371 /nfs/dbraw/zinc/88/63/71/1042886371.db2.gz FTWFZEYAWCDMGG-JTQLQIEISA-N -1 3 344.770 4.179 20 0 EIADHM CCCCOc1ccccc1CN[C@H]1C[C@H](C(=O)[O-])c2ccccc21 ZINC000417628645 1042915175 /nfs/dbraw/zinc/91/51/75/1042915175.db2.gz PPJFWSBOGPMKKR-OALUTQOASA-N -1 3 339.435 4.268 20 0 EIADHM CC[C@H]1CC[C@H](C)N1Cc1csc(-c2ccc(C(=O)[O-])cc2)n1 ZINC000520594938 1042917556 /nfs/dbraw/zinc/91/75/56/1042917556.db2.gz YHACEVPGKUKKBP-LRDDRELGSA-N -1 3 330.453 4.271 20 0 EIADHM Cc1cc(=O)[n-]c([C@H](C)N2CC[C@@H](Sc3cccc(Cl)c3)C2)n1 ZINC000429140703 1043077595 /nfs/dbraw/zinc/07/75/95/1043077595.db2.gz ZWECZSGEEWUALB-SWLSCSKDSA-N -1 3 349.887 4.072 20 0 EIADHM Cc1ccc(NCc2cc([O-])cc(F)c2)c(OC[C@@H]2CCCO2)c1 ZINC000185488988 1043189151 /nfs/dbraw/zinc/18/91/51/1043189151.db2.gz JZTWESVQSSIKSL-KRWDZBQOSA-N -1 3 331.387 4.010 20 0 EIADHM Cc1cccc([C@@H]2CCCN2Cc2cccc([O-])c2Br)n1 ZINC000560576366 1043202333 /nfs/dbraw/zinc/20/23/33/1043202333.db2.gz RYLNDWNNRXWKPF-HNNXBMFYSA-N -1 3 347.256 4.195 20 0 EIADHM CCC1(C(=O)Nc2ccc(-c3nc(C)cc(=O)[n-]3)cc2)CCCCC1 ZINC000185780957 1043220096 /nfs/dbraw/zinc/22/00/96/1043220096.db2.gz LRZATMOQUGXZCD-UHFFFAOYSA-N -1 3 339.439 4.044 20 0 EIADHM O=C(NCCc1ccc(Cl)s1)c1cc([O-])c2ccccc2c1 ZINC000525914251 1043234310 /nfs/dbraw/zinc/23/43/10/1043234310.db2.gz ACUGAKJAVXQALT-UHFFFAOYSA-N -1 3 331.824 4.233 20 0 EIADHM CCCOCc1ccccc1CNC(=O)c1cc([O-])c2ccccc2c1 ZINC000525919150 1043234479 /nfs/dbraw/zinc/23/44/79/1043234479.db2.gz SLQFODYDIBWLCX-UHFFFAOYSA-N -1 3 349.430 4.402 20 0 EIADHM CCO[C@@H](CCNC(=O)c1cc([O-])c2ccccc2c1)C1CCCC1 ZINC000525935309 1043237205 /nfs/dbraw/zinc/23/72/05/1043237205.db2.gz GWXFYIDBCXVDAW-FQEVSTJZSA-N -1 3 341.451 4.261 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N1C[C@@H]2CCCN2c2ccccc21 ZINC000526876012 1043243853 /nfs/dbraw/zinc/24/38/53/1043243853.db2.gz NAIPUFANKUFVDA-KRWDZBQOSA-N -1 3 344.414 4.175 20 0 EIADHM O=C(NCCCCOCc1ccccc1)c1cc([O-])c2ccccc2c1 ZINC000527453569 1043262936 /nfs/dbraw/zinc/26/29/36/1043262936.db2.gz SIUHLYNFMQDEDW-UHFFFAOYSA-N -1 3 349.430 4.272 20 0 EIADHM CCO[C@H](CNC(=O)c1cc([O-])c2ccccc2c1)c1ccccc1 ZINC000527475126 1043262959 /nfs/dbraw/zinc/26/29/59/1043262959.db2.gz AHYCFYQAYHBTPB-HXUWFJFHSA-N -1 3 335.403 4.053 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N1CCS[C@H]2CCCC[C@@H]21 ZINC000527467578 1043263573 /nfs/dbraw/zinc/26/35/73/1043263573.db2.gz YWLSBPPGZHPUSQ-WMZOPIPTSA-N -1 3 327.449 4.046 20 0 EIADHM CC(C)(CCCc1ccccc1)C(=O)NCc1ccc([O-])c(F)c1 ZINC000427949241 1043271874 /nfs/dbraw/zinc/27/18/74/1043271874.db2.gz MDLFRHLLNYALLX-UHFFFAOYSA-N -1 3 329.415 4.197 20 0 EIADHM COc1cc(C)cc(NC(=O)CCCc2ccc([O-])c(F)c2)c1C ZINC000428091103 1043327718 /nfs/dbraw/zinc/32/77/18/1043327718.db2.gz KYDYAJGKBSBXRS-UHFFFAOYSA-N -1 3 331.387 4.118 20 0 EIADHM [O-]c1c(F)cc(F)cc1Nc1ncc(Br)cc1Cl ZINC001212477852 1043407606 /nfs/dbraw/zinc/40/76/06/1043407606.db2.gz OCAIFEDGAOOFSR-UHFFFAOYSA-N -1 3 335.535 4.225 20 0 EIADHM O=[S@](Cc1ccc(Br)c(Cl)c1)c1ccc([O-])cc1 ZINC000189100124 1043436297 /nfs/dbraw/zinc/43/62/97/1043436297.db2.gz BNWFQDDZYXVPOI-GOSISDBHSA-N -1 3 345.645 4.116 20 0 EIADHM CC(C)(C)c1cc(Nc2cc(F)cc(F)c2[O-])n(-c2cccnc2)n1 ZINC001212481797 1043456992 /nfs/dbraw/zinc/45/69/92/1043456992.db2.gz JNJZZPYWQIUBTK-UHFFFAOYSA-N -1 3 344.365 4.292 20 0 EIADHM CSc1ccncc1[N-]C(=O)c1csc(-c2ccc(C)o2)n1 ZINC000674258645 1043519992 /nfs/dbraw/zinc/51/99/92/1043519992.db2.gz VIEGJOOFTGJDHR-UHFFFAOYSA-N -1 3 331.422 4.081 20 0 EIADHM COc1cc(Br)cc(F)c1Nc1cc(F)cc(F)c1[O-] ZINC001212491745 1043610580 /nfs/dbraw/zinc/61/05/80/1043610580.db2.gz YZIPGPIOIVSDEF-UHFFFAOYSA-N -1 3 348.118 4.324 20 0 EIADHM CN(C(=O)c1nnc2ccccc2c1[O-])C1CCC(C(C)(C)C)CC1 ZINC000732269491 1043893315 /nfs/dbraw/zinc/89/33/15/1043893315.db2.gz UNBPHHWPVCRVDP-UHFFFAOYSA-N -1 3 341.455 4.012 20 0 EIADHM COc1ccc([O-])c(C(=O)Nc2ccc3nc(C4CC4)sc3c2)c1 ZINC000521796489 1043970760 /nfs/dbraw/zinc/97/07/60/1043970760.db2.gz MHOGZZDDDRBLPR-UHFFFAOYSA-N -1 3 340.404 4.140 20 0 EIADHM C[C@H](c1ccccc1F)N1CCC(C(=O)c2ccc([O-])cc2)CC1 ZINC000079949169 1044041741 /nfs/dbraw/zinc/04/17/41/1044041741.db2.gz DAZYGYPMJCDKQH-CQSZACIVSA-N -1 3 327.399 4.187 20 0 EIADHM Cc1noc2nc(C3CC3)cc(C(=O)Nc3cc(Cl)ccc3[O-])c12 ZINC000063803290 1044303800 /nfs/dbraw/zinc/30/38/00/1044303800.db2.gz SNXFGAKDSZRPSZ-UHFFFAOYSA-N -1 3 343.770 4.020 20 0 EIADHM [O-]c1ccc(-c2nc(-c3cc(Cl)cc(C(F)(F)F)c3)no2)nc1 ZINC001212557948 1044307150 /nfs/dbraw/zinc/30/71/50/1044307150.db2.gz JRODFQPRSQJYRQ-UHFFFAOYSA-N -1 3 341.676 4.176 20 0 EIADHM Cc1cccc(C(=O)Nc2ccc(NC(=O)OC(C)(C)C)cc2)c1[O-] ZINC000729536029 1044320580 /nfs/dbraw/zinc/32/05/80/1044320580.db2.gz SUKPUYAUOYRTIE-UHFFFAOYSA-N -1 3 342.395 4.300 20 0 EIADHM O=C(Nc1nc(-c2cccnc2)cs1)c1cc([O-])c2ccccc2c1 ZINC000358938305 1044396220 /nfs/dbraw/zinc/39/62/20/1044396220.db2.gz LASLPISLHAOWHA-UHFFFAOYSA-N -1 3 347.399 4.316 20 0 EIADHM CSc1nsc([N-]C(=O)c2oc3c(cccc3Cl)c2C)n1 ZINC000078713187 1044814791 /nfs/dbraw/zinc/81/47/91/1044814791.db2.gz OOTKTXAEKTWMRH-UHFFFAOYSA-N -1 3 339.829 4.220 20 0 EIADHM Cc1ccc(NC(=O)[C@@H](C)OC(=O)c2cc3ccsc3[n-]2)cc1C ZINC000914891253 1044852703 /nfs/dbraw/zinc/85/27/03/1044852703.db2.gz LIIMNFACXCBVFX-GFCCVEGCSA-N -1 3 342.420 4.030 20 0 EIADHM Cc1ccc(C)c(NC(=O)[C@H](C)OC(=O)c2cc3ccsc3[n-]2)c1 ZINC000914890324 1044852845 /nfs/dbraw/zinc/85/28/45/1044852845.db2.gz RNNFEGLJZDGRGU-LBPRGKRZSA-N -1 3 342.420 4.030 20 0 EIADHM CCOc1cc(CNc2cccc(OC)c2OC)cc(Cl)c1[O-] ZINC000895773420 1044885983 /nfs/dbraw/zinc/88/59/83/1044885983.db2.gz BNTLOKFJLNUSSO-UHFFFAOYSA-N -1 3 337.803 4.074 20 0 EIADHM CC[C@H]([N-]C(=O)C(F)(F)c1cccc(Cl)c1)c1nccs1 ZINC000737669909 1045017061 /nfs/dbraw/zinc/01/70/61/1045017061.db2.gz DINSXXQWEMTIOT-NSHDSACASA-N -1 3 330.787 4.156 20 0 EIADHM CSc1cccc(S(=O)(=O)[N-]c2cccc(Cl)c2F)c1 ZINC000509096160 1045114976 /nfs/dbraw/zinc/11/49/76/1045114976.db2.gz GADWPIWSUNVJHT-UHFFFAOYSA-N -1 3 331.821 4.002 20 0 EIADHM CC(C)(C(=O)[O-])[C@@H]1CCCN(Cc2c(Cl)cccc2Cl)C1 ZINC000135034031 1045196303 /nfs/dbraw/zinc/19/63/03/1045196303.db2.gz KMADWJXMFKCVLK-LLVKDONJSA-N -1 3 330.255 4.316 20 0 EIADHM [O-]c1cccc(CNc2ccccc2N2CCCC2)c1Br ZINC000315862412 1045412790 /nfs/dbraw/zinc/41/27/90/1045412790.db2.gz KGPVBIFZTMBINY-UHFFFAOYSA-N -1 3 347.256 4.367 20 0 EIADHM CC(C)(CCNCc1csc(-c2ccsc2)n1)CCC(=O)[O-] ZINC000316129399 1045416255 /nfs/dbraw/zinc/41/62/55/1045416255.db2.gz UEDHQZBQSZSSJT-UHFFFAOYSA-N -1 3 338.498 4.242 20 0 EIADHM COc1ccc([O-])c(-c2nc(-c3ccc(Cl)c(Cl)c3)no2)c1 ZINC000316819794 1045456100 /nfs/dbraw/zinc/45/61/00/1045456100.db2.gz KESFTMHUXPOAKI-UHFFFAOYSA-N -1 3 337.162 4.425 20 0 EIADHM CC(C)(C)C(=O)c1ccsc1[N-]C(=O)c1nc(Cl)cs1 ZINC000790916544 1045630463 /nfs/dbraw/zinc/63/04/63/1045630463.db2.gz UDQZOGWDQSMPCP-UHFFFAOYSA-N -1 3 328.846 4.339 20 0 EIADHM [O-]c1ccc(Nc2cc(F)c(Br)cc2F)c(F)c1F ZINC001212007561 1045827098 /nfs/dbraw/zinc/82/70/98/1045827098.db2.gz NFPQMODAWJWSHX-UHFFFAOYSA-N -1 3 336.082 4.455 20 0 EIADHM COC(=O)c1ccc(Nc2ccc([O-])c(F)c2F)c(C(F)(F)F)c1 ZINC001212007701 1045829484 /nfs/dbraw/zinc/82/94/84/1045829484.db2.gz YIGQXKFMNAPEMC-UHFFFAOYSA-N -1 3 347.239 4.219 20 0 EIADHM CC(C)(C)OC(=O)c1ccc(Nc2ccc([O-])c(F)c2F)cc1O ZINC001212013894 1045834661 /nfs/dbraw/zinc/83/46/61/1045834661.db2.gz OWAQWLNORHFCMH-UHFFFAOYSA-N -1 3 337.322 4.075 20 0 EIADHM [O-]c1ccc(Nc2cc(Br)cc(F)c2O)c(F)c1F ZINC001212014032 1045834769 /nfs/dbraw/zinc/83/47/69/1045834769.db2.gz WCJQKAGDROHBOE-UHFFFAOYSA-N -1 3 334.091 4.021 20 0 EIADHM CC(=O)Nc1ccc(Nc2ccc([O-])c(F)c2F)c(C(F)(F)F)c1 ZINC001212013947 1045835784 /nfs/dbraw/zinc/83/57/84/1045835784.db2.gz QVOLTUSKTYRZOB-UHFFFAOYSA-N -1 3 346.255 4.391 20 0 EIADHM [O-]c1ccc(Nc2c(F)cccc2OC[C@@H]2CCCO2)c(F)c1F ZINC001212016540 1045840902 /nfs/dbraw/zinc/84/09/02/1045840902.db2.gz VCSGZCNJYIAZMH-JTQLQIEISA-N -1 3 339.313 4.111 20 0 EIADHM CC(C)Oc1cccc(CNC(=O)c2cc([O-])c3ccccc3c2)c1 ZINC000792066759 1045852637 /nfs/dbraw/zinc/85/26/37/1045852637.db2.gz IMBYONXVRGOUKQ-UHFFFAOYSA-N -1 3 335.403 4.263 20 0 EIADHM CC(C)Oc1cc(O)ccc1NC(=O)c1cc([O-])c2ccccc2c1 ZINC000792488128 1045902892 /nfs/dbraw/zinc/90/28/92/1045902892.db2.gz ZHCPDQPZHTTZIV-UHFFFAOYSA-N -1 3 337.375 4.291 20 0 EIADHM Cc1cc(NC(=O)c2cccc3n[n-]nc32)ccc1-c1ccccc1 ZINC000792836339 1046075780 /nfs/dbraw/zinc/07/57/80/1046075780.db2.gz OXMZOWGWKPBHMC-UHFFFAOYSA-N -1 3 328.375 4.186 20 0 EIADHM CCc1cccc(C(=O)N2CCC[C@H]2c2ccc(F)c(F)c2)c1[O-] ZINC000769829931 1046087963 /nfs/dbraw/zinc/08/79/63/1046087963.db2.gz BVESEYFJNFGRCN-KRWDZBQOSA-N -1 3 331.362 4.210 20 0 EIADHM CS/C=C/C(=O)Nc1ccc([O-])c(-c2nc3ccccc3s2)c1 ZINC000770079489 1046143001 /nfs/dbraw/zinc/14/30/01/1046143001.db2.gz KPIPHZHAQKSNIC-CMDGGOBGSA-N -1 3 342.445 4.484 20 0 EIADHM O=C([N-]OCc1cccnc1)C1(Cc2cccc(Cl)c2)CCCC1 ZINC000747169956 1046362630 /nfs/dbraw/zinc/36/26/30/1046362630.db2.gz NSJQCBRBFLUDAH-UHFFFAOYSA-N -1 3 344.842 4.086 20 0 EIADHM Cc1sc2[n-]c([C@@H](C)OC(=O)C3=C(C)CCC3)nc(=O)c2c1C ZINC000747166966 1046363038 /nfs/dbraw/zinc/36/30/38/1046363038.db2.gz HXWUHWXNAXTYNU-SNVBAGLBSA-N -1 3 332.425 4.118 20 0 EIADHM Cc1nc([C@@H](C)N(C)CCCC(=O)[O-])oc1-c1ccc(Cl)cc1 ZINC000455646417 1046380996 /nfs/dbraw/zinc/38/09/96/1046380996.db2.gz PVXCBWQCKJWRII-GFCCVEGCSA-N -1 3 336.819 4.161 20 0 EIADHM O=C(c1cc(CCc2ccccc2)ccc1[O-])N1CCC(F)(F)CC1 ZINC000794295860 1046397654 /nfs/dbraw/zinc/39/76/54/1046397654.db2.gz XPPOKUVJGXVPQG-UHFFFAOYSA-N -1 3 345.389 4.049 20 0 EIADHM [O-]c1cc2ccccc2cc1-c1nc(Cc2ccc3c[nH]nc3c2)no1 ZINC000771476656 1046408432 /nfs/dbraw/zinc/40/84/32/1046408432.db2.gz ASHNEJZGMGWKHA-UHFFFAOYSA-N -1 3 342.358 4.063 20 0 EIADHM O=C(OCc1ccc(OC(F)F)c(F)c1)c1cccc(Cl)c1[O-] ZINC001129428122 1046442611 /nfs/dbraw/zinc/44/26/11/1046442611.db2.gz HFWWXYBCDUFCES-UHFFFAOYSA-N -1 3 346.688 4.143 20 0 EIADHM C[C@H]1Cc2ccccc2[C@@H]1NCc1cccc([O-])c1Br ZINC000459413372 1046634966 /nfs/dbraw/zinc/63/49/66/1046634966.db2.gz WZWHXXAVTSHWNO-APPDUMDISA-N -1 3 332.241 4.178 20 0 EIADHM CC1(C)CN(Cc2cccc([O-])c2Br)[C@H]1c1cccnc1 ZINC000459561725 1046777043 /nfs/dbraw/zinc/77/70/43/1046777043.db2.gz RWBAZNFWPAIFBI-INIZCTEOSA-N -1 3 347.256 4.133 20 0 EIADHM COc1cc(C(=O)Nc2cccc([O-])c2F)ccc1OC1CCCC1 ZINC000128199547 1046780582 /nfs/dbraw/zinc/78/05/82/1046780582.db2.gz OBQPJNIHCGBSDI-UHFFFAOYSA-N -1 3 345.370 4.114 20 0 EIADHM O=C(Nc1cccc([O-])c1F)c1cc(-c2cccc(Cl)c2)on1 ZINC000128237051 1046785656 /nfs/dbraw/zinc/78/56/56/1046785656.db2.gz OQTNYKYQUURGEO-UHFFFAOYSA-N -1 3 332.718 4.092 20 0 EIADHM O=C(COC(=O)c1cc2occc2[n-]1)c1ccc(Cl)c(Cl)c1 ZINC000786029487 1046796579 /nfs/dbraw/zinc/79/65/79/1046796579.db2.gz DPCWZFGTOZFVSQ-UHFFFAOYSA-N -1 3 338.146 4.107 20 0 EIADHM CC[C@H](C)c1ccc(NC(=O)COC(=O)c2cc3occc3[n-]2)cc1 ZINC000786030895 1046804030 /nfs/dbraw/zinc/80/40/30/1046804030.db2.gz HVLSFGDPIHSWQI-LBPRGKRZSA-N -1 3 340.379 4.070 20 0 EIADHM C[C@H](O)c1cc(NC(=O)c2cc3sccc3c([O-])c2)ccc1F ZINC000804802354 1046807219 /nfs/dbraw/zinc/80/72/19/1046807219.db2.gz HRIIIDMNALBPBZ-VIFPVBQESA-N -1 3 331.368 4.052 20 0 EIADHM CC(C)c1noc([C@H](C)OC(=O)c2cc3sccc3c([O-])c2)n1 ZINC000786131109 1046814222 /nfs/dbraw/zinc/81/42/22/1046814222.db2.gz LDRLLMFWBFEPQR-VIFPVBQESA-N -1 3 332.381 4.031 20 0 EIADHM O=C(CCn1ccc2cc(Cl)ccc21)Nc1cccc([O-])c1F ZINC000128330424 1046821104 /nfs/dbraw/zinc/82/11/04/1046821104.db2.gz DTVIOTLXUKAHOZ-UHFFFAOYSA-N -1 3 332.762 4.168 20 0 EIADHM O=C(CCSc1ccccc1Cl)Nc1cccc([O-])c1F ZINC000128462134 1046878523 /nfs/dbraw/zinc/87/85/23/1046878523.db2.gz SZZATIZIZSUVQG-UHFFFAOYSA-N -1 3 325.792 4.306 20 0 EIADHM Cc1nocc1[N-]C(=O)c1sc(-c2ccc(C)cc2F)nc1C ZINC001130357135 1047011130 /nfs/dbraw/zinc/01/11/30/1047011130.db2.gz SQKUWQKOFMPWHK-UHFFFAOYSA-N -1 3 331.372 4.115 20 0 EIADHM C[C@@]1(CNC(=O)c2cc([O-])ccc2Cl)CCCc2ccccc21 ZINC000497766717 1047056816 /nfs/dbraw/zinc/05/68/16/1047056816.db2.gz NYMLNISFJCRZDX-IBGZPJMESA-N -1 3 329.827 4.070 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)OCc1ccc2ccccc2n1 ZINC000787845795 1047059707 /nfs/dbraw/zinc/05/97/07/1047059707.db2.gz PIBRPLMEQFMCMQ-UHFFFAOYSA-N -1 3 339.366 4.146 20 0 EIADHM O=C(NC12CC3CC(CC(C3)C1)C2)c1cc2sccc2c([O-])c1 ZINC000788274624 1047154140 /nfs/dbraw/zinc/15/41/40/1047154140.db2.gz PTIREGQZNDCPEM-UHFFFAOYSA-N -1 3 327.449 4.306 20 0 EIADHM CCC(CC)c1cc(CNC(=O)c2cc3sccc3c([O-])c2)on1 ZINC000788305430 1047154613 /nfs/dbraw/zinc/15/46/13/1047154613.db2.gz INMUVUMCOXKXRE-UHFFFAOYSA-N -1 3 344.436 4.429 20 0 EIADHM O=C(Nc1cccc([O-])c1F)[C@@H]1C[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000129261822 1047341738 /nfs/dbraw/zinc/34/17/38/1047341738.db2.gz SMTMGXIKERQVKC-VXGBXAGGSA-N -1 3 339.288 4.292 20 0 EIADHM Cc1c2cc(F)ccc2oc1C(=O)[N-]c1nc(CC(C)C)ns1 ZINC001130845265 1047413261 /nfs/dbraw/zinc/41/32/61/1047413261.db2.gz CDJLLIYXMSTNTC-UHFFFAOYSA-N -1 3 333.388 4.183 20 0 EIADHM O=C(NCCCCCOC1CCCCC1)c1cc([O-])ccc1Cl ZINC000556061945 1047427539 /nfs/dbraw/zinc/42/75/39/1047427539.db2.gz GGHYYZUBLFVMHD-UHFFFAOYSA-N -1 3 339.863 4.295 20 0 EIADHM CCCOc1nc(C(=O)Nc2cccc([O-])c2F)cc2ccccc21 ZINC000129568677 1047433910 /nfs/dbraw/zinc/43/39/10/1047433910.db2.gz CDRWSQWHMSJCCW-UHFFFAOYSA-N -1 3 340.354 4.121 20 0 EIADHM COc1ccc2sc(C(=O)Nc3cccc([O-])c3F)c(C)c2c1 ZINC000129758085 1047504175 /nfs/dbraw/zinc/50/41/75/1047504175.db2.gz XJPZXNSQUUXCSZ-UHFFFAOYSA-N -1 3 331.368 4.315 20 0 EIADHM CC[C@@H](C)Sc1ccc([N-]S(=O)(=O)CC)c(C(F)(F)F)c1 ZINC000130144266 1047618296 /nfs/dbraw/zinc/61/82/96/1047618296.db2.gz QLWGZQQWRLKJKY-SECBINFHSA-N -1 3 341.420 4.358 20 0 EIADHM O=C([N-]c1nc(Cc2ccccc2)ns1)c1cc(Cl)ccc1F ZINC000107198984 1047714403 /nfs/dbraw/zinc/71/44/03/1047714403.db2.gz UURBPOVQWCPBKI-UHFFFAOYSA-N -1 3 347.802 4.174 20 0 EIADHM COc1ccc(C(=O)N[C@H](C)c2cccc(Cl)c2Cl)c([O-])c1 ZINC001136884843 1047875423 /nfs/dbraw/zinc/87/54/23/1047875423.db2.gz VNHQMVVTZMHUFU-SECBINFHSA-N -1 3 340.206 4.199 20 0 EIADHM O=S(=O)(/C=C/c1cccc(Cl)c1)[N-]c1cc(F)cc(F)c1F ZINC000814212187 1047890012 /nfs/dbraw/zinc/89/00/12/1047890012.db2.gz HTTVOZPQFOOAEQ-SNAWJCMRSA-N -1 3 347.745 4.170 20 0 EIADHM Cc1nc(C(C)C)oc1C(=O)[N-]c1nnc(C2CCCCC2)s1 ZINC000814347711 1047996173 /nfs/dbraw/zinc/99/61/73/1047996173.db2.gz VVCJVGNPLKAPSD-UHFFFAOYSA-N -1 3 334.445 4.258 20 0 EIADHM CC(=O)c1cccc(NC(=O)[C@@H](C)Sc2ccc(C)cc2)c1[O-] ZINC000556894351 1048118183 /nfs/dbraw/zinc/11/81/83/1048118183.db2.gz YQRVPXJKLHPXPG-CYBMUJFWSA-N -1 3 329.421 4.023 20 0 EIADHM CC(=O)c1cccc(NC(=O)c2ccc(SC(C)C)cc2)c1[O-] ZINC000556891497 1048134164 /nfs/dbraw/zinc/13/41/64/1048134164.db2.gz BGIKZFPZYAGYCU-UHFFFAOYSA-N -1 3 329.421 4.348 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)[C@H]1C[C@@H]1c1cccc2ccccc21 ZINC000132667054 1048403637 /nfs/dbraw/zinc/40/36/37/1048403637.db2.gz VAXYOYNZFCLSDO-MSOLQXFVSA-N -1 3 335.378 4.104 20 0 EIADHM CCCC[C@H](NC(=O)Cc1ccc([O-])c(F)c1)c1ccc(OC)cc1 ZINC001144144326 1048449559 /nfs/dbraw/zinc/44/95/59/1048449559.db2.gz UQLYIUNVNYXQOU-SFHVURJKSA-N -1 3 345.414 4.130 20 0 EIADHM C[C@H](NC(=O)c1cc([O-])ccc1Cl)c1nc2ccccc2s1 ZINC000810407394 1048791852 /nfs/dbraw/zinc/79/18/52/1048791852.db2.gz RWMHIABIOUPWDM-VIFPVBQESA-N -1 3 332.812 4.146 20 0 EIADHM O=C([N-][C@@H]1CCc2cc(Cl)ccc21)C(F)(F)c1ccc(F)cc1 ZINC000920844131 1048802354 /nfs/dbraw/zinc/80/23/54/1048802354.db2.gz AZYQUEFRMJDBPX-OAHLLOKOSA-N -1 3 339.744 4.375 20 0 EIADHM Cc1ccc(C)c(NC(=O)c2c[n-]c(=NC(=O)OC(C)(C)C)s2)c1 ZINC001135601645 1048814632 /nfs/dbraw/zinc/81/46/32/1048814632.db2.gz NMVQPEFGVNWDHI-UHFFFAOYSA-N -1 3 347.440 4.359 20 0 EIADHM C[C@H]1C[C@H]1c1ccc(C[N-]C(=O)C(F)(F)c2cccc(Cl)c2)o1 ZINC000921004285 1048836187 /nfs/dbraw/zinc/83/61/87/1048836187.db2.gz CNIMXMYTHOGUOW-IINYFYTJSA-N -1 3 339.769 4.465 20 0 EIADHM CC(=O)c1cccc(NC(=O)c2cc3cccc(Cl)c3o2)c1[O-] ZINC000816620915 1048845669 /nfs/dbraw/zinc/84/56/69/1048845669.db2.gz QLSMCAVKKSLYLZ-UHFFFAOYSA-N -1 3 329.739 4.247 20 0 EIADHM C[C@H](CC1CCOCC1)OC(=O)c1cc2cc(Cl)sc2[n-]1 ZINC000810877550 1048881711 /nfs/dbraw/zinc/88/17/11/1048881711.db2.gz ZNQZGMXECBCODH-SECBINFHSA-N -1 3 327.833 4.245 20 0 EIADHM CCSc1ccc(Cl)cc1NC(=O)c1cccc(OC)c1[O-] ZINC001144884687 1048882966 /nfs/dbraw/zinc/88/29/66/1048882966.db2.gz VEZHFLVHIJQNSY-UHFFFAOYSA-N -1 3 337.828 4.419 20 0 EIADHM CC[C@@H](C)CO[N-]C(=O)C12C[C@H]3C[C@@H](C1)CC(C(F)(F)F)(C3)C2 ZINC000816976363 1048884562 /nfs/dbraw/zinc/88/45/62/1048884562.db2.gz BRMOXCQZEPQZAM-XEUBVLPRSA-N -1 3 333.394 4.229 20 0 EIADHM O=C([N-]OCCC1CC1)[C@@H]1CC=CC[C@@H]1c1nc2ccccc2s1 ZINC000817388530 1048967272 /nfs/dbraw/zinc/96/72/72/1048967272.db2.gz YMZUXNMYJKHLNU-CABCVRRESA-N -1 3 342.464 4.194 20 0 EIADHM CC(F)(F)CC[N-]C(=O)C(F)(F)c1cc(Cl)ccc1Cl ZINC000817454722 1048969565 /nfs/dbraw/zinc/96/95/65/1048969565.db2.gz QTXAHMGVDJKRNS-UHFFFAOYSA-N -1 3 332.124 4.247 20 0 EIADHM CCc1cccc(C(=O)N2CCCC[C@@H]2Cc2ccccc2F)c1[O-] ZINC001146201545 1049009593 /nfs/dbraw/zinc/00/95/93/1049009593.db2.gz QWUDSGDXWVMYDZ-QGZVFWFLSA-N -1 3 341.426 4.331 20 0 EIADHM Nc1ccc(C(=O)N(Cc2ccc(F)cc2)C2CCCCC2)c([O-])c1 ZINC000817909019 1049056038 /nfs/dbraw/zinc/05/60/38/1049056038.db2.gz WEXSTOIEMRRFGL-UHFFFAOYSA-N -1 3 342.414 4.089 20 0 EIADHM O=C(Cc1cccc2ccccc21)[N-]OCC[C@@H]1CC1(Cl)Cl ZINC000818078421 1049086674 /nfs/dbraw/zinc/08/66/74/1049086674.db2.gz KINDNVBKWVALOF-CQSZACIVSA-N -1 3 338.234 4.014 20 0 EIADHM Cc1ccc(C(=O)Nc2ccc(F)cc2OCC2CC2)c([O-])c1C ZINC001147256403 1049113295 /nfs/dbraw/zinc/11/32/95/1049113295.db2.gz CXFKJFUOUZHIEY-UHFFFAOYSA-N -1 3 329.371 4.189 20 0 EIADHM CSCC[C@H](C)NC(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC001147298039 1049120321 /nfs/dbraw/zinc/12/03/21/1049120321.db2.gz JOEJRTYUXCKJDU-ZDUSSCGKSA-N -1 3 331.437 4.056 20 0 EIADHM CSCCCCNC(=O)c1cc(CCc2ccccc2)ccc1[O-] ZINC001147318923 1049132981 /nfs/dbraw/zinc/13/29/81/1049132981.db2.gz ZYFHAYCSWHREIA-UHFFFAOYSA-N -1 3 343.492 4.050 20 0 EIADHM C[C@@H]1CC[C@H](C)CN1C(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC001147861904 1049228436 /nfs/dbraw/zinc/22/84/36/1049228436.db2.gz RWMXMGLHMCDZMZ-LSDHHAIUSA-N -1 3 325.408 4.445 20 0 EIADHM O=C(Nc1cc([O-])cc(Cl)c1)c1cc(Br)cs1 ZINC001147912243 1049240398 /nfs/dbraw/zinc/24/03/98/1049240398.db2.gz KUORQUYWRNGPEV-UHFFFAOYSA-N -1 3 332.606 4.122 20 0 EIADHM O=C([N-]c1nocc1C1CC1)c1cnc(-c2ccccc2F)s1 ZINC001133060186 1049308093 /nfs/dbraw/zinc/30/80/93/1049308093.db2.gz AWSWWZJFMHDQNJ-UHFFFAOYSA-N -1 3 329.356 4.067 20 0 EIADHM CC(=O)c1cc(C(=O)N2CCC[C@H]2c2cc3ccccc3[nH]2)ccc1[O-] ZINC001148662325 1049357295 /nfs/dbraw/zinc/35/72/95/1049357295.db2.gz JFMMPPAJQNPHKM-IBGZPJMESA-N -1 3 348.402 4.053 20 0 EIADHM CCc1ccc(C(=O)N2CCC[C@@H](c3ccc(F)c(F)c3)C2)c([O-])c1 ZINC001148744247 1049366086 /nfs/dbraw/zinc/36/60/86/1049366086.db2.gz XAFORLCNHXYCJC-OAHLLOKOSA-N -1 3 345.389 4.253 20 0 EIADHM Cc1ccc(C(=O)Nc2ccc(Oc3ccccc3)nc2)c([O-])c1C ZINC001136353776 1049526079 /nfs/dbraw/zinc/52/60/79/1049526079.db2.gz UCQIBWREFIOCSW-UHFFFAOYSA-N -1 3 334.375 4.449 20 0 EIADHM CSc1ccc([O-])c(C(=O)N2CC[C@H](c3cccc(Cl)c3)C2)c1 ZINC000615288641 1049622802 /nfs/dbraw/zinc/62/28/02/1049622802.db2.gz KJLRFPNGDRNLQM-ZDUSSCGKSA-N -1 3 347.867 4.397 20 0 EIADHM Cc1cc(C)cc([C@@H](C)NC(=O)c2cc([O-])cc(Br)c2)c1 ZINC001136696541 1049833762 /nfs/dbraw/zinc/83/37/62/1049833762.db2.gz OYGZWLUGESKRDI-GFCCVEGCSA-N -1 3 348.240 4.263 20 0 EIADHM C[C@H]1C[C@@H]1N(Cc1cc(=O)[n-]c(-c2ccccc2)n1)c1ccccc1 ZINC001171047565 1049901861 /nfs/dbraw/zinc/90/18/61/1049901861.db2.gz GBOWTSLRTWZIIW-KXBFYZLASA-N -1 3 331.419 4.264 20 0 EIADHM O=c1nc(COCc2ccccc2)[n-]c2scc(-c3ccccc3)c21 ZINC000139556600 1049990112 /nfs/dbraw/zinc/99/01/12/1049990112.db2.gz KKAKWKTYMFIKTI-UHFFFAOYSA-N -1 3 348.427 4.368 20 0 EIADHM Cc1nc([C@@H](C)N2CC[C@](C)(C(=O)[O-])C2)oc1-c1ccc(Cl)cc1 ZINC000263571523 1049995528 /nfs/dbraw/zinc/99/55/28/1049995528.db2.gz JMOUNCCPEQSCDO-XIKOKIGWSA-N -1 3 348.830 4.161 20 0 EIADHM C[C@@H](C(=O)Nc1cc(Br)ccc1[O-])c1ccccc1F ZINC000085591468 1050037172 /nfs/dbraw/zinc/03/71/72/1050037172.db2.gz QXXLMOAKLLEFQW-SECBINFHSA-N -1 3 338.176 4.036 20 0 EIADHM Cc1cc([C@H]2CCCN2CCCCC(=O)[O-])ccc1Br ZINC000263581913 1050089273 /nfs/dbraw/zinc/08/92/73/1050089273.db2.gz XUKLAJWREMLDAH-OAHLLOKOSA-N -1 3 340.261 4.149 20 0 EIADHM Cc1nc([C@H](C)N2CCC[C@@H](C(=O)[O-])C2)oc1-c1ccc(Cl)cc1 ZINC000263582060 1050090289 /nfs/dbraw/zinc/09/02/89/1050090289.db2.gz YAYBINXBGRKHAM-GXTWGEPZSA-N -1 3 348.830 4.161 20 0 EIADHM O=C(Nc1ccc(F)c([O-])c1)c1ccc(C(F)(F)F)c(F)c1F ZINC001186480591 1050331597 /nfs/dbraw/zinc/33/15/97/1050331597.db2.gz WDZXKJIGMHIMIM-UHFFFAOYSA-N -1 3 335.203 4.081 20 0 EIADHM CCC[C@@H]1CCCC[C@@H]1[N-]S(=O)(=O)c1cc(C)c(Cl)s1 ZINC001186566987 1050362513 /nfs/dbraw/zinc/36/25/13/1050362513.db2.gz QNNWTVNPJKYVON-NEPJUHHUSA-N -1 3 335.922 4.347 20 0 EIADHM O=C(NCc1ccc(C(F)(F)F)cc1)Nc1cc([O-])cc(Cl)c1 ZINC001186817032 1050424721 /nfs/dbraw/zinc/42/47/21/1050424721.db2.gz ZNMZTQVRAVTVCM-UHFFFAOYSA-N -1 3 344.720 4.386 20 0 EIADHM O=C(Nc1cncc([O-])c1)Nc1cc(C(F)(F)F)ccc1Cl ZINC001187494095 1050555685 /nfs/dbraw/zinc/55/56/85/1050555685.db2.gz XVVGMUASGHPYSG-UHFFFAOYSA-N -1 3 331.681 4.103 20 0 EIADHM COc1ccc(Cl)cc1NC(=O)Nc1nc2c(cccc2[O-])s1 ZINC001187897948 1050639123 /nfs/dbraw/zinc/63/91/23/1050639123.db2.gz WKECZNBETPGKPV-UHFFFAOYSA-N -1 3 349.799 4.308 20 0 EIADHM O=C(NC1CCCCC1)c1ccc(Nc2cc(F)c([O-])c(F)c2)cc1 ZINC001174081390 1050755569 /nfs/dbraw/zinc/75/55/69/1050755569.db2.gz LJCRKYNVDCXCPL-UHFFFAOYSA-N -1 3 346.377 4.477 20 0 EIADHM COc1ccc(Nc2cc(Br)cc(F)c2[O-])c(F)c1 ZINC001174146576 1050785764 /nfs/dbraw/zinc/78/57/64/1050785764.db2.gz JIQGHQQAWSLDOY-UHFFFAOYSA-N -1 3 330.128 4.185 20 0 EIADHM CCOc1ccc(SCc2nnc(-c3ccccc3[O-])o2)cc1 ZINC001188500425 1050788861 /nfs/dbraw/zinc/78/88/61/1050788861.db2.gz AVYGKUMFIGNXSO-UHFFFAOYSA-N -1 3 328.393 4.133 20 0 EIADHM Cc1cccc([O-])c1C(=O)N1CCC(n2ccc3ccccc32)CC1 ZINC001188646263 1050812554 /nfs/dbraw/zinc/81/25/54/1050812554.db2.gz BWJIDROUHLEEPM-UHFFFAOYSA-N -1 3 334.419 4.133 20 0 EIADHM C[C@@H]1CN(Cc2cccc([O-])c2Br)[C@@H]1c1ccccc1 ZINC001180143355 1050885909 /nfs/dbraw/zinc/88/59/09/1050885909.db2.gz WDQPYBNKKDPDHQ-PXAZEXFGSA-N -1 3 332.241 4.348 20 0 EIADHM Cc1cc(CN2CCC(C(=O)c3ccc([O-])cc3)CC2)ccc1Cl ZINC001180249439 1050933385 /nfs/dbraw/zinc/93/33/85/1050933385.db2.gz MXKDNPFQWIERBF-UHFFFAOYSA-N -1 3 343.854 4.449 20 0 EIADHM O=S(=O)(Cc1cc(F)ccc1F)[N-]c1csc2ccccc12 ZINC001189649238 1051034835 /nfs/dbraw/zinc/03/48/35/1051034835.db2.gz MWLFCXGRZFYEAJ-UHFFFAOYSA-N -1 3 339.388 4.121 20 0 EIADHM CCc1cccc(C(=O)Nc2cccc(Oc3ccccc3)n2)c1[O-] ZINC001180667190 1051060552 /nfs/dbraw/zinc/06/05/52/1051060552.db2.gz HPQFWDLXRQLCPM-UHFFFAOYSA-N -1 3 334.375 4.394 20 0 EIADHM Cc1cc(F)c([N-]S(=O)(=O)Cc2ccc(F)cc2F)cc1Cl ZINC001189824496 1051071474 /nfs/dbraw/zinc/07/14/74/1051071474.db2.gz KQUZBOZQDMKGRM-UHFFFAOYSA-N -1 3 349.761 4.008 20 0 EIADHM [O-]c1ccc(CNc2ccc(OC(F)F)c3cccnc23)cc1F ZINC001180961367 1051122298 /nfs/dbraw/zinc/12/22/98/1051122298.db2.gz AXRJAYDWYWESQI-UHFFFAOYSA-N -1 3 334.297 4.293 20 0 EIADHM CN1CCN(c2ccc(Nc3c([S-])cccc3Cl)cc2)CC1 ZINC001174817281 1051185282 /nfs/dbraw/zinc/18/52/82/1051185282.db2.gz MIMHUTYJNVXLJL-UHFFFAOYSA-N -1 3 333.888 4.124 20 0 EIADHM O=C(Nc1ccc(Cl)cc1[O-])c1cc(Br)cs1 ZINC000153565981 1051196903 /nfs/dbraw/zinc/19/69/03/1051196903.db2.gz GFSIJGOTEDMLGM-UHFFFAOYSA-N -1 3 332.606 4.122 20 0 EIADHM O=S(=O)([N-]c1ccc(F)c(C2CC2)c1)c1ccc(C2CC2)cc1 ZINC001190513117 1051200621 /nfs/dbraw/zinc/20/06/21/1051200621.db2.gz ZWSZSHSYHCNJNW-UHFFFAOYSA-N -1 3 331.412 4.381 20 0 EIADHM Cc1nn(-c2ccccc2)c(C)c1C(=O)Nc1ccc(Cl)cc1[O-] ZINC000153626199 1051207125 /nfs/dbraw/zinc/20/71/25/1051207125.db2.gz WEPCPNDVLQZIHC-UHFFFAOYSA-N -1 3 341.798 4.100 20 0 EIADHM CC(C)COc1cc(F)cc(Nc2cc(=O)n(-c3ccccc3)[n-]2)c1 ZINC001175059879 1051310394 /nfs/dbraw/zinc/31/03/94/1051310394.db2.gz ZRHXCYCULOXGHM-UHFFFAOYSA-N -1 3 341.386 4.495 20 0 EIADHM O=C(Nc1cccnc1)c1ccccc1Nc1c(F)cc([O-])cc1F ZINC001175099708 1051345122 /nfs/dbraw/zinc/34/51/22/1051345122.db2.gz GTRGDBRRZUOZSU-UHFFFAOYSA-N -1 3 341.317 4.061 20 0 EIADHM [O-]c1cc(F)c(Nc2ccccc2I)c(F)c1 ZINC001175100501 1051348031 /nfs/dbraw/zinc/34/80/31/1051348031.db2.gz WAQAYNYCZHLOLL-UHFFFAOYSA-N -1 3 347.102 4.019 20 0 EIADHM COc1cc(Br)ccc1Nc1c(F)cc([O-])cc1F ZINC001175100633 1051348441 /nfs/dbraw/zinc/34/84/41/1051348441.db2.gz ZNGHMSXJOMGFPI-UHFFFAOYSA-N -1 3 330.128 4.185 20 0 EIADHM CCCCc1ccc(S(=O)(=O)[N-]c2cc(F)cnc2Cl)cc1 ZINC001191233957 1051407637 /nfs/dbraw/zinc/40/76/37/1051407637.db2.gz VHUXSDQYZJBPNU-UHFFFAOYSA-N -1 3 342.823 4.018 20 0 EIADHM Cc1ccc(F)cc1NC(=O)Nc1cc(Br)ccc1[O-] ZINC001191410482 1051450992 /nfs/dbraw/zinc/45/09/92/1051450992.db2.gz IABQKBSJNCYFAD-UHFFFAOYSA-N -1 3 339.164 4.246 20 0 EIADHM COc1cccc(Nc2c(F)ccc([O-])c2F)c1Br ZINC001175264201 1051501723 /nfs/dbraw/zinc/50/17/23/1051501723.db2.gz CAWNWJBFKQMLEW-UHFFFAOYSA-N -1 3 330.128 4.185 20 0 EIADHM [O-]c1ccc(F)c(Nc2ccc3cnn([C@@H]4CCCCO4)c3c2)c1F ZINC001175267892 1051503637 /nfs/dbraw/zinc/50/36/37/1051503637.db2.gz BSKVVOITNZCIBP-INIZCTEOSA-N -1 3 345.349 4.463 20 0 EIADHM CCOC(=O)c1ccc(Nc2c(F)ccc([O-])c2F)cc1Cl ZINC001175268092 1051504199 /nfs/dbraw/zinc/50/41/99/1051504199.db2.gz HEZJZCYXECTNHN-UHFFFAOYSA-N -1 3 327.714 4.244 20 0 EIADHM CNc1cccc(Br)c1Nc1c(F)ccc([O-])c1F ZINC001175268535 1051504769 /nfs/dbraw/zinc/50/47/69/1051504769.db2.gz SNTXBYGYZPSOOF-UHFFFAOYSA-N -1 3 329.144 4.218 20 0 EIADHM Cc1noc(C2CC2)c1[N-]C(=O)c1nc(-c2ccco2)sc1C ZINC000156646706 1051548820 /nfs/dbraw/zinc/54/88/20/1051548820.db2.gz BMQHZBNHTRFVJD-UHFFFAOYSA-N -1 3 329.381 4.138 20 0 EIADHM COc1cc(CNC(=O)Nc2ccccc2C(C)C)cc(Cl)c1[O-] ZINC001192275586 1051680731 /nfs/dbraw/zinc/68/07/31/1051680731.db2.gz OAUWWDVVBLZVGY-UHFFFAOYSA-N -1 3 348.830 4.499 20 0 EIADHM CSc1cc(C)nc(SC)c1[N-]C(=O)c1ccc([C@@H](C)O)cc1 ZINC001192340146 1051694506 /nfs/dbraw/zinc/69/45/06/1051694506.db2.gz OFEMFPFJXBASOA-LLVKDONJSA-N -1 3 348.493 4.139 20 0 EIADHM O=C([N-]c1nc2ccccc2s1)c1nc(C(F)(F)F)cs1 ZINC001192446312 1051737315 /nfs/dbraw/zinc/73/73/15/1051737315.db2.gz DPJORWNFFZITSV-UHFFFAOYSA-N -1 3 329.328 4.024 20 0 EIADHM Cc1ccc(-c2nc(NC(=O)c3cc(-c4ccccc4)oc3C)n[n-]2)o1 ZINC001182932132 1051754817 /nfs/dbraw/zinc/75/48/17/1051754817.db2.gz XFPFWGUUQCIETR-UHFFFAOYSA-N -1 3 348.362 4.194 20 0 EIADHM C[C@@H]1c2sccc2CCN1Cc1cc(=O)[n-]c(-c2ccccc2)n1 ZINC001175830586 1051793454 /nfs/dbraw/zinc/79/34/54/1051793454.db2.gz LFMIRAWEBIVJJC-CYBMUJFWSA-N -1 3 337.448 4.030 20 0 EIADHM CCSc1ccc([C@@H](C)NC(=O)NCc2ccc([O-])c(F)c2)cc1 ZINC000159012313 1051804378 /nfs/dbraw/zinc/80/43/78/1051804378.db2.gz SROBLKCYOYXUSV-GFCCVEGCSA-N -1 3 348.443 4.204 20 0 EIADHM O=c1ccn(-c2ccc(Nc3ccc(-c4cccnc4)cc3)cc2)[n-]1 ZINC001175891453 1051817614 /nfs/dbraw/zinc/81/76/14/1051817614.db2.gz NPSXZQCZEHHLFU-UHFFFAOYSA-N -1 3 328.375 4.384 20 0 EIADHM O=c1[n-]c(C2CC2)nc2c1CN(CCCCc1cccc(Cl)c1)C2 ZINC001175861086 1051824116 /nfs/dbraw/zinc/82/41/16/1051824116.db2.gz IIWLEUCDOUFZKS-UHFFFAOYSA-N -1 3 343.858 4.052 20 0 EIADHM COc1cccc([C@H](C)NC(=O)Nc2ccc(C)c([O-])c2Cl)c1 ZINC001192885632 1051826164 /nfs/dbraw/zinc/82/61/64/1051826164.db2.gz GHHJEBNBWINPBN-NSHDSACASA-N -1 3 334.803 4.245 20 0 EIADHM Cc1cc(Nc2cc(Br)cc(F)c2[O-])cc(C)c1N ZINC001175939411 1051833150 /nfs/dbraw/zinc/83/31/50/1051833150.db2.gz XWQOISJGIUTZQP-UHFFFAOYSA-N -1 3 325.181 4.236 20 0 EIADHM CC1(C)CCCC[C@@H]1C(=O)Nc1n[n-]c(-c2cc3ccccc3o2)n1 ZINC001183369127 1051837785 /nfs/dbraw/zinc/83/77/85/1051837785.db2.gz WOQXRFQLBNCYBO-CYBMUJFWSA-N -1 3 338.411 4.373 20 0 EIADHM CN(C)C(=O)c1ccc(F)c([N-]c2nc3cc(Cl)ccc3o2)c1 ZINC001176044084 1051865987 /nfs/dbraw/zinc/86/59/87/1051865987.db2.gz ZCEBZXHUSMPSCZ-UHFFFAOYSA-N -1 3 333.750 4.066 20 0 EIADHM CCN(CC)C(=O)c1ccc(F)c(Nc2ccc([O-])c(F)c2F)c1 ZINC001176067663 1051902289 /nfs/dbraw/zinc/90/22/89/1051902289.db2.gz BCKAQPLECBQVGN-UHFFFAOYSA-N -1 3 338.329 4.035 20 0 EIADHM O=C([N-]OC1CCCC1)[C@H]1CC=CC[C@H]1c1nc2ccccc2s1 ZINC000775599089 1051929833 /nfs/dbraw/zinc/92/98/33/1051929833.db2.gz BVJFRQNFFZDMGW-LSDHHAIUSA-N -1 3 342.464 4.337 20 0 EIADHM O=C(c1ccc(F)c(Nc2ccc([O-])c(Cl)c2)c1)N1CCCC1 ZINC001176213317 1051959216 /nfs/dbraw/zinc/95/92/16/1051959216.db2.gz NORUZJUYVUAVKW-UHFFFAOYSA-N -1 3 334.778 4.164 20 0 EIADHM COc1cc(C)c(NC(=O)c2ccc([O-])cc2C(F)(F)F)cc1C ZINC001193748190 1051991161 /nfs/dbraw/zinc/99/11/61/1051991161.db2.gz RDKPACHDTOVIFG-UHFFFAOYSA-N -1 3 339.313 4.289 20 0 EIADHM O=C(Nc1ccccc1-c1ncc[nH]1)c1ccc([O-])cc1C(F)(F)F ZINC001193747317 1051992290 /nfs/dbraw/zinc/99/22/90/1051992290.db2.gz JCYQEDHTHYXWLW-UHFFFAOYSA-N -1 3 347.296 4.053 20 0 EIADHM CN(CCCc1ccccc1)C(=O)c1ccc([O-])cc1C(F)(F)F ZINC001193749875 1051992573 /nfs/dbraw/zinc/99/25/73/1051992573.db2.gz RZSFUESVKHTFFX-UHFFFAOYSA-N -1 3 337.341 4.116 20 0 EIADHM CCCCOc1ccc(C(=O)N[C@@H](C)c2c(F)cccc2F)c([O-])c1 ZINC001184349135 1051997449 /nfs/dbraw/zinc/99/74/49/1051997449.db2.gz WOBNQQKPMSKGPD-LBPRGKRZSA-N -1 3 349.377 4.340 20 0 EIADHM [O-]c1cc(Br)cnc1Nc1ccc(O)cc1C(F)(F)F ZINC001176339622 1051998238 /nfs/dbraw/zinc/99/82/38/1051998238.db2.gz LQEOZCOKVFNWGZ-UHFFFAOYSA-N -1 3 349.106 4.018 20 0 EIADHM CCCC[C@H](CC)COC(=O)NCc1cc(Cl)c([O-])c(OC)c1 ZINC001193983558 1052039598 /nfs/dbraw/zinc/03/95/98/1052039598.db2.gz JCMFNBWKZRRNPP-LBPRGKRZSA-N -1 3 343.851 4.497 20 0 EIADHM O=C(Nc1ncccc1[O-])c1ccc(-c2ccc(C(F)(F)F)cc2)o1 ZINC001194229039 1052097698 /nfs/dbraw/zinc/09/76/98/1052097698.db2.gz DYQOXFXDKNGRBC-UHFFFAOYSA-N -1 3 348.280 4.318 20 0 EIADHM [O-]c1cc(Cl)c(Nc2cnc(N3CCCCC3)nc2)cc1Cl ZINC001176507768 1052101811 /nfs/dbraw/zinc/10/18/11/1052101811.db2.gz UCOPJTXMVWHHGB-UHFFFAOYSA-N -1 3 339.226 4.223 20 0 EIADHM Cc1ccnc(NC(=O)c2cc([O-])cc(C(F)(F)F)c2)c1C1CC1 ZINC000622147584 1052131429 /nfs/dbraw/zinc/13/14/29/1052131429.db2.gz HCYHIEQWNCVYRY-UHFFFAOYSA-N -1 3 336.313 4.244 20 0 EIADHM CN(CCCc1ccccc1)C(=O)c1cc([O-])cc(C(F)(F)F)c1 ZINC000622309370 1052189378 /nfs/dbraw/zinc/18/93/78/1052189378.db2.gz OKYVDLDUTQAZJS-UHFFFAOYSA-N -1 3 337.341 4.116 20 0 EIADHM CC(C)[C@@H](C[N-]S(=O)(=O)c1ccc(Cl)s1)c1ccccc1 ZINC001185251553 1052203321 /nfs/dbraw/zinc/20/33/21/1052203321.db2.gz KSZWTJNTLVVANH-CYBMUJFWSA-N -1 3 343.901 4.120 20 0 EIADHM CCCN(CCc1cccc(F)c1)C(=O)c1cc(CC)ccc1[O-] ZINC000622371158 1052234911 /nfs/dbraw/zinc/23/49/11/1052234911.db2.gz CVLKOXKVNKOKSJ-UHFFFAOYSA-N -1 3 329.415 4.189 20 0 EIADHM Cc1cc(S(=O)(=O)[N-]c2ccc(OC(F)F)cc2)ccc1Cl ZINC001185484190 1052250252 /nfs/dbraw/zinc/25/02/52/1052250252.db2.gz BAFFVCJWKJBVKM-UHFFFAOYSA-N -1 3 347.770 4.051 20 0 EIADHM CCc1ccc(C(=O)N(C)CC(C)(C)c2ccc(C)cc2)c([O-])c1 ZINC000622394880 1052250974 /nfs/dbraw/zinc/25/09/74/1052250974.db2.gz YFYHOPWWCHBLFR-UHFFFAOYSA-N -1 3 325.452 4.313 20 0 EIADHM Cc1ccc(C(=O)N2CCc3cc(Cl)cc(Cl)c3C2)c([O-])c1 ZINC000622420276 1052257603 /nfs/dbraw/zinc/25/76/03/1052257603.db2.gz LSKHPNODJPWUQX-UHFFFAOYSA-N -1 3 336.218 4.206 20 0 EIADHM Cc1cc(S(=O)(=O)Nc2ccc(C)c([O-])c2Cl)ccc1Cl ZINC001185530097 1052257632 /nfs/dbraw/zinc/25/76/32/1052257632.db2.gz SIGSCLNWTWSXKQ-UHFFFAOYSA-N -1 3 346.235 4.117 20 0 EIADHM COc1cc(C)c([N-]S(=O)(=O)c2ccc(Cl)c(C)c2)cc1C ZINC001185531443 1052257764 /nfs/dbraw/zinc/25/77/64/1052257764.db2.gz ASDXTFJADALKGL-UHFFFAOYSA-N -1 3 339.844 4.075 20 0 EIADHM CC(C)C[C@H]1CCCN(C(=O)c2cc([O-])cc(C(F)(F)F)c2)C1 ZINC000622433775 1052268757 /nfs/dbraw/zinc/26/87/57/1052268757.db2.gz PZDTVSSXWJIQFW-GFCCVEGCSA-N -1 3 329.362 4.309 20 0 EIADHM O=C(Nc1ccccc1OCCF)c1cc([O-])cc(C(F)(F)F)c1 ZINC000622629193 1052358055 /nfs/dbraw/zinc/35/80/55/1052358055.db2.gz CPLPASYVXXWXOS-UHFFFAOYSA-N -1 3 343.276 4.012 20 0 EIADHM CCCc1nc(C(=O)[N-]c2c(C)c3ccccc3nc2SC)co1 ZINC000622968557 1052558730 /nfs/dbraw/zinc/55/87/30/1052558730.db2.gz POKMSXGCNZSJCL-UHFFFAOYSA-N -1 3 341.436 4.458 20 0 EIADHM O=C(Nc1cc(Br)ccc1[O-])c1cc(Cl)ccc1F ZINC000176438175 1052622741 /nfs/dbraw/zinc/62/27/41/1052622741.db2.gz WLBLDLFSZSWFMQ-UHFFFAOYSA-N -1 3 344.567 4.200 20 0 EIADHM O=C(Nc1cc(Br)ccc1[O-])c1ccc(Cl)s1 ZINC000176434767 1052623134 /nfs/dbraw/zinc/62/31/34/1052623134.db2.gz UOCXZBZQBBNLJJ-UHFFFAOYSA-N -1 3 332.606 4.122 20 0 EIADHM Cc1cc(=O)[n-]c([C@H](C)N[C@@H](C)c2ccc(SC(C)C)cc2)n1 ZINC000192731836 1052634524 /nfs/dbraw/zinc/63/45/24/1052634524.db2.gz ZTABGHVUWSJXPO-KBPBESRZSA-N -1 3 331.485 4.403 20 0 EIADHM C[C@@H](Oc1cccc2ccccc21)C(=O)Nc1cccc([O-])c1F ZINC000192833219 1052641958 /nfs/dbraw/zinc/64/19/58/1052641958.db2.gz HQCXGACLVIBENT-GFCCVEGCSA-N -1 3 325.339 4.091 20 0 EIADHM Cc1nc(Cc2ccccc2)sc1C(=O)Nc1cc(F)ccc1[O-] ZINC000178328525 1052704619 /nfs/dbraw/zinc/70/46/19/1052704619.db2.gz UHKZIOBBCVYYHM-UHFFFAOYSA-N -1 3 342.395 4.139 20 0 EIADHM COc1ccc(Cl)c([N-]S(=O)(=O)c2cccc(C)c2Cl)c1 ZINC000179982657 1052770735 /nfs/dbraw/zinc/77/07/35/1052770735.db2.gz WCCPIUPZZMLNGK-UHFFFAOYSA-N -1 3 346.235 4.111 20 0 EIADHM CCc1cc(NC(=O)c2c[n-]c3c(C)cc(F)cc3c2=O)ccc1C ZINC000183608941 1052979633 /nfs/dbraw/zinc/97/96/33/1052979633.db2.gz LAAXHFGRHGFDGQ-UHFFFAOYSA-N -1 3 338.382 4.099 20 0 EIADHM C[C@@H](c1ccc(Cl)cc1Cl)S(=O)(=O)c1cccc([O-])c1 ZINC000183994766 1052988976 /nfs/dbraw/zinc/98/89/76/1052988976.db2.gz CXYLEYBYLAOXNQ-VIFPVBQESA-N -1 3 331.220 4.234 20 0 EIADHM C[C@H](CC(=O)c1ccc(Cl)cc1)C(=O)Nc1cccc([O-])c1F ZINC000184244812 1052995839 /nfs/dbraw/zinc/99/58/39/1052995839.db2.gz BUMFBODESKCXQT-SNVBAGLBSA-N -1 3 335.762 4.032 20 0 EIADHM Cc1cc([O-])c(NC(=O)N[C@@H](C)c2ccccc2)cc1Br ZINC001202510537 1053076050 /nfs/dbraw/zinc/07/60/50/1053076050.db2.gz RSZHSDSCPSSSFO-NSHDSACASA-N -1 3 349.228 4.346 20 0 EIADHM CCOc1cc(CNc2cc(F)cc(N(C)C)c2)cc(Cl)c1[O-] ZINC000864016389 1053144133 /nfs/dbraw/zinc/14/41/33/1053144133.db2.gz RGKOHCAKIKSZNG-UHFFFAOYSA-N -1 3 338.810 4.262 20 0 EIADHM Cc1c([O-])ccc2c(CN(c3ccccc3)[C@@H]3C[C@H]3C)cc(=O)oc12 ZINC001195045416 1053241522 /nfs/dbraw/zinc/24/15/22/1053241522.db2.gz IZVCKGQAAZNPIO-FZKQIMNGSA-N -1 3 335.403 4.222 20 0 EIADHM [O-]c1ccc(CNCc2c(Cl)cccc2OC(F)F)cc1F ZINC000120470506 1053456635 /nfs/dbraw/zinc/45/66/35/1053456635.db2.gz CWGQCJIMHXADSR-UHFFFAOYSA-N -1 3 331.721 4.076 20 0 EIADHM CCCCCCOc1ccc(NS(=O)(=O)c2ccc([O-])cc2)cc1 ZINC001195794645 1053488427 /nfs/dbraw/zinc/48/84/27/1053488427.db2.gz DFNLCUDPSZTHMG-UHFFFAOYSA-N -1 3 349.452 4.152 20 0 EIADHM CCCCC[C@H](CC)C(=O)Nc1ccc(-c2nc(C)cc(=O)[n-]2)cc1 ZINC000775672943 1053499402 /nfs/dbraw/zinc/49/94/02/1053499402.db2.gz VJDIDBJWAHRXRO-HNNXBMFYSA-N -1 3 341.455 4.290 20 0 EIADHM Cc1cccc(NC(=S)Nc2nc3c(cccc3[O-])s2)c1C ZINC001196385665 1053652903 /nfs/dbraw/zinc/65/29/03/1053652903.db2.gz JJBPYJUORLNBSN-UHFFFAOYSA-N -1 3 329.450 4.428 20 0 EIADHM COc1ccc([N-]S(=O)(=O)c2ccc3cc(Cl)ccc3c2)cc1 ZINC001196411780 1053666385 /nfs/dbraw/zinc/66/63/85/1053666385.db2.gz FTKGDLCFYXEWCB-UHFFFAOYSA-N -1 3 347.823 4.303 20 0 EIADHM O=C(NCc1ccccc1OC(F)F)c1cc([O-])c2ccccc2c1 ZINC000471625632 1053670447 /nfs/dbraw/zinc/67/04/47/1053670447.db2.gz CNTZIHLIWFEVBQ-UHFFFAOYSA-N -1 3 343.329 4.077 20 0 EIADHM Cc1ccc(-c2nnco2)cc1NC(=O)c1cc([O-])c2ccccc2c1 ZINC000471760000 1053704069 /nfs/dbraw/zinc/70/40/69/1053704069.db2.gz QCLCOYFULNUZQP-UHFFFAOYSA-N -1 3 345.358 4.156 20 0 EIADHM CC1(C)CCCc2sc([N-]C(=O)c3conc3C(F)(F)F)nc21 ZINC000854527734 1053825767 /nfs/dbraw/zinc/82/57/67/1053825767.db2.gz NUKYQGXYCOAHLU-UHFFFAOYSA-N -1 3 345.346 4.016 20 0 EIADHM Cc1cc(NC([O-])=NO[C@@H]2CCCCO2)ccc1-c1ccccc1 ZINC000775776133 1053918307 /nfs/dbraw/zinc/91/83/07/1053918307.db2.gz CYOFYVGRJAAJHS-GOSISDBHSA-N -1 3 326.396 4.242 20 0 EIADHM Cc1cc(NC(=O)[N-]O[C@@H]2CCCCO2)ccc1-c1ccccc1 ZINC000775776133 1053918317 /nfs/dbraw/zinc/91/83/17/1053918317.db2.gz CYOFYVGRJAAJHS-GOSISDBHSA-N -1 3 326.396 4.242 20 0 EIADHM [O-]c1cc(Cl)ccc1NC(=S)NCc1ccc(Cl)cc1 ZINC001197581225 1053933959 /nfs/dbraw/zinc/93/39/59/1053933959.db2.gz SZPSSEDFRHVDGA-UHFFFAOYSA-N -1 3 327.236 4.186 20 0 EIADHM [O-]c1cccc(C(F)(F)F)c1NC(=S)Nc1cccc(F)c1 ZINC001197645135 1053959750 /nfs/dbraw/zinc/95/97/50/1053959750.db2.gz KSBNSQWBHZADAY-UHFFFAOYSA-N -1 3 330.306 4.359 20 0 EIADHM C[C@]1(C[N-]C(=O)C(F)(F)c2cc(Cl)ccc2Cl)CC1(F)F ZINC000855796207 1053977263 /nfs/dbraw/zinc/97/72/63/1053977263.db2.gz RDLWDJFTLVNKJJ-LLVKDONJSA-N -1 3 344.135 4.247 20 0 EIADHM O=C(c1cc2sccc2c([O-])c1)N1CCC([C@@H]2CCCCO2)CC1 ZINC000855948541 1053999304 /nfs/dbraw/zinc/99/93/04/1053999304.db2.gz PRPTWOVNPNHIHB-KRWDZBQOSA-N -1 3 345.464 4.028 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N1CC2(CCC2)[C@@H]1c1ccncc1 ZINC000856496279 1054078889 /nfs/dbraw/zinc/07/88/89/1054078889.db2.gz WBBLLKUQZBNIAA-FQEVSTJZSA-N -1 3 344.414 4.308 20 0 EIADHM O=C(CCCCCc1ccc(O)cc1)Nc1c([O-])cccc1Cl ZINC000857269900 1054206744 /nfs/dbraw/zinc/20/67/44/1054206744.db2.gz IACDKMRCWCYNNU-UHFFFAOYSA-N -1 3 333.815 4.493 20 0 EIADHM CC(C)Cc1nsc([N-]C(=O)c2sccc2SC(F)F)n1 ZINC000857318360 1054215549 /nfs/dbraw/zinc/21/55/49/1054215549.db2.gz YRZVLXAHDAYWFG-UHFFFAOYSA-N -1 3 349.453 4.365 20 0 EIADHM CC[C@](C)(NC(=O)c1cc([O-])c2ccccc2c1)c1nc(C)cs1 ZINC000472217605 1054256189 /nfs/dbraw/zinc/25/61/89/1054256189.db2.gz UZXLNMLIECQCKW-IBGZPJMESA-N -1 3 340.448 4.366 20 0 EIADHM Cc1c(NC(=O)c2[n-]cnc2C(F)(F)F)cccc1C(F)(F)F ZINC000857467168 1054256720 /nfs/dbraw/zinc/25/67/20/1054256720.db2.gz UTWUIXKNOMYIBB-UHFFFAOYSA-N -1 3 337.223 4.008 20 0 EIADHM Cc1c(NC(=O)c2nc[n-]c2C(F)(F)F)cccc1C(F)(F)F ZINC000857467168 1054256738 /nfs/dbraw/zinc/25/67/38/1054256738.db2.gz UTWUIXKNOMYIBB-UHFFFAOYSA-N -1 3 337.223 4.008 20 0 EIADHM Cc1c(NC(=O)c2cc([O-])cc(C(F)(F)F)c2)cccc1N(C)C ZINC000857480998 1054270979 /nfs/dbraw/zinc/27/09/79/1054270979.db2.gz TXHAJBADULBLGQ-UHFFFAOYSA-N -1 3 338.329 4.038 20 0 EIADHM CC[C@H](C)c1ccccc1[N-]S(=O)(=O)c1ccc(OC)cc1C ZINC001198896163 1054291120 /nfs/dbraw/zinc/29/11/20/1054291120.db2.gz HFLMJYRANUMTBC-ZDUSSCGKSA-N -1 3 333.453 4.318 20 0 EIADHM C[C@@H]([N-]C(=O)C(F)(F)c1ccc(F)cc1)c1ccc(Cl)cc1 ZINC000857535714 1054302313 /nfs/dbraw/zinc/30/23/13/1054302313.db2.gz HQGPBMZSZXWBIM-SNVBAGLBSA-N -1 3 327.733 4.448 20 0 EIADHM COc1ccc(S(=O)(=O)[N-]c2ccc3cc(F)ccc3c2)c(C)c1 ZINC001198943229 1054304510 /nfs/dbraw/zinc/30/45/10/1054304510.db2.gz AJNVKPPAULYUSF-UHFFFAOYSA-N -1 3 345.395 4.097 20 0 EIADHM Cc1cc(C(=O)COC(=O)c2cc(Cl)c(Cl)[n-]2)c(C)s1 ZINC000011810291 1054309251 /nfs/dbraw/zinc/30/92/51/1054309251.db2.gz AWWUWHNGODYQAH-UHFFFAOYSA-N -1 3 332.208 4.040 20 0 EIADHM C[C@H](NCc1ccc(OCC(F)(F)F)cc1)c1cccc([O-])c1F ZINC000872018913 1054334594 /nfs/dbraw/zinc/33/45/94/1054334594.db2.gz QYWHTQODAFYRTQ-NSHDSACASA-N -1 3 343.320 4.323 20 0 EIADHM O=C([N-]c1c2nsnc2ccc1Cl)c1cc2occc2s1 ZINC000776965074 1054360006 /nfs/dbraw/zinc/36/00/06/1054360006.db2.gz IGPRUFZUGYQHKG-UHFFFAOYSA-N -1 3 335.797 4.405 20 0 EIADHM C[C@H](Nc1cccc(OC[C@@H]2CCCO2)c1)c1cccc([O-])c1F ZINC000872057339 1054368364 /nfs/dbraw/zinc/36/83/64/1054368364.db2.gz XUXVCBSRQYHRJU-BBRMVZONSA-N -1 3 331.387 4.262 20 0 EIADHM C[C@H](N[C@@H]1CCc2ccccc2-n2ccnc21)c1cccc([O-])c1F ZINC000872089009 1054385315 /nfs/dbraw/zinc/38/53/15/1054385315.db2.gz XRKKZVRAUFYCKV-XJKSGUPXSA-N -1 3 337.398 4.055 20 0 EIADHM Cc1cc(C)cc(C(=O)Cc2nc(=O)c3c4ccccc4sc3[n-]2)c1 ZINC000060639217 1054714581 /nfs/dbraw/zinc/71/45/81/1054714581.db2.gz YDNPJKAWTXTBHQ-UHFFFAOYSA-N -1 3 348.427 4.180 20 0 EIADHM CC(C)c1ccc2nc(-c3ccc(Br)cc3)[n-]c(=O)c2c1 ZINC000060797418 1054722448 /nfs/dbraw/zinc/72/24/48/1054722448.db2.gz KEJNXCQCDAJWEF-UHFFFAOYSA-N -1 3 343.224 4.476 20 0 EIADHM Cc1sc2[n-]c([C@H](C)OC(=O)[C@@H]3CCCC34CC4)nc(=O)c2c1C ZINC000860177039 1054783183 /nfs/dbraw/zinc/78/31/83/1054783183.db2.gz LZKUOMXVDXEOKI-JQWIXIFHSA-N -1 3 346.452 4.198 20 0 EIADHM CC(C)Cc1nc(C(=O)[N-]c2nc(-c3ccccc3)ns2)cs1 ZINC000063595154 1054819711 /nfs/dbraw/zinc/81/97/11/1054819711.db2.gz QZUMHHKMKZCBBQ-UHFFFAOYSA-N -1 3 344.465 4.112 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2cccc(COC(C)C)c2)c(C)c1 ZINC000063849388 1054839730 /nfs/dbraw/zinc/83/97/30/1054839730.db2.gz VSGMLWRVOWZBEF-UHFFFAOYSA-N -1 3 333.453 4.029 20 0 EIADHM Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)OC(=O)c1ccc([O-])cc1 ZINC000005694131 1054901786 /nfs/dbraw/zinc/90/17/86/1054901786.db2.gz HKHBSFRLQMBROM-CQSZACIVSA-N -1 3 341.407 4.008 20 0 EIADHM Cc1cc(C)c2cc(C(=O)[N-]c3nc(C(C)C)ns3)sc2n1 ZINC000876482802 1054916230 /nfs/dbraw/zinc/91/62/30/1054916230.db2.gz PXXQUDGNOYBDGF-UHFFFAOYSA-N -1 3 332.454 4.140 20 0 EIADHM O=C(Nc1c([O-])cccc1C(F)(F)F)Nc1c(F)cccc1F ZINC001202043506 1055019098 /nfs/dbraw/zinc/01/90/98/1055019098.db2.gz FXMSVFIEERVZNC-UHFFFAOYSA-N -1 3 332.228 4.333 20 0 EIADHM C[C@H](NC(=O)Nc1ccc([O-])c(Br)c1)c1ccccc1 ZINC001202506167 1055026222 /nfs/dbraw/zinc/02/62/22/1055026222.db2.gz NCCUFLWOAYICNB-JTQLQIEISA-N -1 3 335.201 4.037 20 0 EIADHM O=C(Nc1ccc(Cl)c(Cl)c1)Nc1cc(=O)[n-]c(C2CC2)n1 ZINC001202256815 1055099980 /nfs/dbraw/zinc/09/99/80/1055099980.db2.gz HROKKLMQUVHRKD-UHFFFAOYSA-N -1 3 339.182 4.010 20 0 EIADHM CCCc1nnc([N-]C(=O)c2sccc2SC(F)F)s1 ZINC000107103493 1055208761 /nfs/dbraw/zinc/20/87/61/1055208761.db2.gz OCGDLZYNRINDGQ-UHFFFAOYSA-N -1 3 335.426 4.119 20 0 EIADHM [O-]c1ccc(Cl)c(Nc2ccc(F)nc2Br)c1F ZINC001214556056 1058316420 /nfs/dbraw/zinc/31/64/20/1058316420.db2.gz IIRONXIRQDYBPC-UHFFFAOYSA-N -1 3 335.535 4.225 20 0 EIADHM [O-]c1ccc(CNC(=S)Nc2cccc(C(F)(F)F)c2)cc1F ZINC000737461959 1058564772 /nfs/dbraw/zinc/56/47/72/1058564772.db2.gz WKPBEZZVDVWPKY-UHFFFAOYSA-N -1 3 344.333 4.037 20 0 EIADHM Cc1cc(=O)[n-]c(-c2cccc(OC(=O)C3CCCCCCC3)c2)n1 ZINC000744217788 1059336730 /nfs/dbraw/zinc/33/67/30/1059336730.db2.gz QPDKZUGBXBVXJS-UHFFFAOYSA-N -1 3 340.423 4.424 20 0 EIADHM Cc1cc(C(=O)COC(=O)c2cc3ccsc3[n-]2)cc(C)c1F ZINC000744542513 1059574030 /nfs/dbraw/zinc/57/40/30/1059574030.db2.gz OVQZMVVBKIACDL-UHFFFAOYSA-N -1 3 331.368 4.025 20 0 EIADHM Cc1sc2[n-]c([C@@H](C)OC(=O)[C@@H](C)c3ccco3)nc(=O)c2c1C ZINC000745134100 1059739870 /nfs/dbraw/zinc/73/98/70/1059739870.db2.gz ZAYCZDSKALCJKV-VHSXEESVSA-N -1 3 346.408 4.015 20 0 EIADHM Cc1c(Br)c[nH]c(=O)c1Nc1c(Cl)ccc([O-])c1F ZINC001214558217 1059970519 /nfs/dbraw/zinc/97/05/19/1059970519.db2.gz STVLTVOPLVECSS-UHFFFAOYSA-N -1 3 347.571 4.100 20 0 EIADHM COc1ccccc1-c1cc(Nc2ccc(Cl)c([O-])c2)n(C)n1 ZINC001212587927 1060739775 /nfs/dbraw/zinc/73/97/75/1060739775.db2.gz ALFUYHUZARCATF-UHFFFAOYSA-N -1 3 329.787 4.198 20 0 EIADHM COC(=O)c1sc2cccnc2c1Nc1ccc(Cl)c([O-])c1 ZINC001212587974 1060750110 /nfs/dbraw/zinc/75/01/10/1060750110.db2.gz CSGYSXGAFIHXKT-UHFFFAOYSA-N -1 3 334.784 4.186 20 0 EIADHM COc1ccc(-c2nnsc2Nc2ccc(Cl)c([O-])c2)cc1 ZINC001212589319 1060769807 /nfs/dbraw/zinc/76/98/07/1060769807.db2.gz FSLYHRHNQDMJGO-UHFFFAOYSA-N -1 3 333.800 4.316 20 0 EIADHM Cc1ccc(CNc2cc(F)cc(-c3nnn[n-]3)c2)c2ccccc12 ZINC001169418324 1060808680 /nfs/dbraw/zinc/80/86/80/1060808680.db2.gz QGGSUNRKQJAOLP-UHFFFAOYSA-N -1 3 333.370 4.080 20 0 EIADHM Cc1ccc(CNc2cc(F)cc(-c3nn[n-]n3)c2)c2ccccc12 ZINC001169418324 1060808686 /nfs/dbraw/zinc/80/86/86/1060808686.db2.gz QGGSUNRKQJAOLP-UHFFFAOYSA-N -1 3 333.370 4.080 20 0 EIADHM COc1cccc(Cn2nc(C)cc2Nc2ccc(Cl)c([O-])c2)c1 ZINC001212590283 1060818743 /nfs/dbraw/zinc/81/87/43/1060818743.db2.gz DVHHYWSNHGNHQY-UHFFFAOYSA-N -1 3 343.814 4.351 20 0 EIADHM [O-]c1cc(Nc2ccc(I)cc2)ccc1Cl ZINC001212593421 1060887897 /nfs/dbraw/zinc/88/78/97/1060887897.db2.gz PVTGHPZOYLNFEE-UHFFFAOYSA-N -1 3 345.567 4.394 20 0 EIADHM Cc1cc(N)c(Nc2ccc(Cl)c([O-])c2)cc1Br ZINC001212592478 1060890612 /nfs/dbraw/zinc/89/06/12/1060890612.db2.gz RYWYJOJZIGJREJ-UHFFFAOYSA-N -1 3 327.609 4.442 20 0 EIADHM Cc1ccccc1NC(=O)c1c(C)cccc1NCc1ncccc1[O-] ZINC001169730482 1060933316 /nfs/dbraw/zinc/93/33/16/1060933316.db2.gz AXCYSPPSAPBUST-UHFFFAOYSA-N -1 3 347.418 4.268 20 0 EIADHM CN(C)c1ccc2c(c1)Cc1cc(NCc3ncccc3[O-])ccc1-2 ZINC001169731040 1060934087 /nfs/dbraw/zinc/93/40/87/1060934087.db2.gz APUTVFVKIPAVSY-UHFFFAOYSA-N -1 3 331.419 4.037 20 0 EIADHM [O-]c1cc(Cl)c(CN2CC[C@H](F)C(F)(F)CC2)c(Cl)c1 ZINC001142105980 1029669419 /nfs/dbraw/zinc/66/94/19/1029669419.db2.gz VMDKIKNFYKCHQB-LBPRGKRZSA-N -1 3 328.161 4.268 20 0 EIADHM CC[C@@H](CC(F)(F)F)C(=O)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000450088384 1032275374 /nfs/dbraw/zinc/27/53/74/1032275374.db2.gz PVBAEGWDHYENCS-ZETCQYMHSA-N -1 3 329.240 4.328 20 0 EIADHM Cc1cc(S(=O)(=O)[N-]c2ccccc2Cl)c(Cl)cc1F ZINC000471113866 1018904974 /nfs/dbraw/zinc/90/49/74/1018904974.db2.gz SYAFDZQDDFOLLG-UHFFFAOYSA-N -1 3 334.199 4.242 20 0 EIADHM CCCCCc1nnc([N-]C(=O)c2cnc(C(C)(C)C)s2)s1 ZINC000108987089 1019181032 /nfs/dbraw/zinc/18/10/32/1019181032.db2.gz WLBWQCDCCYPIPJ-UHFFFAOYSA-N -1 3 338.502 4.277 20 0 EIADHM CCCCOc1ccc(NC(=O)c2cc3c(cc2[O-])CCCC3)cn1 ZINC001625838468 1020237002 /nfs/dbraw/zinc/23/70/02/1020237002.db2.gz CMFGPSDCUHZMNX-UHFFFAOYSA-N -1 3 340.423 4.097 20 0 EIADHM Cc1oc(-c2ccsc2)nc1CN1CCC[C@H](C(C)(C)C(=O)[O-])C1 ZINC000652499698 1020539369 /nfs/dbraw/zinc/53/93/69/1020539369.db2.gz IZXZOWQLWOACKG-AWEZNQCLSA-N -1 3 348.468 4.034 20 0 EIADHM O=C([O-])C[C@@H](NCc1ccc(F)c(C(F)(F)F)c1)c1cccs1 ZINC000322020738 1020564505 /nfs/dbraw/zinc/56/45/05/1020564505.db2.gz GDLYFRGMVUZYKH-GFCCVEGCSA-N -1 3 347.333 4.212 20 0 EIADHM CCc1ccc([O-])c(C(=O)Nc2ccc(Oc3ccncc3)cc2)c1 ZINC000109821336 1020798051 /nfs/dbraw/zinc/79/80/51/1020798051.db2.gz BRVVQLWJULIHPE-UHFFFAOYSA-N -1 3 334.375 4.394 20 0 EIADHM Cc1c(Cl)cc(F)c([N-]C(=O)c2coc(C3CCC3)n2)c1F ZINC000683450025 1020844772 /nfs/dbraw/zinc/84/47/72/1020844772.db2.gz OILPHXAGGBBLMP-UHFFFAOYSA-N -1 3 326.730 4.434 20 0 EIADHM O=C(Nc1cccnc1)c1ccccc1Nc1cccc(Cl)c1[O-] ZINC001210222079 1020959749 /nfs/dbraw/zinc/95/97/49/1020959749.db2.gz MWDXNFJVADQGDV-UHFFFAOYSA-N -1 3 339.782 4.437 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1c(F)cccc1Br ZINC000126250579 1021043242 /nfs/dbraw/zinc/04/32/42/1021043242.db2.gz JQLXGJWSKILTDC-UHFFFAOYSA-N -1 3 344.567 4.200 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)N1CCc2cccc(Cl)c2C1 ZINC000458022034 1021080206 /nfs/dbraw/zinc/08/02/06/1021080206.db2.gz UYHYHIBSQGDIMF-UHFFFAOYSA-N -1 3 347.817 4.092 20 0 EIADHM Cc1c(CNC(=O)c2cc([O-])ccc2Cl)oc2ccc(F)cc12 ZINC000340524610 1021190498 /nfs/dbraw/zinc/19/04/98/1021190498.db2.gz YWANNOGKNCMETF-UHFFFAOYSA-N -1 3 333.746 4.169 20 0 EIADHM C[C@@H](C(=O)Nc1cccc([O-])c1F)c1cccc(Br)c1 ZINC000570261194 1021304541 /nfs/dbraw/zinc/30/45/41/1021304541.db2.gz MFSGLMCDSJBUIP-SECBINFHSA-N -1 3 338.176 4.036 20 0 EIADHM Cc1c([O-])ccc2c(CN(C)[C@H](C)c3ccccc3F)cc(=O)oc12 ZINC000053124923 1021417678 /nfs/dbraw/zinc/41/76/78/1021417678.db2.gz TZNNLQOJZPHUKZ-CYBMUJFWSA-N -1 3 341.382 4.139 20 0 EIADHM [O-]c1ccc(F)c(CNCc2cc(Cl)ccc2OC(F)F)c1F ZINC000511410117 1021630976 /nfs/dbraw/zinc/63/09/76/1021630976.db2.gz HZAISEAXSFRMPI-UHFFFAOYSA-N -1 3 349.711 4.215 20 0 EIADHM Cc1nc(-c2ccc(NC(=O)NC(C)(C)C(C)(C)C)cc2)cc(=O)[n-]1 ZINC000431720853 1021639941 /nfs/dbraw/zinc/63/99/41/1021639941.db2.gz DSWSBGUMMKPMSV-UHFFFAOYSA-N -1 3 342.443 4.104 20 0 EIADHM O=C(NCCc1ccccc1C(F)(F)F)c1cc([O-])ccc1Cl ZINC000431740908 1021720966 /nfs/dbraw/zinc/72/09/66/1021720966.db2.gz IHRKKDRTYMRFOG-UHFFFAOYSA-N -1 3 343.732 4.037 20 0 EIADHM O=C(N[C@@H]1C[C@H]1c1cccc2ccccc21)c1cc([O-])ccc1Cl ZINC000511436195 1021760253 /nfs/dbraw/zinc/76/02/53/1021760253.db2.gz IGRDEIZUMUNFMB-QFBILLFUSA-N -1 3 337.806 4.485 20 0 EIADHM COc1cc(Br)c(C)nc1Nc1cccc([O-])c1Cl ZINC001210854917 1021805210 /nfs/dbraw/zinc/80/52/10/1021805210.db2.gz FIHCCNXPDRYWRB-UHFFFAOYSA-N -1 3 343.608 4.264 20 0 EIADHM Cc1cc(N)c(Nc2cccc([O-])c2Cl)cc1Br ZINC001210854597 1021805828 /nfs/dbraw/zinc/80/58/28/1021805828.db2.gz HASGCDHFPMYVSM-UHFFFAOYSA-N -1 3 327.609 4.442 20 0 EIADHM CCN1CCN(c2ccc(Nc3cccc([O-])c3Cl)cc2F)CC1 ZINC001210854645 1021805894 /nfs/dbraw/zinc/80/58/94/1021805894.db2.gz JMFZHPLVZSJSRF-UHFFFAOYSA-N -1 3 349.837 4.070 20 0 EIADHM CC(=O)N1CC(C)(C)c2ccc(Nc3cccc([O-])c3Cl)cc21 ZINC001210855407 1021808825 /nfs/dbraw/zinc/80/88/25/1021808825.db2.gz ZEHTZYMYZLXOIR-UHFFFAOYSA-N -1 3 330.815 4.433 20 0 EIADHM O=C(N[C@H]1CCC[C@@H]1Cc1ccccc1)c1cc([O-])ccc1Cl ZINC000431793638 1021862696 /nfs/dbraw/zinc/86/26/96/1021862696.db2.gz ZUZPKTJVOYUPAN-KDOFPFPSSA-N -1 3 329.827 4.187 20 0 EIADHM O=S(=O)([N-]c1cc(F)ccc1Cl)c1cccc2ccccc21 ZINC000318525881 1021866718 /nfs/dbraw/zinc/86/67/18/1021866718.db2.gz IRHCRAHPDIPIBG-UHFFFAOYSA-N -1 3 335.787 4.433 20 0 EIADHM O=C([N-]c1ncc(C2CCCCC2)s1)c1ncoc1C(F)(F)F ZINC000613402424 1021944196 /nfs/dbraw/zinc/94/41/96/1021944196.db2.gz JXUGMDQWKFTHQB-UHFFFAOYSA-N -1 3 345.346 4.450 20 0 EIADHM C[C@H](CN(C)Cc1c(Br)cccc1C(=O)[O-])C(C)(C)C ZINC000634697265 1022036510 /nfs/dbraw/zinc/03/65/10/1022036510.db2.gz FDULQQKDVLVUQO-LLVKDONJSA-N -1 3 342.277 4.261 20 0 EIADHM FC(F)(F)[C@H](C[C@H]1CCCO1)[N-]c1nc(C2CCCC2)ns1 ZINC000656227138 1022066737 /nfs/dbraw/zinc/06/67/37/1022066737.db2.gz JVNQDOVXCWVJDA-MNOVXSKESA-N -1 3 335.395 4.108 20 0 EIADHM O=C(N[C@@H](c1nccs1)c1ccccc1)c1cc([O-])ccc1Cl ZINC000377891505 1022076726 /nfs/dbraw/zinc/07/67/26/1022076726.db2.gz CBDRQJJYHYSZMZ-OAHLLOKOSA-N -1 3 344.823 4.022 20 0 EIADHM CSc1ccc(C(=O)[N-]c2c(F)cc(Br)cc2F)o1 ZINC000175255983 1022309550 /nfs/dbraw/zinc/30/95/50/1022309550.db2.gz YXKAPHQWMDSYNL-UHFFFAOYSA-N -1 3 348.168 4.295 20 0 EIADHM [O-]c1cc2ccccc2cc1-c1nc(COCc2ccccc2)no1 ZINC000395512681 1022316429 /nfs/dbraw/zinc/31/64/29/1022316429.db2.gz DRJHYDAIAIPAMG-UHFFFAOYSA-N -1 3 332.359 4.312 20 0 EIADHM O=C([O-])c1occc1CN1CCC([C@H](F)c2ccccc2F)CC1 ZINC000580785630 1022495104 /nfs/dbraw/zinc/49/51/04/1022495104.db2.gz IKEOIIJGYIJNOD-INIZCTEOSA-N -1 3 335.350 4.040 20 0 EIADHM Cc1cc(=O)[n-]c(-c2ccc(NC(=O)C=CC3CCCCC3)cc2)n1 ZINC000255767580 1022499307 /nfs/dbraw/zinc/49/93/07/1022499307.db2.gz FLPPBPMNXNRNNK-GHXNOFRVSA-N -1 3 337.423 4.233 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1cccnc1SC(F)(F)F ZINC000060065203 1022588187 /nfs/dbraw/zinc/58/81/87/1022588187.db2.gz BOKAUNAJTWVSOI-UHFFFAOYSA-N -1 3 348.733 4.305 20 0 EIADHM Cc1nsc([N-]c2cc(F)cc(F)c2OCc2ccccc2)n1 ZINC001211509988 1022884035 /nfs/dbraw/zinc/88/40/35/1022884035.db2.gz FDTKESVTUUIOLJ-UHFFFAOYSA-N -1 3 333.363 4.447 20 0 EIADHM CC(C)CCn1ncc(NCc2cc(=O)[n-]c(C3CC3)n2)c1C(C)C ZINC000417021348 1023111627 /nfs/dbraw/zinc/11/16/27/1023111627.db2.gz GLNFMYOIVZNXSJ-UHFFFAOYSA-N -1 3 343.475 4.038 20 0 EIADHM Cc1cc(-c2noc(C=C([O-])c3ccccc3Cl)n2)ccc1F ZINC001211645311 1023129739 /nfs/dbraw/zinc/12/97/39/1023129739.db2.gz ROMSQCHVEWBVTN-UHFFFAOYSA-N -1 3 330.746 4.263 20 0 EIADHM Cc1c(Cl)c(CN2CCC[C@H](CCC(=O)[O-])C2)nc2ccccc12 ZINC000261894049 1023159470 /nfs/dbraw/zinc/15/94/70/1023159470.db2.gz ODGQDQSITKKDIM-CQSZACIVSA-N -1 3 346.858 4.273 20 0 EIADHM C[C@@H](c1cccnc1)N(C)C(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000179483853 1023213509 /nfs/dbraw/zinc/21/35/09/1023213509.db2.gz CVQNVMWHEKTPRS-HNNXBMFYSA-N -1 3 348.402 4.413 20 0 EIADHM CC(C)N(CC(F)F)C(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000179858312 1023221754 /nfs/dbraw/zinc/22/17/54/1023221754.db2.gz GEMFLGBONLUMOD-UHFFFAOYSA-N -1 3 335.350 4.300 20 0 EIADHM [O-]C(=Cc1nc(-c2cccc3ccncc32)no1)c1ccccc1Cl ZINC001211647459 1023223018 /nfs/dbraw/zinc/22/30/18/1023223018.db2.gz QLMWWVYNUODACE-UHFFFAOYSA-N -1 3 349.777 4.364 20 0 EIADHM [O-]C(=Cc1nc(-c2cccc(F)c2F)no1)c1ccccc1Cl ZINC001211647379 1023223072 /nfs/dbraw/zinc/22/30/72/1023223072.db2.gz MLHFBWMCLCAGTM-UHFFFAOYSA-N -1 3 334.709 4.094 20 0 EIADHM O=C([O-])c1cccc2c1CCN(CCCc1ccccc1Cl)C2 ZINC000659792237 1023273594 /nfs/dbraw/zinc/27/35/94/1023273594.db2.gz AOBCJKQJOCGZAM-UHFFFAOYSA-N -1 3 329.827 4.029 20 0 EIADHM C[C@H](c1ncc(-c2ccc(Cl)cc2)o1)N1CC[C@H](C(=O)[O-])[C@H](C)C1 ZINC000659801017 1023281932 /nfs/dbraw/zinc/28/19/32/1023281932.db2.gz FVDQBMROCQMWRP-JMSVASOKSA-N -1 3 348.830 4.099 20 0 EIADHM CC[C@@H](C)Oc1cccc(S(=O)(=O)[N-]c2c(C)cccc2F)c1 ZINC000656732828 1023471836 /nfs/dbraw/zinc/47/18/36/1023471836.db2.gz WTWMEBOEPIKAQJ-CYBMUJFWSA-N -1 3 337.416 4.112 20 0 EIADHM O=C([O-])[C@@H]1CCN(Cc2cc(Cl)cc(Cl)c2)[C@H]2CCCC[C@@H]12 ZINC000656764256 1023506251 /nfs/dbraw/zinc/50/62/51/1023506251.db2.gz FUDSUUFENRKRKW-XHSDSOJGSA-N -1 3 342.266 4.459 20 0 EIADHM O=C([O-])[C@@H](c1ccc(Cl)c(Cl)c1)N1CCC[C@@H](CCF)C1 ZINC000656763854 1023508279 /nfs/dbraw/zinc/50/82/79/1023508279.db2.gz RTUCXSTYZPZXDY-IINYFYTJSA-N -1 3 334.218 4.191 20 0 EIADHM O=C([O-])[C@@H]1CCN(Cc2ccc(Cl)c(Cl)c2)[C@H]2CCCC[C@@H]12 ZINC000656764930 1023510552 /nfs/dbraw/zinc/51/05/52/1023510552.db2.gz LRTODGJOYWRETO-ZENOOKHLSA-N -1 3 342.266 4.459 20 0 EIADHM O=C(Nc1nc(-c2cccc(O)c2)cs1)c1cc([O-])ccc1Cl ZINC000377576885 1023614739 /nfs/dbraw/zinc/61/47/39/1023614739.db2.gz HGFRBJIFMQTEKJ-UHFFFAOYSA-N -1 3 346.795 4.127 20 0 EIADHM O=C([O-])c1ccc(CN2CCCCC[C@H]2/C=C/c2cccs2)nc1 ZINC000581731559 1023655290 /nfs/dbraw/zinc/65/52/90/1023655290.db2.gz GGIHUXSNQJHNLH-FVNWOWOISA-N -1 3 342.464 4.299 20 0 EIADHM CCc1cc(=O)[n-]c(CN[C@@H](CC(C)(C)C)c2ccc(F)cc2)n1 ZINC000341457279 1023783394 /nfs/dbraw/zinc/78/33/94/1023783394.db2.gz OJHZDASCTHGLND-INIZCTEOSA-N -1 3 331.435 4.151 20 0 EIADHM O=C(NCc1ccc(-c2cccnc2)cc1)c1cc([O-])ccc1Cl ZINC000341467342 1023803661 /nfs/dbraw/zinc/80/36/61/1023803661.db2.gz WAENIVKBQKOFCT-UHFFFAOYSA-N -1 3 338.794 4.038 20 0 EIADHM Cc1cc(C(=O)CCC(=O)Nc2cc(Cl)ccc2[O-])c(C)s1 ZINC000111211086 1023856387 /nfs/dbraw/zinc/85/63/87/1023856387.db2.gz AZRIGIQWPPIIQH-UHFFFAOYSA-N -1 3 337.828 4.326 20 0 EIADHM COc1ccc(C(=O)Nc2ccc(Cl)cc2[O-])c(OCC2CC2)c1 ZINC000473076663 1023897996 /nfs/dbraw/zinc/89/79/96/1023897996.db2.gz QUBTWQZGZWXFAR-UHFFFAOYSA-N -1 3 347.798 4.095 20 0 EIADHM CC[C@H](C)Oc1ccccc1/C=C\C(=O)Nc1cccc([O-])c1F ZINC000255394034 1023932365 /nfs/dbraw/zinc/93/23/65/1023932365.db2.gz HZJDQYFESPWVRG-HHQWOOOKSA-N -1 3 329.371 4.361 20 0 EIADHM Cc1cc(=O)[n-]c(C(C)(C)NCc2sc3ccccc3c2Cl)n1 ZINC000660745729 1024044797 /nfs/dbraw/zinc/04/47/97/1024044797.db2.gz GFVZRIXOXZXSCH-UHFFFAOYSA-N -1 3 347.871 4.384 20 0 EIADHM CO[C@H](C)c1cccc(NC(=O)CCCc2ccc([O-])c(F)c2)c1 ZINC000468872203 1024077387 /nfs/dbraw/zinc/07/73/87/1024077387.db2.gz INIGHFFZNXRGPC-CYBMUJFWSA-N -1 3 331.387 4.200 20 0 EIADHM O=C([O-])[C@@H](NCc1cccc(OCc2ccccc2)c1)c1ccccc1 ZINC000388554082 1024234247 /nfs/dbraw/zinc/23/42/47/1024234247.db2.gz WZUSPERQJFPBAV-NRFANRHFSA-N -1 3 347.414 4.181 20 0 EIADHM O=C(COc1ccc(Cl)c2ccccc12)Nc1cccc([O-])c1F ZINC000535657077 1024372809 /nfs/dbraw/zinc/37/28/09/1024372809.db2.gz BYRVOAQYLKKQTP-UHFFFAOYSA-N -1 3 345.757 4.355 20 0 EIADHM COc1cccc(C=C2CCN(Cc3cc([O-])cc(F)c3)CC2)c1 ZINC000473141360 1024412881 /nfs/dbraw/zinc/41/28/81/1024412881.db2.gz RLNWGDITAUSFMN-UHFFFAOYSA-N -1 3 327.399 4.219 20 0 EIADHM Cc1ccc(C)n1-c1sccc1C(=O)Nc1cccc([O-])c1F ZINC000535657840 1024428484 /nfs/dbraw/zinc/42/84/84/1024428484.db2.gz IDIMZXFDHCPFPN-UHFFFAOYSA-N -1 3 330.384 4.253 20 0 EIADHM O=C([N-]c1nc(-c2ccco2)cs1)c1scnc1C(F)(F)F ZINC000341809182 1024729380 /nfs/dbraw/zinc/72/93/80/1024729380.db2.gz IIPGVGJEZLZREY-UHFFFAOYSA-N -1 3 345.327 4.131 20 0 EIADHM O=C([O-])[C@H](c1ccc(F)cc1)N1CC[C@H](C(F)(F)F)C2(CCC2)C1 ZINC000652446933 1024837181 /nfs/dbraw/zinc/83/71/81/1024837181.db2.gz GVFILYHVNJCWIQ-KBPBESRZSA-N -1 3 345.336 4.006 20 0 EIADHM O=C(c1cc([O-])ccc1Cl)N1CCC[C@H]1Cc1ccc(F)cc1 ZINC000341867476 1024840882 /nfs/dbraw/zinc/84/08/82/1024840882.db2.gz JJEAMWVZVPULLW-AWEZNQCLSA-N -1 3 333.790 4.032 20 0 EIADHM COc1c(F)cc(Nc2cc(Br)cc(F)c2[O-])cc1F ZINC001211686898 1024871715 /nfs/dbraw/zinc/87/17/15/1024871715.db2.gz LQBWMKLFXZLUQZ-UHFFFAOYSA-N -1 3 348.118 4.324 20 0 EIADHM Cc1cnc(-c2nc(=O)c3c(C4CCCCC4)csc3[n-]2)cn1 ZINC000663219234 1024897282 /nfs/dbraw/zinc/89/72/82/1024897282.db2.gz LWHURQRGOYAUIF-UHFFFAOYSA-N -1 3 326.425 4.210 20 0 EIADHM O=c1nc(CN2CCC[C@@H](C3CCCCC3)C2)[n-]c2ccsc21 ZINC000662200423 1024932540 /nfs/dbraw/zinc/93/25/40/1024932540.db2.gz GKYRWDZSJUPMKL-CQSZACIVSA-N -1 3 331.485 4.189 20 0 EIADHM O=C([O-])CC[C@@H](CNCc1cc(Cl)ccc1Cl)C(F)(F)F ZINC000663261214 1024963112 /nfs/dbraw/zinc/96/31/12/1024963112.db2.gz GXUBPGDCCZLEKA-VIFPVBQESA-N -1 3 344.160 4.126 20 0 EIADHM O=C([O-])CC[C@H](CNCc1ccc(Cl)cc1Cl)C(F)(F)F ZINC000663260500 1024965375 /nfs/dbraw/zinc/96/53/75/1024965375.db2.gz ALRDYAVHYSQJGO-SECBINFHSA-N -1 3 344.160 4.126 20 0 EIADHM CCc1cccc2cc(CNC[C@@H](CCC(=O)[O-])C(F)(F)F)oc21 ZINC000663260953 1024965960 /nfs/dbraw/zinc/96/59/60/1024965960.db2.gz FLWYKARSLIWCMX-CYBMUJFWSA-N -1 3 343.345 4.128 20 0 EIADHM O=C([O-])CC[C@@H](CNCc1ccc(Cl)cc1Cl)C(F)(F)F ZINC000663260510 1024966188 /nfs/dbraw/zinc/96/61/88/1024966188.db2.gz ALRDYAVHYSQJGO-VIFPVBQESA-N -1 3 344.160 4.126 20 0 EIADHM Cc1cc2cc(CNC[C@@H](CCC(=O)[O-])C(F)(F)F)oc2cc1C ZINC000663261371 1024968201 /nfs/dbraw/zinc/96/82/01/1024968201.db2.gz JXUKVDHQRIUZEJ-CYBMUJFWSA-N -1 3 343.345 4.183 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1ccc(-n2cccc2)c(F)c1 ZINC000519165042 1025567246 /nfs/dbraw/zinc/56/72/46/1025567246.db2.gz DIBFJWPTRCQMEO-UHFFFAOYSA-N -1 3 330.746 4.228 20 0 EIADHM CCOC(=O)c1ccc(NC(=O)c2cc(C)c(C)cc2Cl)c([O-])c1 ZINC000512011414 1025712970 /nfs/dbraw/zinc/71/29/70/1025712970.db2.gz SJCZWNFEXDIGRU-UHFFFAOYSA-N -1 3 347.798 4.091 20 0 EIADHM CCS[C@H]1CCCCN(C(=O)c2cc([O-])c3ccccc3c2)C1 ZINC000472091421 1025748092 /nfs/dbraw/zinc/74/80/92/1025748092.db2.gz ZFWGSWHCMRCQOC-INIZCTEOSA-N -1 3 329.465 4.293 20 0 EIADHM O=S(=O)([N-]c1cc(C(F)(F)F)ccc1Cl)c1ccsc1 ZINC000506818247 1025814636 /nfs/dbraw/zinc/81/46/36/1025814636.db2.gz HHBZWUDSQZXWGN-UHFFFAOYSA-N -1 3 341.763 4.221 20 0 EIADHM CC(C)Oc1ccccc1CNC(=O)c1cc([O-])c2ccccc2c1 ZINC000469948173 1025868758 /nfs/dbraw/zinc/86/87/58/1025868758.db2.gz NSYPISIMXGAJBQ-UHFFFAOYSA-N -1 3 335.403 4.263 20 0 EIADHM [O-]c1ccc(F)c(CNCc2ccc(Oc3ccccc3)nc2)c1F ZINC000512066585 1025874283 /nfs/dbraw/zinc/87/42/83/1025874283.db2.gz GHVPAJZIOZRZRP-UHFFFAOYSA-N -1 3 342.345 4.148 20 0 EIADHM CC(C)c1cccc(-c2ccc(C(=O)NCc3ncccc3[O-])o2)c1 ZINC000473643618 1025984414 /nfs/dbraw/zinc/98/44/14/1025984414.db2.gz ZZHPZWFCICDLKH-UHFFFAOYSA-N -1 3 336.391 4.101 20 0 EIADHM O=C([O-])CC[C@H]1CCCCN1Cc1ncc(-c2ccc(Cl)cc2)o1 ZINC000324442322 1026044245 /nfs/dbraw/zinc/04/42/45/1026044245.db2.gz SXEOUVLDLKTJEJ-OAHLLOKOSA-N -1 3 348.830 4.214 20 0 EIADHM Cc1ccc(-c2cc(C(=O)Nc3cc(Cl)ccc3[O-])on2)cc1 ZINC000111211422 1026098912 /nfs/dbraw/zinc/09/89/12/1026098912.db2.gz DDQDWNJDCGIZPV-UHFFFAOYSA-N -1 3 328.755 4.261 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1cnn(-c2ccc(Cl)cc2)c1 ZINC000111210108 1026099105 /nfs/dbraw/zinc/09/91/05/1026099105.db2.gz DYRHYDZWWAFGBK-UHFFFAOYSA-N -1 3 348.189 4.137 20 0 EIADHM CSc1ccc([O-])c(C(=O)N[C@@]2(c3ccccc3)CC2(C)C)c1 ZINC001167972994 1026153639 /nfs/dbraw/zinc/15/36/39/1026153639.db2.gz OTSFMPGTYFHMKV-LJQANCHMSA-N -1 3 327.449 4.169 20 0 EIADHM C[C@@H](CCCCC(=O)[O-])NCc1csc(-c2ccc(F)cc2)n1 ZINC000426663390 1026207546 /nfs/dbraw/zinc/20/75/46/1026207546.db2.gz LHIWIWARNMRNQF-LBPRGKRZSA-N -1 3 336.432 4.072 20 0 EIADHM COc1cc(C(=O)Nc2cc(Cl)ccc2[O-])cc(OC)c1C(C)C ZINC000512175885 1026230234 /nfs/dbraw/zinc/23/02/34/1026230234.db2.gz SDTMJWAHZKEUIG-UHFFFAOYSA-N -1 3 349.814 4.439 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2cc(-c3ccncc3)ccc2C)cc1 ZINC000101850663 1026344446 /nfs/dbraw/zinc/34/44/46/1026344446.db2.gz KUINGDFTHYQMOH-UHFFFAOYSA-N -1 3 338.432 4.166 20 0 EIADHM C[C@@H]1C[C@@H](CC[N-]S(=O)(=O)c2ccc(F)cc2F)CC(C)(C)C1 ZINC001211704580 1026395486 /nfs/dbraw/zinc/39/54/86/1026395486.db2.gz BHLYARSUFZUXME-CHWSQXEVSA-N -1 3 345.455 4.096 20 0 EIADHM O=C([N-][C@@H]1C[C@@]1(F)c1ccccc1)C(F)(F)c1cccc(Cl)c1 ZINC001299750261 1026399202 /nfs/dbraw/zinc/39/92/02/1026399202.db2.gz PQPMHRLZYYKVBA-GDBMZVCRSA-N -1 3 339.744 4.185 20 0 EIADHM O=C([N-][C@H]1C[C@]1(F)c1ccccc1)C(F)(F)c1cccc(Cl)c1 ZINC001299750263 1026406718 /nfs/dbraw/zinc/40/67/18/1026406718.db2.gz PQPMHRLZYYKVBA-HOCLYGCPSA-N -1 3 339.744 4.185 20 0 EIADHM Cc1oc(CN2CCC(c3ccc(Cl)cc3)CC2)cc1C(=O)[O-] ZINC000582306530 1026429598 /nfs/dbraw/zinc/42/95/98/1026429598.db2.gz SGVUHYLSZOWVMC-UHFFFAOYSA-N -1 3 333.815 4.319 20 0 EIADHM O=C([O-])c1ccc(CNCc2cc(Cl)cc(C(F)(F)F)c2)cc1 ZINC000426686385 1026476363 /nfs/dbraw/zinc/47/63/63/1026476363.db2.gz MPEUUAGGYNWYFK-UHFFFAOYSA-N -1 3 343.732 4.347 20 0 EIADHM CC(C)COc1ccc(CN[C@@H](C(=O)[O-])c2cccc(Cl)c2)cc1 ZINC000426737810 1026518689 /nfs/dbraw/zinc/51/86/89/1026518689.db2.gz QLFJMZBBFLKYFD-GOSISDBHSA-N -1 3 347.842 4.290 20 0 EIADHM O=C([O-])C[C@H](NCc1ccc(F)cc1)c1cc(Cl)cc(Cl)c1 ZINC000426746713 1026533719 /nfs/dbraw/zinc/53/37/19/1026533719.db2.gz KQWPGYQAVUWIML-HNNXBMFYSA-N -1 3 342.197 4.438 20 0 EIADHM O=C([O-])[C@H](NCc1cccc(Cl)c1)c1ccc(Cl)c(F)c1 ZINC000426751240 1026537418 /nfs/dbraw/zinc/53/74/18/1026537418.db2.gz UMZSRVFXPFUDMS-CQSZACIVSA-N -1 3 328.170 4.048 20 0 EIADHM COc1cc(-c2ccccc2)ccc1CN[C@H](C(=O)[O-])c1ccccc1 ZINC000426770771 1026549779 /nfs/dbraw/zinc/54/97/79/1026549779.db2.gz VUHBQXAYXGKNSC-NRFANRHFSA-N -1 3 347.414 4.278 20 0 EIADHM CCOc1cccc(CN[C@@H](CC(=O)[O-])c2cccc(Cl)c2)c1 ZINC000426803706 1026571176 /nfs/dbraw/zinc/57/11/76/1026571176.db2.gz OQVKPYHDKUGSJB-KRWDZBQOSA-N -1 3 333.815 4.044 20 0 EIADHM Cc1ccc2[nH]c(CN[C@@H](CC(=O)[O-])c3ccc(F)cc3)cc2c1C ZINC000426821782 1026579724 /nfs/dbraw/zinc/57/97/24/1026579724.db2.gz WQDJMMDBJIHVOZ-IBGZPJMESA-N -1 3 340.398 4.229 20 0 EIADHM COc1ccc([C@@H](NCc2ccc(C(C)(C)C)cc2)C(=O)[O-])cc1F ZINC000426823976 1026582108 /nfs/dbraw/zinc/58/21/08/1026582108.db2.gz KUOXXQRWCNRPTQ-GOSISDBHSA-N -1 3 345.414 4.047 20 0 EIADHM CCCCCOc1ccc(CN[C@H](C(=O)[O-])c2ccsc2)cc1 ZINC000426831596 1026592250 /nfs/dbraw/zinc/59/22/50/1026592250.db2.gz FNGZGQYAJSRPTH-KRWDZBQOSA-N -1 3 333.453 4.233 20 0 EIADHM CCN(Cc1ccc(OC)c(OC)c1)Cc1cccc([O-])c1Cl ZINC000507022474 1026600548 /nfs/dbraw/zinc/60/05/48/1026600548.db2.gz RYHXLNPYWFCAIB-UHFFFAOYSA-N -1 3 335.831 4.085 20 0 EIADHM CC(C)C[C@H](C)n1nccc1NC(=O)CCCc1ccc([O-])c(F)c1 ZINC000426889761 1026603332 /nfs/dbraw/zinc/60/33/32/1026603332.db2.gz OOCSNRAYWRBGOA-AWEZNQCLSA-N -1 3 347.434 4.296 20 0 EIADHM CC(C)c1nnc([N-]C(=O)c2cnc(-c3ccsc3)s2)s1 ZINC000112231273 1026667051 /nfs/dbraw/zinc/66/70/51/1026667051.db2.gz NCNGAAXSASKWHH-UHFFFAOYSA-N -1 3 336.467 4.099 20 0 EIADHM COC(=O)c1cnc(S[C@H](C)c2ccc(Cl)c(Cl)c2)[n-]1 ZINC000432669898 1026697924 /nfs/dbraw/zinc/69/79/24/1026697924.db2.gz ZJLUWZAWLWVAGT-SSDOTTSWSA-N -1 3 331.224 4.356 20 0 EIADHM C[C@H](c1ccc(Br)cc1)[S@@](=O)c1ccc([O-])cc1 ZINC000427469420 1026861617 /nfs/dbraw/zinc/86/16/17/1026861617.db2.gz BDQYMLAQOXAMQV-MLCYQJTMSA-N -1 3 325.227 4.024 20 0 EIADHM CCc1ccc([O-])c(C(=O)Nc2cccc(Oc3ccccn3)c2)c1 ZINC000440661872 1027002527 /nfs/dbraw/zinc/00/25/27/1027002527.db2.gz RAZURYKFXDEWQO-UHFFFAOYSA-N -1 3 334.375 4.394 20 0 EIADHM CC[C@@]1(C)CCCN(Cc2ccc(C(=O)[O-])cc2Br)C1 ZINC000519831382 1027010306 /nfs/dbraw/zinc/01/03/06/1027010306.db2.gz YJZMFZGSENUBCX-INIZCTEOSA-N -1 3 340.261 4.159 20 0 EIADHM O=S(=O)([N-]c1cccc(F)c1F)c1ccccc1-c1ccccc1 ZINC000520038037 1027147077 /nfs/dbraw/zinc/14/70/77/1027147077.db2.gz YQQINXJVDQXFSR-UHFFFAOYSA-N -1 3 345.370 4.433 20 0 EIADHM CCN(Cc1nc(-c2ccccc2)cs1)C1CCC(C(=O)[O-])CC1 ZINC000563898347 1027432683 /nfs/dbraw/zinc/43/26/83/1027432683.db2.gz FPUGACGQGAWQGD-UHFFFAOYSA-N -1 3 344.480 4.275 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)N[C@@H]1CCC[C@H](c2ccccc2)C1 ZINC000487486411 1027476659 /nfs/dbraw/zinc/47/66/59/1027476659.db2.gz POIJNTJMNCXWMY-DLBZAZTESA-N -1 3 342.414 4.057 20 0 EIADHM COc1ccc(N(C(=O)c2cc([O-])ccc2Cl)[C@@H](C)C2CC2)cc1 ZINC000550339836 1027577273 /nfs/dbraw/zinc/57/72/73/1027577273.db2.gz XZGDOMVXQWELMX-LBPRGKRZSA-N -1 3 345.826 4.500 20 0 EIADHM Cc1nsc([N-]C(=O)c2cc(F)c(Oc3ccccc3)c(F)c2)n1 ZINC001126565040 1027738838 /nfs/dbraw/zinc/73/88/38/1027738838.db2.gz GISPYMFSNBYRIC-UHFFFAOYSA-N -1 3 347.346 4.169 20 0 EIADHM CC(C)(C)[C@H]1CCC[C@@H](NC(=O)c2cc(=O)c3ccccc3[n-]2)CC1 ZINC000444438201 1027746331 /nfs/dbraw/zinc/74/63/31/1027746331.db2.gz RGBLKXQWROLJTA-LSDHHAIUSA-N -1 3 340.467 4.253 20 0 EIADHM Cc1ccccc1-c1cc(=NC(=O)C[C@@H](C)c2cccc(F)c2)[nH][n-]1 ZINC000522564610 1028013818 /nfs/dbraw/zinc/01/38/18/1028013818.db2.gz FERYCGRAWLOQKE-CQSZACIVSA-N -1 3 337.398 4.078 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)N1CCC[C@H]1CC1CCCCC1 ZINC000523509957 1028163570 /nfs/dbraw/zinc/16/35/70/1028163570.db2.gz FKHXVYOXUCQQFM-INIZCTEOSA-N -1 3 334.435 4.176 20 0 EIADHM CC1(C)C[C@@H](NC(=O)c2cc([O-])ccc2Cl)c2ccc(F)cc2O1 ZINC000343099229 1028209452 /nfs/dbraw/zinc/20/94/52/1028209452.db2.gz NAAKEBPWZGVKED-OAHLLOKOSA-N -1 3 349.789 4.217 20 0 EIADHM CCN(Cc1ccc(Cl)s1)C(=O)c1cc([O-])ccc1Cl ZINC000431525348 1028210205 /nfs/dbraw/zinc/21/02/05/1028210205.db2.gz TZBDBDYUBFREBA-UHFFFAOYSA-N -1 3 330.236 4.423 20 0 EIADHM C[C@H]1CN(Cc2csc(-c3ccc(C(=O)[O-])cc3)n2)C(C)(C)C1 ZINC000583209560 1028259632 /nfs/dbraw/zinc/25/96/32/1028259632.db2.gz QUQHVPWLTMWENT-GFCCVEGCSA-N -1 3 330.453 4.129 20 0 EIADHM O=C(CCCCc1nc2ccccc2s1)[N-]OCCC(F)(F)F ZINC000162768016 1028346735 /nfs/dbraw/zinc/34/67/35/1028346735.db2.gz UXKMGAUITGQBGJ-UHFFFAOYSA-N -1 3 346.374 4.009 20 0 EIADHM CC(C)N(Cc1ccco1)Cc1nc2c3ccccc3oc2c(=O)[n-]1 ZINC000346328237 1028387930 /nfs/dbraw/zinc/38/79/30/1028387930.db2.gz FADTVXFGUHDSMN-UHFFFAOYSA-N -1 3 337.379 4.085 20 0 EIADHM [O-]c1cncc(/C=C/c2nc(Cc3cc(Cl)ccc3Cl)no2)c1 ZINC000445228224 1028395440 /nfs/dbraw/zinc/39/54/40/1028395440.db2.gz LEEYIJIMDCTNEK-DAFODLJHSA-N -1 3 348.189 4.238 20 0 EIADHM CCCN(C(=O)c1cc([O-])ccc1Cl)[C@@H]1CCCc2cccnc21 ZINC000347151753 1028890608 /nfs/dbraw/zinc/89/06/08/1028890608.db2.gz GETQWVUXANFWOM-QGZVFWFLSA-N -1 3 344.842 4.370 20 0 EIADHM [O-]c1cccnc1CNCc1ccc(-c2ccc(C(F)(F)F)cc2)o1 ZINC000475342910 1029557611 /nfs/dbraw/zinc/55/76/11/1029557611.db2.gz MLPNPKSNKFWYMR-UHFFFAOYSA-N -1 3 348.324 4.356 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2ccc(OC(C)C)c(C)c2)cc1F ZINC000525535527 1029667149 /nfs/dbraw/zinc/66/71/49/1029667149.db2.gz BKRCLQAFAFSFOB-UHFFFAOYSA-N -1 3 337.416 4.031 20 0 EIADHM CCc1ccc(CCNc2ccc(-c3nc(CC)cc(=O)[n-]3)cn2)cc1 ZINC000301289209 1029700772 /nfs/dbraw/zinc/70/07/72/1029700772.db2.gz SMGUJCYWAQXSLH-UHFFFAOYSA-N -1 3 348.450 4.024 20 0 EIADHM CC(C)N(Cc1ccccc1)C(=O)CCCc1ccc([O-])c(F)c1 ZINC000468371316 1029713282 /nfs/dbraw/zinc/71/32/82/1029713282.db2.gz ISWVOJITQUKBAM-UHFFFAOYSA-N -1 3 329.415 4.291 20 0 EIADHM CC1CCC(OC2CCN(Cc3csc(C(=O)[O-])c3)CC2)CC1 ZINC000584296988 1029719194 /nfs/dbraw/zinc/71/91/94/1029719194.db2.gz QLYAUPWWMNGIGX-UHFFFAOYSA-N -1 3 337.485 4.006 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@@H](c3ccccc3)C3CC3)nc2)n1 ZINC000301497590 1029744176 /nfs/dbraw/zinc/74/41/76/1029744176.db2.gz BULPCKFBBSDULF-FQEVSTJZSA-N -1 3 346.434 4.370 20 0 EIADHM CC(C)c1scnc1[N-]C(=O)c1cc(-c2ccccc2F)on1 ZINC000685297418 1029826717 /nfs/dbraw/zinc/82/67/17/1029826717.db2.gz VCJRABDNPHRJCJ-UHFFFAOYSA-N -1 3 331.372 4.313 20 0 EIADHM CCc1cccc(C)c1[N-]S(=O)(=O)c1ccc(OC(C)C)cc1 ZINC000096659293 1030019575 /nfs/dbraw/zinc/01/95/75/1030019575.db2.gz DNCLKKWWKMXSPT-UHFFFAOYSA-N -1 3 333.453 4.145 20 0 EIADHM CCC(C)(C)OCc1ccccc1NC(=O)Cc1ccc([O-])c(F)c1 ZINC000450838429 1030044783 /nfs/dbraw/zinc/04/47/83/1030044783.db2.gz OVJOTCMWBUEFJK-UHFFFAOYSA-N -1 3 345.414 4.418 20 0 EIADHM Cc1ccc(-c2csc3[n-]c(-c4ccccn4)nc(=O)c23)s1 ZINC000055490933 1030104475 /nfs/dbraw/zinc/10/44/75/1030104475.db2.gz DXDYTCWEJQWVGY-UHFFFAOYSA-N -1 3 325.418 4.084 20 0 EIADHM O=C([O-])c1ccc(F)c2c1CN(CCCc1ccc(Cl)cc1)CC2 ZINC000530169147 1030165884 /nfs/dbraw/zinc/16/58/84/1030165884.db2.gz QVQGNRSSBGSWOU-UHFFFAOYSA-N -1 3 347.817 4.168 20 0 EIADHM [O-]c1cccc(CNCc2ccc(Br)cc2)c1Cl ZINC000385648468 1030184233 /nfs/dbraw/zinc/18/42/33/1030184233.db2.gz WEVUWJZOGLMJMX-UHFFFAOYSA-N -1 3 326.621 4.098 20 0 EIADHM C[C@H]1CC[C@@H](C(=O)[O-])CN1CCSc1cc(Cl)ccc1Cl ZINC000396993446 1030193516 /nfs/dbraw/zinc/19/35/16/1030193516.db2.gz BIBNPWZKDGBBSH-WDEREUQCSA-N -1 3 348.295 4.271 20 0 EIADHM C[C@H](Oc1ccc2ccccc2c1)C(=O)Nc1cccc([O-])c1F ZINC000526920927 1030329699 /nfs/dbraw/zinc/32/96/99/1030329699.db2.gz LVOIPAHBXLVDKV-LBPRGKRZSA-N -1 3 325.339 4.091 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)Nc1ccc(O)c2ccccc12 ZINC000530351560 1030330667 /nfs/dbraw/zinc/33/06/67/1030330667.db2.gz GYLZSRGIOWUKMK-UHFFFAOYSA-N -1 3 339.366 4.352 20 0 EIADHM CC[C@@H](NC(=O)NCc1ccc([O-])c(F)c1)c1cccc(Cl)c1 ZINC000303805140 1030345083 /nfs/dbraw/zinc/34/50/83/1030345083.db2.gz MINSLDZWPXOUHA-OAHLLOKOSA-N -1 3 336.794 4.135 20 0 EIADHM O=C1[N-]C(=O)C(=CNc2ccc(-c3ccccc3)cc2)c2ccccc21 ZINC000145225921 1030378856 /nfs/dbraw/zinc/37/88/56/1030378856.db2.gz IHZOLXNIUJVPCF-XSFVSMFZSA-N -1 3 340.382 4.077 20 0 EIADHM CCc1ccc(C(=O)N2CCC(c3ccccc3F)CC2)c([O-])c1 ZINC000527046598 1030425125 /nfs/dbraw/zinc/42/51/25/1030425125.db2.gz VHXAHDSZZVWGKW-UHFFFAOYSA-N -1 3 327.399 4.114 20 0 EIADHM CCc1cccc(C(=O)N2C[C@@H](c3ccc(F)cc3)C[C@H]2C)c1[O-] ZINC000530719667 1030671407 /nfs/dbraw/zinc/67/14/07/1030671407.db2.gz SVCOQQXEKATLMQ-CJNGLKHVSA-N -1 3 327.399 4.112 20 0 EIADHM CN(Cc1c(F)cccc1F)C(=O)c1cc([O-])c2ccccc2c1 ZINC000358277501 1030747862 /nfs/dbraw/zinc/74/78/62/1030747862.db2.gz PPIDPORKYOKMAX-UHFFFAOYSA-N -1 3 327.330 4.096 20 0 EIADHM CN(Cc1cccc(O)c1)C(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000530844606 1030765347 /nfs/dbraw/zinc/76/53/47/1030765347.db2.gz VCBYIOXSGZCOKN-UHFFFAOYSA-N -1 3 349.386 4.162 20 0 EIADHM O=C(Nc1cc(Br)ccc1[O-])c1cccc(Cl)c1 ZINC000530917150 1030799005 /nfs/dbraw/zinc/79/90/05/1030799005.db2.gz WVEVOCLUQZLTLS-UHFFFAOYSA-N -1 3 326.577 4.060 20 0 EIADHM CSc1ccc([O-])c(C(=O)N2CC[C@H](c3ccccc3)[C@H]2C)c1 ZINC000612072111 1030847055 /nfs/dbraw/zinc/84/70/55/1030847055.db2.gz VGVYHPPRZKUVKN-CJNGLKHVSA-N -1 3 327.449 4.132 20 0 EIADHM O=C(Cc1ccc([O-])c(F)c1)Nc1ccccc1N1CCCCCC1 ZINC000448637532 1030911399 /nfs/dbraw/zinc/91/13/99/1030911399.db2.gz DMOMSHAWXAMOOS-UHFFFAOYSA-N -1 3 342.414 4.093 20 0 EIADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)C(C)(C)C(C)(F)F)c2)n1 ZINC000448726099 1030989748 /nfs/dbraw/zinc/98/97/48/1030989748.db2.gz RONFQPMFVUTECN-UHFFFAOYSA-N -1 3 349.381 4.032 20 0 EIADHM Cc1cccc([C@H](C)C(=O)Nc2cc(Br)ccc2[O-])c1 ZINC000531253748 1031027276 /nfs/dbraw/zinc/02/72/76/1031027276.db2.gz FTGXBEYCBKUMBH-NSHDSACASA-N -1 3 334.213 4.205 20 0 EIADHM CC(C)Cn1ccnc1CN[C@H](C)c1cc(Cl)c(Cl)cc1[O-] ZINC000192898382 1031136882 /nfs/dbraw/zinc/13/68/82/1031136882.db2.gz ZIICFOCBZJRRCZ-LLVKDONJSA-N -1 3 342.270 4.402 20 0 EIADHM COc1ccccc1C[C@@H](C)N(C)Cc1cc(C(=O)[O-])ccc1Cl ZINC000569981443 1031529487 /nfs/dbraw/zinc/52/94/87/1031529487.db2.gz DXJKCNWRDPRRFL-CYBMUJFWSA-N -1 3 347.842 4.110 20 0 EIADHM [O-]c1ccc(F)c(CN[C@H]2CCCc3c(F)cc(F)cc32)c1F ZINC000449351834 1031650080 /nfs/dbraw/zinc/65/00/80/1031650080.db2.gz RBIZRBHVIUESFX-HNNXBMFYSA-N -1 3 325.305 4.116 20 0 EIADHM Cc1ccc(NCc2ccc([O-])c(F)c2)cc1C(=O)N1CCCCC1 ZINC000894087172 1033320807 /nfs/dbraw/zinc/32/08/07/1033320807.db2.gz GFMXTVKLQOXECL-UHFFFAOYSA-N -1 3 342.414 4.078 20 0 EIADHM Cc1ccc([O-])c(C(=O)Nc2ccc(-c3cn4c(n3)CCCC4)cc2)c1 ZINC000512605071 1033489898 /nfs/dbraw/zinc/48/98/98/1033489898.db2.gz VKDPEBDPNVNLQC-UHFFFAOYSA-N -1 3 347.418 4.153 20 0 EIADHM CCCN(CCC)C(=O)c1ccc(NCc2cc([O-])cc(F)c2)cc1 ZINC000512647614 1033601956 /nfs/dbraw/zinc/60/19/56/1033601956.db2.gz FTVKSAJFYDSYNW-UHFFFAOYSA-N -1 3 344.430 4.406 20 0 EIADHM CCN(Cc1occc1C)Cc1nc2c3ccccc3oc2c(=O)[n-]1 ZINC000412024980 1034168901 /nfs/dbraw/zinc/16/89/01/1034168901.db2.gz GXAQQMBOYSIDSF-UHFFFAOYSA-N -1 3 337.379 4.005 20 0 EIADHM COc1ccc(OC(C)C)c(NC(=O)c2cc([O-])ccc2Cl)c1 ZINC000433344363 1034251057 /nfs/dbraw/zinc/25/10/57/1034251057.db2.gz RHUPERMBXVRCTQ-UHFFFAOYSA-N -1 3 335.787 4.094 20 0 EIADHM CC(C)n1c2ccccc2nc1[C@H]1CCCN1CCCCC(=O)[O-] ZINC000262301906 1034898521 /nfs/dbraw/zinc/89/85/21/1034898521.db2.gz ZXBPSNDAMKRWAB-QGZVFWFLSA-N -1 3 329.444 4.009 20 0 EIADHM O=c1nc(-c2ccncn2)[n-]c2scc(-c3ccc(Cl)cc3)c21 ZINC000345362021 1035200149 /nfs/dbraw/zinc/20/01/49/1035200149.db2.gz BVAAYZXIQFHCSI-UHFFFAOYSA-N -1 3 340.795 4.174 20 0 EIADHM Cc1ccc([O-])c(NC(=O)c2cncc(-c3ccc(Cl)cc3)c2)n1 ZINC000345933167 1035333628 /nfs/dbraw/zinc/33/36/28/1035333628.db2.gz SBUNUXJECZAYLV-UHFFFAOYSA-N -1 3 339.782 4.063 20 0 EIADHM CC(C)c1ccc([C@H](CC(=O)[O-])NCc2cnc(C3CC3)s2)cc1 ZINC000575025955 1035656769 /nfs/dbraw/zinc/65/67/69/1035656769.db2.gz HAPKKJDHLIGSKJ-KRWDZBQOSA-N -1 3 344.480 4.450 20 0 EIADHM Cc1cc(S(=O)(=O)[N-]C[C@H]2CCCC(C)(C)C2)sc1Cl ZINC001212177592 1035667834 /nfs/dbraw/zinc/66/78/34/1035667834.db2.gz RPNUWJMCRMNIMG-NSHDSACASA-N -1 3 335.922 4.205 20 0 EIADHM CCCc1cc(=O)[n-]c(C(=Cc2ccc(C(F)(F)F)[nH]2)CC)n1 ZINC000905072591 1035729454 /nfs/dbraw/zinc/72/94/54/1035729454.db2.gz GBMWMUQPVYIWPZ-NTMALXAHSA-N -1 3 325.334 4.432 20 0 EIADHM CC1(C)CN(C(=O)c2cc([O-])c3ccccc3c2)[C@@H]1c1ccncc1 ZINC000349726971 1036077101 /nfs/dbraw/zinc/07/71/01/1036077101.db2.gz JNAJUCQQVKTIOW-LJQANCHMSA-N -1 3 332.403 4.164 20 0 EIADHM CCSCc1cc(C(=O)[N-]c2cscc2Br)no1 ZINC000597720586 1036330182 /nfs/dbraw/zinc/33/01/82/1036330182.db2.gz XHDSPPKLYLKXLZ-UHFFFAOYSA-N -1 3 347.259 4.004 20 0 EIADHM CC[C@H](Cc1ccccc1)C(=O)Nc1ccc(Br)cc1[O-] ZINC000602093178 1036333013 /nfs/dbraw/zinc/33/30/13/1036333013.db2.gz JXCCZDCKGBCXNT-CYBMUJFWSA-N -1 3 348.240 4.362 20 0 EIADHM CCC1(CC)CCN(Cc2nc3c4ccccc4oc3c(=O)[n-]2)CC1 ZINC000485909248 1036356787 /nfs/dbraw/zinc/35/67/87/1036356787.db2.gz VWROHISYDJXXKN-UHFFFAOYSA-N -1 3 339.439 4.484 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@@H]3CCC[C@H](C(C)C)C3)nc2)n1 ZINC000597939941 1036403346 /nfs/dbraw/zinc/40/33/46/1036403346.db2.gz PPLDFWHWLVEDJC-WMLDXEAASA-N -1 3 340.471 4.433 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@H]3CCC[C@@H](C(C)C)C3)nc2)n1 ZINC000597939936 1036403373 /nfs/dbraw/zinc/40/33/73/1036403373.db2.gz PPLDFWHWLVEDJC-PBHICJAKSA-N -1 3 340.471 4.433 20 0 EIADHM CCn1c2ccc(C(=O)[O-])cc2nc1CN1CCC[C@@H](C(C)C)CC1 ZINC000572008730 1036406865 /nfs/dbraw/zinc/40/68/65/1036406865.db2.gz YSSUXLZFQFNOJN-OAHLLOKOSA-N -1 3 343.471 4.013 20 0 EIADHM CC(C)c1ccc2c(c1)[C@H](NC(=O)NCc1ccc([O-])c(F)c1)CC2 ZINC000430048606 1036471972 /nfs/dbraw/zinc/47/19/72/1036471972.db2.gz XVFYWIYSCBXPOX-GOSISDBHSA-N -1 3 342.414 4.141 20 0 EIADHM O=C([O-])c1ccc(CN2CCC[C@H]2Cc2ccccc2Cl)c(F)c1 ZINC000572413771 1036493495 /nfs/dbraw/zinc/49/34/95/1036493495.db2.gz SKLGGFNNMHRXHI-INIZCTEOSA-N -1 3 347.817 4.384 20 0 EIADHM CO[C@H](C)c1cccc([N-]S(=O)(=O)c2c(C)c(C)cc(C)c2C)c1 ZINC000588833878 1036541983 /nfs/dbraw/zinc/54/19/83/1036541983.db2.gz VRFZXXFYRHXZJY-MRXNPFEDSA-N -1 3 347.480 4.428 20 0 EIADHM Cc1cc(=O)[n-]c([C@H](C)Sc2ncc(C(F)(F)F)cc2Cl)n1 ZINC000486559676 1036768748 /nfs/dbraw/zinc/76/87/48/1036768748.db2.gz HYXYNKPIOPKSFV-ZETCQYMHSA-N -1 3 349.765 4.411 20 0 EIADHM O=C(CCc1ccc2ccccc2n1)Nc1ccc(Cl)cc1[O-] ZINC000486791006 1036855836 /nfs/dbraw/zinc/85/58/36/1036855836.db2.gz JNNLSMYWUHCRFD-UHFFFAOYSA-N -1 3 326.783 4.165 20 0 EIADHM CCCc1nnc([N-]C(=O)c2oc3ccccc3c2CSC)s1 ZINC000603821152 1037021666 /nfs/dbraw/zinc/02/16/66/1037021666.db2.gz SOCGLGOAANZCBZ-UHFFFAOYSA-N -1 3 347.465 4.352 20 0 EIADHM CC(=O)c1cc(F)c([N-]C(=O)c2csc(C(C)(C)C)n2)c(F)c1 ZINC000271954892 1037064007 /nfs/dbraw/zinc/06/40/07/1037064007.db2.gz BUIDQULFKVNBEH-UHFFFAOYSA-N -1 3 338.379 4.174 20 0 EIADHM Cc1cc(NCc2cc(=O)[n-]c(C3CC3)n2)ccc1-c1ccncc1 ZINC000669366092 1037107133 /nfs/dbraw/zinc/10/71/33/1037107133.db2.gz GRZVBLNCBUKTKT-UHFFFAOYSA-N -1 3 332.407 4.042 20 0 EIADHM COc1cccc([C@H]([N-]c2nc3cc(C)ccc3o2)c2nccn2C)c1 ZINC000604034395 1037164252 /nfs/dbraw/zinc/16/42/52/1037164252.db2.gz KJGAKOVYDVKVOX-SFHVURJKSA-N -1 3 348.406 4.080 20 0 EIADHM CC(C)(C)C[C@H](NC(=O)c1cc(=O)c2ccccc2[n-]1)C(F)(F)F ZINC000272441202 1037188816 /nfs/dbraw/zinc/18/88/16/1037188816.db2.gz IGJGHPZRJSWDOQ-AWEZNQCLSA-N -1 3 340.345 4.037 20 0 EIADHM CCCCCc1nnc([N-]C(=O)c2sccc2OC(F)F)s1 ZINC000591151961 1037307363 /nfs/dbraw/zinc/30/73/63/1037307363.db2.gz VDEZWBPERDCGLQ-UHFFFAOYSA-N -1 3 347.412 4.186 20 0 EIADHM O=C([N-]c1cc(F)c(F)cc1F)c1cc(-c2ccccc2F)on1 ZINC000591248846 1037340132 /nfs/dbraw/zinc/34/01/32/1037340132.db2.gz GOBOLIZOWSURAF-UHFFFAOYSA-N -1 3 336.244 4.150 20 0 EIADHM CC1(C)CCC([S@@](=O)Cc2cc(=O)[n-]c(-c3ccccc3)n2)CC1 ZINC000591247762 1037341011 /nfs/dbraw/zinc/34/10/11/1037341011.db2.gz PVFSQFHOOJTTAC-DEOSSOPVSA-N -1 3 344.480 4.067 20 0 EIADHM CC(C)c1ccc(C(=O)N2CCCO[C@H](c3ccccc3)C2)c([O-])c1 ZINC000591831715 1037609538 /nfs/dbraw/zinc/60/95/38/1037609538.db2.gz LSCWGMCWNYWFBH-FQEVSTJZSA-N -1 3 339.435 4.119 20 0 EIADHM CSc1ccc([O-])c(C(=O)N2C[C@H](c3ccc(F)cc3)C[C@H]2C)c1 ZINC000668944201 1037940380 /nfs/dbraw/zinc/94/03/80/1037940380.db2.gz FLPHTBUGEOYDSB-TZMCWYRMSA-N -1 3 345.439 4.271 20 0 EIADHM O=C([O-])C[C@H](NCc1cnc(C2CCCC2)s1)c1cccs1 ZINC000669472631 1037942550 /nfs/dbraw/zinc/94/25/50/1037942550.db2.gz GKPHCDIXZJLNIT-ZDUSSCGKSA-N -1 3 336.482 4.168 20 0 EIADHM O=C([N-]c1ccc(-c2ccco2)cc1F)c1cc(-c2ccccn2)no1 ZINC000489385268 1038018465 /nfs/dbraw/zinc/01/84/65/1038018465.db2.gz DIWCJCCPVBKPSR-UHFFFAOYSA-N -1 3 349.321 4.388 20 0 EIADHM C[C@H](C(=O)NCc1ccc([O-])c(F)c1)c1c(Cl)cccc1Cl ZINC000606537170 1038153992 /nfs/dbraw/zinc/15/39/92/1038153992.db2.gz VJVQWYRMQKASEC-VIFPVBQESA-N -1 3 342.197 4.258 20 0 EIADHM O=C([O-])c1coc(CN2CCCCC[C@@H]2/C=C/c2cccs2)c1 ZINC000574578235 1038297340 /nfs/dbraw/zinc/29/73/40/1038297340.db2.gz NQHSXMMNOQOKDE-MVGZEHJDSA-N -1 3 331.437 4.497 20 0 EIADHM CC1CCC(OC2CCN(Cc3ccsc3C(=O)[O-])CC2)CC1 ZINC000574644279 1038315510 /nfs/dbraw/zinc/31/55/10/1038315510.db2.gz OMLVUZXKPLHDJL-UHFFFAOYSA-N -1 3 337.485 4.006 20 0 EIADHM Cc1cc(=O)[n-]c(-c2ccc(NC(=O)C3CCCCCCC3)cc2)n1 ZINC000172803508 1038342034 /nfs/dbraw/zinc/34/20/34/1038342034.db2.gz JNVWIBWZOZMBRC-UHFFFAOYSA-N -1 3 339.439 4.044 20 0 EIADHM Cc1ccccc1N(C)C(=O)c1c[n-]c(=NC(=O)OC(C)(C)C)s1 ZINC000912830729 1038349018 /nfs/dbraw/zinc/34/90/18/1038349018.db2.gz YUNFUOZIWRMCND-UHFFFAOYSA-N -1 3 347.440 4.075 20 0 EIADHM C[C@H](C(=O)Nc1ccc([O-])c(C(F)(F)F)c1)c1c(F)cccc1F ZINC000490210966 1038376746 /nfs/dbraw/zinc/37/67/46/1038376746.db2.gz QJRIUESMJMYBAM-QMMMGPOBSA-N -1 3 345.267 4.431 20 0 EIADHM O=C(NCCCC(F)(F)F)c1cc(Cc2ccccc2)ccc1[O-] ZINC000608489776 1038836825 /nfs/dbraw/zinc/83/68/25/1038836825.db2.gz WZHPIZBJIPLFTD-UHFFFAOYSA-N -1 3 337.341 4.055 20 0 EIADHM [O-]c1ccc(F)c(CNC[C@H](Cc2ccccc2)C(F)(F)F)c1F ZINC000552051704 1039072365 /nfs/dbraw/zinc/07/23/65/1039072365.db2.gz CALOKRGZHALPEM-LBPRGKRZSA-N -1 3 345.311 4.181 20 0 EIADHM CC[C@@H](C)Oc1ccc(-c2nc3cc(Cl)ccc3c(=O)[n-]2)cc1 ZINC000481195431 1039104328 /nfs/dbraw/zinc/10/43/28/1039104328.db2.gz HTMGXLFPMSWMOW-LLVKDONJSA-N -1 3 328.799 4.421 20 0 EIADHM CC(=O)c1cccc(NC(=O)[C@H](Cc2ccccc2)C(C)C)c1[O-] ZINC000552287040 1039342140 /nfs/dbraw/zinc/34/21/40/1039342140.db2.gz GNXZONKUZSIOBT-QGZVFWFLSA-N -1 3 325.408 4.048 20 0 EIADHM Cc1ccc(Cl)c(O[C@H](C)C(=O)Nc2c([O-])cccc2Cl)c1 ZINC000552433568 1039511834 /nfs/dbraw/zinc/51/18/34/1039511834.db2.gz PVPHLHXEMSIEEG-SNVBAGLBSA-N -1 3 340.206 4.413 20 0 EIADHM O=C(Cc1cccc(C(F)(F)F)c1)Nc1c([O-])cccc1Cl ZINC000552433427 1039512289 /nfs/dbraw/zinc/51/22/89/1039512289.db2.gz IUGSZURTOVSQCC-UHFFFAOYSA-N -1 3 329.705 4.246 20 0 EIADHM CC1(C)C[C@@H](c2ccccc2)N(C(=O)c2cc(=O)c3ccccc3[n-]2)C1 ZINC000425124563 1039782947 /nfs/dbraw/zinc/78/29/47/1039782947.db2.gz UPRXAQYJBZWKBX-IBGZPJMESA-N -1 3 346.430 4.142 20 0 EIADHM C[C@](Cc1ccccc1)(NC(=O)c1cc([O-])ccc1Cl)C1CC1 ZINC000457047157 1039807646 /nfs/dbraw/zinc/80/76/46/1039807646.db2.gz OXHPLMVRYHKCJB-LJQANCHMSA-N -1 3 329.827 4.187 20 0 EIADHM CCc1c([N-]C(=O)c2cc(C(CC)CC)no2)onc1C(F)(F)F ZINC000476750664 1039856967 /nfs/dbraw/zinc/85/69/67/1039856967.db2.gz WONXDJBWMAPUSH-UHFFFAOYSA-N -1 3 345.321 4.400 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)N1CCc2cc(Cl)ccc21 ZINC000552960496 1039885828 /nfs/dbraw/zinc/88/58/28/1039885828.db2.gz SHGJQWNRRDNSRO-UHFFFAOYSA-N -1 3 333.790 4.097 20 0 EIADHM O=S(=O)([N-]c1ccc(Cl)cc1F)c1cc(F)cc(Cl)c1 ZINC000535136950 1039994759 /nfs/dbraw/zinc/99/47/59/1039994759.db2.gz FZPCCGONTAESLQ-UHFFFAOYSA-N -1 3 338.162 4.072 20 0 EIADHM CC(C)c1ccc2occ(C(=O)Nc3n[n-]c(-c4ccco4)n3)c2c1 ZINC000553292046 1040098302 /nfs/dbraw/zinc/09/83/02/1040098302.db2.gz WFZNPRKWAWXFRY-UHFFFAOYSA-N -1 3 336.351 4.187 20 0 EIADHM Cc1cccc(C(=O)Nc2ccc(Cl)cc2[O-])c1Br ZINC000535308063 1040176915 /nfs/dbraw/zinc/17/69/15/1040176915.db2.gz SJCUQFTXCPXEFW-UHFFFAOYSA-N -1 3 340.604 4.369 20 0 EIADHM CCCc1cc(=O)[n-]c(C(=Cc2ccc(OCC)c(F)c2)CC)n1 ZINC000435338974 1040295290 /nfs/dbraw/zinc/29/52/90/1040295290.db2.gz MFGHQAOVSJJGCI-UVTDQMKNSA-N -1 3 330.403 4.211 20 0 EIADHM O=C([O-])C[C@@H](NCc1cc(Cl)cc(Cl)c1)c1cccs1 ZINC000037424423 1040371380 /nfs/dbraw/zinc/37/13/80/1040371380.db2.gz PNCUADLQQZOVFR-GFCCVEGCSA-N -1 3 330.236 4.361 20 0 EIADHM Cc1cccc(F)c1S(=O)(=O)[N-]c1ccc(Cl)cc1Cl ZINC000479529014 1040455810 /nfs/dbraw/zinc/45/58/10/1040455810.db2.gz RWBYPMYGUSPHAS-UHFFFAOYSA-N -1 3 334.199 4.242 20 0 EIADHM Cc1ccc(NC(=O)NCc2ccc([O-])c(Br)c2)cc1C ZINC000482760218 1040475745 /nfs/dbraw/zinc/47/57/45/1040475745.db2.gz PDSFSFBUSPOLQW-UHFFFAOYSA-N -1 3 349.228 4.093 20 0 EIADHM O=S(=O)([N-]c1cc(F)c(F)cc1F)c1cccc2ccccc21 ZINC000084460895 1040559676 /nfs/dbraw/zinc/55/96/76/1040559676.db2.gz ZLAXAIZSBASJOI-UHFFFAOYSA-N -1 3 337.322 4.058 20 0 EIADHM O=C(NC[C@@H]1CCC[C@@H](C(F)(F)F)C1)c1cc([O-])ccc1Cl ZINC000551770258 1040573490 /nfs/dbraw/zinc/57/34/90/1040573490.db2.gz HKFBDAWYOJMAJS-NXEZZACHSA-N -1 3 335.753 4.144 20 0 EIADHM CC(C)N(CC1CC1)C(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000539846237 1040837926 /nfs/dbraw/zinc/83/79/26/1040837926.db2.gz RUPVDMOIJKNTQR-UHFFFAOYSA-N -1 3 325.408 4.445 20 0 EIADHM O=C(Nc1cccc(O)c1F)c1cc(Oc2ccccc2)ccc1[O-] ZINC000539865348 1040854691 /nfs/dbraw/zinc/85/46/91/1040854691.db2.gz MSVSWWHSVSURHI-UHFFFAOYSA-N -1 3 339.322 4.282 20 0 EIADHM O=C(c1ccccc1[O-])N1CCC(Sc2ccc(Cl)cc2)CC1 ZINC000155796352 1041039177 /nfs/dbraw/zinc/03/91/77/1041039177.db2.gz BXYXRDKBYGWLQG-UHFFFAOYSA-N -1 3 347.867 4.443 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(NCCCCC3CCCC3)nc2)n1 ZINC000462945627 1041126586 /nfs/dbraw/zinc/12/65/86/1041126586.db2.gz RZIWUKQVFOWULU-UHFFFAOYSA-N -1 3 340.471 4.001 20 0 EIADHM COc1ccc2oc(CN[C@H](CC(=O)[O-])c3cccc(C)c3)cc2c1 ZINC000904046187 1041301287 /nfs/dbraw/zinc/30/12/87/1041301287.db2.gz WTQLQURKJLWLLC-GOSISDBHSA-N -1 3 339.391 4.055 20 0 EIADHM Cc1cccc([C@H](CC(=O)[O-])NCc2ccc(C(F)(F)F)s2)c1 ZINC000904045922 1041301351 /nfs/dbraw/zinc/30/13/51/1041301351.db2.gz RKZNXHDZCOIMRJ-ZDUSSCGKSA-N -1 3 343.370 4.381 20 0 EIADHM Cc1ccc(C(=O)N(C)[C@H](C)c2ccccc2Br)c([O-])c1 ZINC000436522268 1041305901 /nfs/dbraw/zinc/30/59/01/1041305901.db2.gz SPAJTUUAHJMKAP-GFCCVEGCSA-N -1 3 348.240 4.296 20 0 EIADHM O=C([O-])C[C@@H](CNCc1nc2cc(F)ccc2o1)C1CCCCCC1 ZINC000904026753 1041306700 /nfs/dbraw/zinc/30/67/00/1041306700.db2.gz JVIMWPNIEQHIEH-AWEZNQCLSA-N -1 3 348.418 4.118 20 0 EIADHM Cc1cc(F)c(CN[C@@H](Cc2c(C)cccc2C)C(=O)[O-])c(Cl)c1 ZINC000904072107 1041318564 /nfs/dbraw/zinc/31/85/64/1041318564.db2.gz TWWPDSAWXUVTAO-SFHVURJKSA-N -1 3 349.833 4.190 20 0 EIADHM CCCCCN(C(=O)c1cc(OC)c([O-])c(OC)c1)[C@H](C)CCC ZINC000436536957 1041320626 /nfs/dbraw/zinc/32/06/26/1041320626.db2.gz QSKZYTXDRUMVJT-CQSZACIVSA-N -1 3 337.460 4.230 20 0 EIADHM Cc1ccc(C(=O)Nc2ccc(F)cc2OCC(F)(F)F)c([O-])c1 ZINC000436548374 1041323150 /nfs/dbraw/zinc/32/31/50/1041323150.db2.gz MARGGSHCSZDUIS-UHFFFAOYSA-N -1 3 343.276 4.033 20 0 EIADHM Cc1cnc([C@@H](NC(=O)c2ccc(C(C)C)cc2[O-])C2CC2)s1 ZINC000436591391 1041350956 /nfs/dbraw/zinc/35/09/56/1041350956.db2.gz PXTMKXZWHLZBLP-INIZCTEOSA-N -1 3 330.453 4.162 20 0 EIADHM CSC[C@@H]1CCCN1C(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436598328 1041357005 /nfs/dbraw/zinc/35/70/05/1041357005.db2.gz YMRGNBCIMBEBON-AWEZNQCLSA-N -1 3 343.448 4.152 20 0 EIADHM C[C@@H](N(C)C(=O)c1cc(Oc2ccccc2)ccc1[O-])C1(C)CC1 ZINC000436590655 1041365000 /nfs/dbraw/zinc/36/50/00/1041365000.db2.gz UFZKIRIBDZAMOL-CQSZACIVSA-N -1 3 325.408 4.445 20 0 EIADHM Cc1cccc(C2(C(=O)Nc3ccc(Br)cc3[O-])CC2)c1 ZINC000516180241 1041444744 /nfs/dbraw/zinc/44/47/44/1041444744.db2.gz ZBEHRKWQONWFJC-UHFFFAOYSA-N -1 3 346.224 4.133 20 0 EIADHM Cc1ccc(C)c(Sc2nc3c(cnn3-c3ccccc3)c(=O)[n-]2)c1 ZINC000461466541 1041457678 /nfs/dbraw/zinc/45/76/78/1041457678.db2.gz ZLGCWEVCIWGRKP-UHFFFAOYSA-N -1 3 348.431 4.289 20 0 EIADHM Cc1ccc(C(=O)N(Cc2ccc([C@@H]3C[C@@H]3C)o2)C2CC2)c([O-])c1 ZINC000436759889 1041458333 /nfs/dbraw/zinc/45/83/33/1041458333.db2.gz HVOLVPMKXGAVRY-SUMWQHHRSA-N -1 3 325.408 4.222 20 0 EIADHM C[C@@H]1c2cccn2CCN1C(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436753171 1041465314 /nfs/dbraw/zinc/46/53/14/1041465314.db2.gz COUWNZQIFRDGHY-OAHLLOKOSA-N -1 3 348.402 4.203 20 0 EIADHM O=C(c1ccc(O)cc1[O-])N(Cc1ccccc1)C1CCCCC1 ZINC000436781722 1041479591 /nfs/dbraw/zinc/47/95/91/1041479591.db2.gz FOVVUPSNMXNVIK-UHFFFAOYSA-N -1 3 325.408 4.073 20 0 EIADHM CCSc1cccc(-c2noc(-c3cc(OC)ccc3[O-])n2)c1 ZINC000436789956 1041481692 /nfs/dbraw/zinc/48/16/92/1041481692.db2.gz MJHDDQYQFMTCKJ-UHFFFAOYSA-N -1 3 328.393 4.230 20 0 EIADHM Cc1ccc(C(=O)N2CCC(c3ccc(F)cc3C)CC2)c([O-])c1 ZINC000436797236 1041485539 /nfs/dbraw/zinc/48/55/39/1041485539.db2.gz ZJUXLQSCDPZPKT-UHFFFAOYSA-N -1 3 327.399 4.168 20 0 EIADHM Cc1cc(-c2ccc(O)cc2[O-])nc2ccc(Br)cc12 ZINC000436818472 1041487544 /nfs/dbraw/zinc/48/75/44/1041487544.db2.gz FJAFQUIOKHVELO-UHFFFAOYSA-N -1 3 330.181 4.384 20 0 EIADHM CCc1ccc(C(=O)N2CCn3cccc3[C@H]2c2ccccc2)c([O-])c1 ZINC000436809462 1041490706 /nfs/dbraw/zinc/49/07/06/1041490706.db2.gz SULBOJULUTVOBL-OAQYLSRUSA-N -1 3 346.430 4.002 20 0 EIADHM O=C(c1ccc(O)cc1[O-])N1CCCCC[C@@H]1/C=C\c1cccs1 ZINC000436809437 1041491140 /nfs/dbraw/zinc/49/11/40/1041491140.db2.gz OSPFHHVUXDMMSL-IUCKJTJTSA-N -1 3 343.448 4.258 20 0 EIADHM Cc1ccc(C)c(CSCc2noc(-c3ccccc3[O-])n2)c1 ZINC000436813429 1041493514 /nfs/dbraw/zinc/49/35/14/1041493514.db2.gz HSZUKTUALGHHHC-UHFFFAOYSA-N -1 3 326.421 4.492 20 0 EIADHM CCc1nc2c(s1)[C@H](N(C)C(=O)c1ccc(CC)cc1[O-])CCC2 ZINC000436836690 1041497802 /nfs/dbraw/zinc/49/78/02/1041497802.db2.gz MTIVTHZTBGKKOV-OAHLLOKOSA-N -1 3 344.480 4.123 20 0 EIADHM CCc1ccc(C(=O)N(C)[C@H](COC)c2ccc(Cl)cc2)c([O-])c1 ZINC000436834238 1041498883 /nfs/dbraw/zinc/49/88/83/1041498883.db2.gz LKTFZWAJRDVVRL-QGZVFWFLSA-N -1 3 347.842 4.068 20 0 EIADHM CCc1ccc(-c2nc(Cc3cccc4cccnc43)no2)c([O-])c1 ZINC000436842911 1041511472 /nfs/dbraw/zinc/51/14/72/1041511472.db2.gz YCRGHLJLGVLWAU-UHFFFAOYSA-N -1 3 331.375 4.144 20 0 EIADHM CCc1ccc(-c2nc([C@H](C)c3c(F)cccc3F)no2)c([O-])c1 ZINC000436863967 1041523736 /nfs/dbraw/zinc/52/37/36/1041523736.db2.gz LWPDXUQRIBWQJN-SNVBAGLBSA-N -1 3 330.334 4.435 20 0 EIADHM CCc1ccc(-c2nc([C@H](OC)c3cccc(Cl)c3)no2)c([O-])c1 ZINC000436863289 1041523935 /nfs/dbraw/zinc/52/39/35/1041523935.db2.gz IJCATENQVWCRIN-MRXNPFEDSA-N -1 3 344.798 4.394 20 0 EIADHM Cc1ccc2ncc(-c3noc(-c4cc5ccccc5cc4[O-])n3)n2c1 ZINC000436878314 1041535883 /nfs/dbraw/zinc/53/58/83/1041535883.db2.gz BJOIAXKBAOYJDP-UHFFFAOYSA-N -1 3 342.358 4.219 20 0 EIADHM CCc1ccc(-c2nc(-c3ccnc(C(F)(F)F)c3)no2)c([O-])c1 ZINC000436886515 1041541963 /nfs/dbraw/zinc/54/19/63/1041541963.db2.gz SJSFNEPPHWBYFT-UHFFFAOYSA-N -1 3 335.285 4.085 20 0 EIADHM CCN(C(=O)c1cc2c(cc1[O-])CCCC2)c1ccc2[nH]ccc2c1 ZINC000436887103 1041542010 /nfs/dbraw/zinc/54/20/10/1041542010.db2.gz OUQFXHVEAUSIPB-UHFFFAOYSA-N -1 3 334.419 4.419 20 0 EIADHM CCc1ccc([O-])c(C(=O)N2CCCCC[C@H]2[C@H]2CCCCC2=O)c1 ZINC000538784914 1041542361 /nfs/dbraw/zinc/54/23/61/1041542361.db2.gz QVMADPFZVWPUBA-AEFFLSMTSA-N -1 3 343.467 4.099 20 0 EIADHM Cc1ccc(-c2nc(-c3cccc(NC(=O)C4CCC4)c3)no2)c([O-])c1 ZINC000436900901 1041552959 /nfs/dbraw/zinc/55/29/59/1041552959.db2.gz FFESBNPPYPLWQA-UHFFFAOYSA-N -1 3 349.390 4.156 20 0 EIADHM CC(C)[C@@H](c1ccccc1Cl)N(C)C(=O)c1ccc(O)cc1[O-] ZINC000436920818 1041559232 /nfs/dbraw/zinc/55/92/32/1041559232.db2.gz QUZSMQMKLPIIDZ-KRWDZBQOSA-N -1 3 333.815 4.221 20 0 EIADHM C[C@H](NC(=O)c1cc(Oc2ccccc2)ccc1[O-])c1ccccn1 ZINC000436924130 1041559602 /nfs/dbraw/zinc/55/96/02/1041559602.db2.gz FHPIDFGETGEFMU-AWEZNQCLSA-N -1 3 334.375 4.071 20 0 EIADHM C[C@@H](c1ccc(Cl)c(Cl)c1)N(C)C(=O)c1ccc(O)cc1[O-] ZINC000436945143 1041568676 /nfs/dbraw/zinc/56/86/76/1041568676.db2.gz SBXVZLURYFJXRS-VIFPVBQESA-N -1 3 340.206 4.238 20 0 EIADHM COc1cccc(-c2nc(-c3ccccc3C(F)(F)F)no2)c1[O-] ZINC000436997029 1041586093 /nfs/dbraw/zinc/58/60/93/1041586093.db2.gz FEJCAHNEKMSZSK-UHFFFAOYSA-N -1 3 336.269 4.137 20 0 EIADHM CCOc1cccc2cc([C@@H](C)NC(=O)c3ccccc3[O-])oc21 ZINC000436998764 1041594814 /nfs/dbraw/zinc/59/48/14/1041594814.db2.gz YZAXRGATUIWQMD-GFCCVEGCSA-N -1 3 325.364 4.028 20 0 EIADHM CC(C)c1nnc([N-]C(=O)c2ncsc2-c2ccccc2)s1 ZINC000438050840 1042031004 /nfs/dbraw/zinc/03/10/04/1042031004.db2.gz FKPLMVZIMWXMAZ-UHFFFAOYSA-N -1 3 330.438 4.037 20 0 EIADHM O=C(COc1cccc(C(F)(F)F)c1)Nc1cc(Cl)ccc1[O-] ZINC000302002238 1042050075 /nfs/dbraw/zinc/05/00/75/1042050075.db2.gz UAAJPNVIUQDKCW-UHFFFAOYSA-N -1 3 345.704 4.082 20 0 EIADHM CC1=C(c2ccco2)CN(C(=O)CCCc2ccc([O-])c(F)c2)CC1 ZINC000517967437 1042298633 /nfs/dbraw/zinc/29/86/33/1042298633.db2.gz OABCCXZNOSDITC-UHFFFAOYSA-N -1 3 343.398 4.153 20 0 EIADHM Cc1cc([C@@H](NC(=O)c2cc([O-])ccc2Cl)C2CC2)ccc1F ZINC000491420550 1042448207 /nfs/dbraw/zinc/44/82/07/1042448207.db2.gz CZZJOLBTDSCDHW-KRWDZBQOSA-N -1 3 333.790 4.374 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])[C@@H]1C[C@@]12CCCc1ccccc12 ZINC000439093543 1042496514 /nfs/dbraw/zinc/49/65/14/1042496514.db2.gz HNIBXRLQRXYHFE-HNAYVOBHSA-N -1 3 327.811 4.278 20 0 EIADHM Cc1cccc(C(=O)Nc2ccc(COC3CCCC3)cc2)c1[O-] ZINC000303824498 1042515917 /nfs/dbraw/zinc/51/59/17/1042515917.db2.gz PWBZFEMOZKNADP-UHFFFAOYSA-N -1 3 325.408 4.412 20 0 EIADHM CC[C@@](C)(OC)c1noc(-c2cc(Cc3ccccc3)ccc2[O-])n1 ZINC000518625831 1042596893 /nfs/dbraw/zinc/59/68/93/1042596893.db2.gz RZPQPELASXRTKY-HXUWFJFHSA-N -1 3 338.407 4.305 20 0 EIADHM C[C@@H](C(=O)[O-])[C@H](NCc1cnc(C2CCCC2)s1)c1ccccc1 ZINC000417559455 1042877641 /nfs/dbraw/zinc/87/76/41/1042877641.db2.gz IGPLPTYFSWTWBF-DYVFJYSZSA-N -1 3 344.480 4.352 20 0 EIADHM O=C([N-]c1ncn(C2CCCCC2)n1)c1cc2cc(Cl)ccc2o1 ZINC000182712020 1042898195 /nfs/dbraw/zinc/89/81/95/1042898195.db2.gz ZPFGAHRGYMIPJN-UHFFFAOYSA-N -1 3 344.802 4.435 20 0 EIADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)C=CC3CCCC3)c2)n1 ZINC000493703117 1042950860 /nfs/dbraw/zinc/95/08/60/1042950860.db2.gz DLLFMYVZXUSEEL-ZHACJKMWSA-N -1 3 337.423 4.097 20 0 EIADHM O=C([N-]c1ncc(C(F)(F)F)s1)c1cc(-c2ccccc2)no1 ZINC000355935332 1043121775 /nfs/dbraw/zinc/12/17/75/1043121775.db2.gz UUTDRNZWPDYVNR-UHFFFAOYSA-N -1 3 339.298 4.069 20 0 EIADHM CN(c1ccccc1)C1CCN(Cc2cccc([O-])c2Cl)CC1 ZINC000507866300 1043151856 /nfs/dbraw/zinc/15/18/56/1043151856.db2.gz XHQMEVBVRJTPBE-UHFFFAOYSA-N -1 3 330.859 4.146 20 0 EIADHM O=C([O-])C[C@@H]1CCCN(CCSc2cc(Cl)ccc2Cl)C1 ZINC000054298523 1043154654 /nfs/dbraw/zinc/15/46/54/1043154654.db2.gz AEBQJJAGORFSNO-NSHDSACASA-N -1 3 348.295 4.272 20 0 EIADHM [O-]c1cccc(CN2CCC(Oc3ccc(F)cc3)CC2)c1Cl ZINC000507890885 1043176586 /nfs/dbraw/zinc/17/65/86/1043176586.db2.gz RYSSWMVBQRHKSO-UHFFFAOYSA-N -1 3 335.806 4.228 20 0 EIADHM COc1cc(CN(C)Cc2c(F)ccc([O-])c2F)ccc1SC ZINC000507919806 1043189179 /nfs/dbraw/zinc/18/91/79/1043189179.db2.gz SSVNRJLEERKKEU-UHFFFAOYSA-N -1 3 339.407 4.033 20 0 EIADHM Cc1cccc([C@@H]2CCN(C(=O)c3cc([O-])c4ccccc4c3)C2)c1 ZINC000525931391 1043236839 /nfs/dbraw/zinc/23/68/39/1043236839.db2.gz GWYAUMLTDQJKGI-GOSISDBHSA-N -1 3 331.415 4.484 20 0 EIADHM O=C(NCc1ncc(-c2ccccc2)o1)c1cc([O-])c2ccccc2c1 ZINC000526864912 1043243769 /nfs/dbraw/zinc/24/37/69/1043243769.db2.gz ZSEKYKNVJDXFEB-UHFFFAOYSA-N -1 3 344.370 4.130 20 0 EIADHM CC1(C)[C@@H](C(F)(F)F)CCN1C(=O)c1cc([O-])c2ccccc2c1 ZINC000526929763 1043246210 /nfs/dbraw/zinc/24/62/10/1043246210.db2.gz OJSXVQNACOSFBD-HNNXBMFYSA-N -1 3 337.341 4.348 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N1CCS[C@@H]2CCCC[C@H]21 ZINC000527467577 1043262322 /nfs/dbraw/zinc/26/23/22/1043262322.db2.gz YWLSBPPGZHPUSQ-SJLPKXTDSA-N -1 3 327.449 4.046 20 0 EIADHM Cc1nc(C)c([C@@H](C)N(C)C(=O)c2cc([O-])c3ccccc3c2)s1 ZINC000280988340 1043262728 /nfs/dbraw/zinc/26/27/28/1043262728.db2.gz STALFCKEIDZVPP-GFCCVEGCSA-N -1 3 340.448 4.452 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N1CCS[C@@H]2CCCC[C@@H]21 ZINC000527467576 1043262985 /nfs/dbraw/zinc/26/29/85/1043262985.db2.gz YWLSBPPGZHPUSQ-FUHWJXTLSA-N -1 3 327.449 4.046 20 0 EIADHM Cc1cccc2nc(-c3ccc(F)c(Br)c3)[n-]c(=O)c12 ZINC000534880907 1043300581 /nfs/dbraw/zinc/30/05/81/1043300581.db2.gz CTRNIBGKIFNFNN-UHFFFAOYSA-N -1 3 333.160 4.212 20 0 EIADHM Cc1cc(Nc2cc(F)cc(F)c2[O-])n(Cc2cccc(F)c2)n1 ZINC001212484235 1043483688 /nfs/dbraw/zinc/48/36/88/1043483688.db2.gz RVMUUVFHZJUAQD-UHFFFAOYSA-N -1 3 333.313 4.106 20 0 EIADHM O=C(CCc1nc2cc(Cl)ccc2s1)[N-]OCc1ccccc1 ZINC000730519714 1043550218 /nfs/dbraw/zinc/55/02/18/1043550218.db2.gz VSCRRNZKUJXXBE-UHFFFAOYSA-N -1 3 346.839 4.130 20 0 EIADHM CCOC(=O)Nc1ccc(OC(=O)c2cc3ccsc3[n-]2)cc1 ZINC000730784684 1043622926 /nfs/dbraw/zinc/62/29/26/1043622926.db2.gz MLXDHHZIGOMADW-UHFFFAOYSA-N -1 3 330.365 4.017 20 0 EIADHM COc1cc(NCc2c(F)ccc([O-])c2F)ccc1Br ZINC000509224236 1043657725 /nfs/dbraw/zinc/65/77/25/1043657725.db2.gz KJQSDYHVBFQOGA-UHFFFAOYSA-N -1 3 344.155 4.054 20 0 EIADHM CS[C@@H]1CCCCN([C@H](C(=O)[O-])c2ccc(Cl)c(Cl)c2)C1 ZINC000521257584 1043671532 /nfs/dbraw/zinc/67/15/32/1043671532.db2.gz MORSJIKHDANULL-RISCZKNCSA-N -1 3 348.295 4.337 20 0 EIADHM CCc1ncc(C(=O)[N-]c2nnc(-c3cc(C)cc(C)c3)s2)s1 ZINC000115149948 1043855751 /nfs/dbraw/zinc/85/57/51/1043855751.db2.gz UMKPXPDFDBQVKA-UHFFFAOYSA-N -1 3 344.465 4.093 20 0 EIADHM O=C(Nc1cccc(-c2cccs2)c1)c1nnc2ccccc2c1[O-] ZINC000732282531 1043895255 /nfs/dbraw/zinc/89/52/55/1043895255.db2.gz PIHQIXWRGRPGGK-UHFFFAOYSA-N -1 3 347.399 4.316 20 0 EIADHM O=C(c1cc([O-])ccc1Cl)N1CCc2c1cccc2C(F)(F)F ZINC000499669740 1044002453 /nfs/dbraw/zinc/00/24/53/1044002453.db2.gz ICHHSYYLJNMJAG-UHFFFAOYSA-N -1 3 341.716 4.267 20 0 EIADHM Cc1cc(-c2nc3ccc(Br)cc3c(=O)[n-]2)cc(C)c1F ZINC000675222119 1044086253 /nfs/dbraw/zinc/08/62/53/1044086253.db2.gz FMJJYIRINKHELF-UHFFFAOYSA-N -1 3 347.187 4.109 20 0 EIADHM C[C@H]1CCCCCN1Cc1csc(-c2cccc(C(=O)[O-])c2)n1 ZINC000522008805 1044151994 /nfs/dbraw/zinc/15/19/94/1044151994.db2.gz WFZWAJRTANUFQO-ZDUSSCGKSA-N -1 3 330.453 4.273 20 0 EIADHM CCOc1c(F)cccc1Nc1cccc([O-])c1Br ZINC001212537949 1044204156 /nfs/dbraw/zinc/20/41/56/1044204156.db2.gz SJFJLVHANBMOAP-UHFFFAOYSA-N -1 3 326.165 4.436 20 0 EIADHM CCc1ccc([O-])c(C(=O)N2CC=C(c3ccc(F)cc3)CC2)c1 ZINC000522151324 1044282986 /nfs/dbraw/zinc/28/29/86/1044282986.db2.gz WANNXUORBATOLP-UHFFFAOYSA-N -1 3 325.383 4.023 20 0 EIADHM O=C(NCCc1cccc(Cl)c1Cl)c1cc([O-])ccc1Cl ZINC000518842769 1044327423 /nfs/dbraw/zinc/32/74/23/1044327423.db2.gz FCMKUFNLZMDWLY-UHFFFAOYSA-N -1 3 344.625 4.325 20 0 EIADHM O=C([O-])CCC1CCN(Cc2ccc(Oc3ccccc3)o2)CC1 ZINC000665343357 1044394702 /nfs/dbraw/zinc/39/47/02/1044394702.db2.gz FZRKWGPUAIGDPJ-UHFFFAOYSA-N -1 3 329.396 4.149 20 0 EIADHM O=C([N-]c1nnc(C(F)F)s1)c1ccc(-c2ccco2)s1 ZINC000675753281 1044467290 /nfs/dbraw/zinc/46/72/90/1044467290.db2.gz QCBRVVKNSMUXPF-UHFFFAOYSA-N -1 3 327.337 4.050 20 0 EIADHM Cc1cc(F)ccc1-c1ccc(/C=C2\C(=O)[N-]C(=O)c3ccccc32)o1 ZINC000734307149 1044530666 /nfs/dbraw/zinc/53/06/66/1044530666.db2.gz VVTWZBBTHFPDAS-WQRHYEAKSA-N -1 3 347.345 4.205 20 0 EIADHM Cc1ccc(-c2nc([N-]C(=O)c3occc3-c3ccccc3)n[nH]2)cc1 ZINC000070724901 1044708367 /nfs/dbraw/zinc/70/83/67/1044708367.db2.gz RFAZGRHJDALYGC-UHFFFAOYSA-N -1 3 344.374 4.292 20 0 EIADHM Cc1cc(=O)[n-]c(CSc2nc(-c3ccc(F)cc3)cs2)n1 ZINC000761852598 1044799392 /nfs/dbraw/zinc/79/93/92/1044799392.db2.gz SQAZOUVYUYBXMQ-UHFFFAOYSA-N -1 3 333.413 4.046 20 0 EIADHM O=C([O-])C[C@H](NCc1ccc(C(F)(F)F)cc1)c1cccs1 ZINC000315393895 1044877449 /nfs/dbraw/zinc/87/74/49/1044877449.db2.gz FTAOKIYKQAVMJM-LBPRGKRZSA-N -1 3 329.343 4.073 20 0 EIADHM Cc1ccc(-c2csc3[n-]c(-c4ccccn4)nc(=O)c23)c(C)c1 ZINC000020369484 1044930637 /nfs/dbraw/zinc/93/06/37/1044930637.db2.gz VBLSCCIRGYVTDK-UHFFFAOYSA-N -1 3 333.416 4.330 20 0 EIADHM [O-]c1cc(F)cc(CNc2cccc(Cl)c2OCC(F)F)c1 ZINC000673619577 1044999738 /nfs/dbraw/zinc/99/97/38/1044999738.db2.gz ZCTOGWCLEBVYPY-UHFFFAOYSA-N -1 3 331.721 4.441 20 0 EIADHM N#CC(=C([O-])C1=CCCCCC1)c1nc2ccccc2n1C(F)F ZINC000187143900 1045066680 /nfs/dbraw/zinc/06/66/80/1045066680.db2.gz PTTYAZXFHWCPCF-CYBMUJFWSA-N -1 3 329.350 4.498 20 0 EIADHM CC(C)Sc1ccc(Cl)cc1[N-]C(=O)c1cn(C2CC2)nn1 ZINC000625274305 1045206151 /nfs/dbraw/zinc/20/61/51/1045206151.db2.gz IEFVFWMSSARNHC-UHFFFAOYSA-N -1 3 336.848 4.019 20 0 EIADHM O=C(NOCc1ccccc1)c1cc(Oc2ccccc2)ccc1[O-] ZINC000740749629 1045211903 /nfs/dbraw/zinc/21/19/03/1045211903.db2.gz IAAHBOYPJRESNQ-UHFFFAOYSA-N -1 3 335.359 4.046 20 0 EIADHM Cc1ccc(/C=C\S(=O)(=O)[N-]c2ccccc2OCC2CC2)cc1 ZINC000740813110 1045228401 /nfs/dbraw/zinc/22/84/01/1045228401.db2.gz SQOGVWGVDLMVLO-SEYXRHQNSA-N -1 3 343.448 4.196 20 0 EIADHM Cc1cccc(C(=O)Nc2ccc(OCC(F)(F)F)c(F)c2)c1[O-] ZINC001626019745 1045284426 /nfs/dbraw/zinc/28/44/26/1045284426.db2.gz JVKDUJLUTCQMHZ-UHFFFAOYSA-N -1 3 343.276 4.033 20 0 EIADHM C[C@@H]1CN(Cc2c(C(=O)[O-])sc3cccc(F)c32)C[C@H](C)S1 ZINC000387078562 1045415887 /nfs/dbraw/zinc/41/58/87/1045415887.db2.gz OXCQBCRBXQMIMB-AOOOYVTPSA-N -1 3 339.457 4.064 20 0 EIADHM C[C@H](Oc1ccc(Cl)cc1)C(=O)Nc1cc(Cl)ccc1[O-] ZINC000069693081 1045518028 /nfs/dbraw/zinc/51/80/28/1045518028.db2.gz NOILNZJNUVTNNR-VIFPVBQESA-N -1 3 326.179 4.105 20 0 EIADHM Cc1cnc(Cl)nc1/C=C\c1ccc([O-])c(Br)c1 ZINC000791434816 1045740002 /nfs/dbraw/zinc/74/00/02/1045740002.db2.gz MXTMTDKTRPRAFR-RQOWECAXSA-N -1 3 325.593 4.077 20 0 EIADHM O=C(Nc1ccc(-c2ncc[nH]2)cc1)c1cc2sccc2c([O-])c1 ZINC000791342854 1045724875 /nfs/dbraw/zinc/72/48/75/1045724875.db2.gz BBBNNNNDXVRERV-UHFFFAOYSA-N -1 3 335.388 4.249 20 0 EIADHM O=C(NCc1ccc([O-])c(Br)c1)C1CCCCCCC1 ZINC000768292043 1045781090 /nfs/dbraw/zinc/78/10/90/1045781090.db2.gz JOPPBCXWZUNBNI-UHFFFAOYSA-N -1 3 340.261 4.131 20 0 EIADHM [O-]c1ccc(Nc2cc(F)c(F)cc2Br)c(F)c1F ZINC001212007496 1045827432 /nfs/dbraw/zinc/82/74/32/1045827432.db2.gz JBJZCLUAZDRKMI-UHFFFAOYSA-N -1 3 336.082 4.455 20 0 EIADHM CC[C@H](NC(=O)c1cc([O-])c2ccccc2c1)c1ccccc1OC ZINC000792056471 1045853345 /nfs/dbraw/zinc/85/33/45/1045853345.db2.gz FCXXUMHYYDNMFV-SFHVURJKSA-N -1 3 335.403 4.435 20 0 EIADHM O=S(=O)(/C=C/c1cccc(Cl)c1)[N-]c1cc(F)cc(F)c1 ZINC000768861097 1045857018 /nfs/dbraw/zinc/85/70/18/1045857018.db2.gz IAEDTZILVJIGMB-SNAWJCMRSA-N -1 3 329.755 4.031 20 0 EIADHM O=C(Nc1ccnn1C1CCCCC1)c1cc([O-])c2ccccc2c1 ZINC000792130449 1045864777 /nfs/dbraw/zinc/86/47/77/1045864777.db2.gz VPRCZSNDABKIPK-UHFFFAOYSA-N -1 3 335.407 4.499 20 0 EIADHM CC(C)[C@@H](NC(=O)c1cc([O-])c2ccccc2c1)[C@H](O)c1ccccc1 ZINC000792492628 1045899146 /nfs/dbraw/zinc/89/91/46/1045899146.db2.gz ZRRSTHVIQFLYQM-NHCUHLMSSA-N -1 3 349.430 4.033 20 0 EIADHM CCCOc1ccc([N-]S(=O)(=O)c2ccc(Cl)cc2)c(C)c1 ZINC000614885314 1045922026 /nfs/dbraw/zinc/92/20/26/1045922026.db2.gz UFJRZXKYSIRLLU-UHFFFAOYSA-N -1 3 339.844 4.238 20 0 EIADHM Cc1cc(=O)[n-]c(CN2CCC(c3ccc(C(C)(C)C)cc3)CC2)n1 ZINC001170444292 1046389164 /nfs/dbraw/zinc/38/91/64/1046389164.db2.gz WCHDQYNDMXIPRP-UHFFFAOYSA-N -1 3 339.483 4.168 20 0 EIADHM CC(=O)c1ccc(C(=O)[N-]c2ccccc2SC(F)(F)F)o1 ZINC000772153811 1046581229 /nfs/dbraw/zinc/58/12/29/1046581229.db2.gz HDGNFPXYQUWFPP-UHFFFAOYSA-N -1 3 329.299 4.346 20 0 EIADHM [O-]c1cccc(CNC2(c3ccc(F)cc3)CC2)c1Br ZINC000459425498 1046657002 /nfs/dbraw/zinc/65/70/02/1046657002.db2.gz KRUBCXXGPJTQRB-UHFFFAOYSA-N -1 3 336.204 4.073 20 0 EIADHM C[C@H]1C[C@@H](c2cccnc2)N(Cc2cccc([O-])c2Br)C1 ZINC000459489724 1046714915 /nfs/dbraw/zinc/71/49/15/1046714915.db2.gz UOTYIDNZCYHQPZ-WFASDCNBSA-N -1 3 347.256 4.133 20 0 EIADHM CC[C@@H](C)c1ccc(NC(=O)COC(=O)c2cc3occc3[n-]2)cc1 ZINC000786030894 1046804321 /nfs/dbraw/zinc/80/43/21/1046804321.db2.gz HVLSFGDPIHSWQI-GFCCVEGCSA-N -1 3 340.379 4.070 20 0 EIADHM O=C(OCc1nc2ccccc2o1)c1cc2sccc2c([O-])c1 ZINC000786131792 1046814196 /nfs/dbraw/zinc/81/41/96/1046814196.db2.gz QQOLMHVARARREA-UHFFFAOYSA-N -1 3 325.345 4.105 20 0 EIADHM O=C(CSc1cccc(C(F)(F)F)c1)Nc1cccc([O-])c1F ZINC000128309769 1046814838 /nfs/dbraw/zinc/81/48/38/1046814838.db2.gz WLFAHQBPZYUOOW-UHFFFAOYSA-N -1 3 345.317 4.281 20 0 EIADHM O=C(Nc1ccc(F)cc1OCC(F)F)c1cc([O-])ccc1Cl ZINC000497664345 1046940101 /nfs/dbraw/zinc/94/01/01/1046940101.db2.gz XKNITPNAEYHBQZ-UHFFFAOYSA-N -1 3 345.704 4.081 20 0 EIADHM O=C(Nc1cccc([O-])c1F)c1ccc(Br)cc1Cl ZINC000128801155 1047081776 /nfs/dbraw/zinc/08/17/76/1047081776.db2.gz PQEPQLCMUJNJNY-UHFFFAOYSA-N -1 3 344.567 4.200 20 0 EIADHM C[C@H](Oc1cc(Cl)cc(Cl)c1)C(=O)Nc1cccc([O-])c1F ZINC000128831192 1047100880 /nfs/dbraw/zinc/10/08/80/1047100880.db2.gz OSAWXXBRZPZSFS-QMMMGPOBSA-N -1 3 344.169 4.244 20 0 EIADHM Cn1ccnc1-c1cccc(NC(=O)c2cc3sccc3c([O-])c2)c1 ZINC000788288301 1047158603 /nfs/dbraw/zinc/15/86/03/1047158603.db2.gz NYSPEHKKLZCBJB-UHFFFAOYSA-N -1 3 349.415 4.260 20 0 EIADHM Cc1nocc1[N-]C(=O)c1sc(-c2ccc(F)c(C)c2)nc1C ZINC001130577201 1047222088 /nfs/dbraw/zinc/22/20/88/1047222088.db2.gz IDVHENNMSSYHAX-UHFFFAOYSA-N -1 3 331.372 4.115 20 0 EIADHM Cc1ccc(-c2nc(C(=O)Nc3cccc([O-])c3F)cs2)cc1 ZINC000129037068 1047250138 /nfs/dbraw/zinc/25/01/38/1047250138.db2.gz IOHSBJVLEQQQFI-UHFFFAOYSA-N -1 3 328.368 4.216 20 0 EIADHM CC[C@@H](Oc1ccccc1C(C)C)C(=O)Nc1cccc([O-])c1F ZINC000129135734 1047312280 /nfs/dbraw/zinc/31/22/80/1047312280.db2.gz XLPHMEUWHALDFU-MRXNPFEDSA-N -1 3 331.387 4.451 20 0 EIADHM Cc1nc(CCC(=O)Nc2cccc([O-])c2F)oc1-c1ccccc1 ZINC000129135980 1047312682 /nfs/dbraw/zinc/31/26/82/1047312682.db2.gz SYMLALKPDQDJIG-UHFFFAOYSA-N -1 3 340.354 4.066 20 0 EIADHM O=C(Nc1cccc([O-])c1F)c1ccc(COc2ccccc2)cc1 ZINC000129432736 1047388886 /nfs/dbraw/zinc/38/88/86/1047388886.db2.gz TZEPTNRBNUETQJ-UHFFFAOYSA-N -1 3 337.350 4.363 20 0 EIADHM O=C(CCCc1c[nH]c2ccccc12)Nc1cc(Cl)ccc1[O-] ZINC000069692931 1047450059 /nfs/dbraw/zinc/45/00/59/1047450059.db2.gz IIOZZTPSFHKYOD-UHFFFAOYSA-N -1 3 328.799 4.488 20 0 EIADHM O=C(OCc1ccc(OC(F)F)cc1)c1cc(Cl)c(Cl)[n-]1 ZINC000918504734 1047465550 /nfs/dbraw/zinc/46/55/50/1047465550.db2.gz BXFMQTNFXVUZNT-UHFFFAOYSA-N -1 3 336.121 4.280 20 0 EIADHM O=C(Nc1cccc([O-])c1F)c1ccccc1OC1CCCCC1 ZINC000129754342 1047502265 /nfs/dbraw/zinc/50/22/65/1047502265.db2.gz MNTNWYRESDDXNY-UHFFFAOYSA-N -1 3 329.371 4.495 20 0 EIADHM CSc1c(F)cccc1[N-]C(=O)c1coc(Br)c1 ZINC001131059138 1047504089 /nfs/dbraw/zinc/50/40/89/1047504089.db2.gz LLIWAXPPCUCTGV-UHFFFAOYSA-N -1 3 330.178 4.155 20 0 EIADHM Cc1ccccc1C[C@H]1CCCN1C(=O)c1cc([O-])ccc1Cl ZINC000556183653 1047541468 /nfs/dbraw/zinc/54/14/68/1047541468.db2.gz BZCKOAFUVNOBCC-OAHLLOKOSA-N -1 3 329.827 4.201 20 0 EIADHM CC(C)(C(=O)Nc1ccc([O-])c(C(F)(F)F)c1)c1cccs1 ZINC000129990068 1047544718 /nfs/dbraw/zinc/54/47/18/1047544718.db2.gz TXQHRRSRWFAASB-UHFFFAOYSA-N -1 3 329.343 4.389 20 0 EIADHM COc1ccc(-c2nsc([N-]C(=O)c3occc3C(C)C)n2)cc1 ZINC000556357706 1047696824 /nfs/dbraw/zinc/69/68/24/1047696824.db2.gz ATRUMMFMGVHHFF-UHFFFAOYSA-N -1 3 343.408 4.182 20 0 EIADHM COc1ccc(Cl)cc1CN(C)C(=O)c1ccc(C(C)C)cc1[O-] ZINC000108059793 1047777186 /nfs/dbraw/zinc/77/71/86/1047777186.db2.gz PUCWEKGRUWSUDU-UHFFFAOYSA-N -1 3 347.842 4.450 20 0 EIADHM Cc1sc2[n-]c([C@@H](C)OC(=O)C=C3CCCC3)nc(=O)c2c1C ZINC000919595974 1047889122 /nfs/dbraw/zinc/88/91/22/1047889122.db2.gz NUWNHEFKUHNKBQ-SNVBAGLBSA-N -1 3 332.425 4.118 20 0 EIADHM CCCc1nc(C)c(C(=O)[N-]c2nnc(C3CCCCC3)s2)o1 ZINC000814347394 1047995759 /nfs/dbraw/zinc/99/57/59/1047995759.db2.gz NIXBAOBGRZAZPS-UHFFFAOYSA-N -1 3 334.445 4.087 20 0 EIADHM Cc1sc2[n-]c([C@H](C)OC(=O)CC(C)(C)C3CC3)nc(=O)c2c1C ZINC000815470854 1048479755 /nfs/dbraw/zinc/47/97/55/1048479755.db2.gz MAFQEMDBUJZADV-JTQLQIEISA-N -1 3 348.468 4.444 20 0 EIADHM CSc1nc2ccc(NC(=O)c3ccc(C)cc3[O-])cc2s1 ZINC001135341605 1048671556 /nfs/dbraw/zinc/67/15/56/1048671556.db2.gz DCOCFWZGTWVIIF-UHFFFAOYSA-N -1 3 330.434 4.285 20 0 EIADHM CSc1ccc(Cl)cc1[N-]S(=O)(=O)/C=C\c1ccccc1 ZINC000920757105 1048772338 /nfs/dbraw/zinc/77/23/38/1048772338.db2.gz VVOVHMGVKHDWEF-KTKRTIGZSA-N -1 3 339.869 4.475 20 0 EIADHM COc1cccc(CC2CCN(Cc3cc(F)c([O-])cc3F)CC2)c1 ZINC001144660276 1048795438 /nfs/dbraw/zinc/79/54/38/1048795438.db2.gz YXAUFFHOIJPPAG-UHFFFAOYSA-N -1 3 347.405 4.134 20 0 EIADHM O=C(OCc1ccnc(Cl)c1)c1cc2cc(Cl)sc2[n-]1 ZINC000810562055 1048812803 /nfs/dbraw/zinc/81/28/03/1048812803.db2.gz TWVVDLQIRNCEAL-UHFFFAOYSA-N -1 3 327.192 4.288 20 0 EIADHM O=C([N-][C@H]1CCc2c1cccc2F)C(F)(F)c1cccc(Cl)c1 ZINC000921006697 1048837819 /nfs/dbraw/zinc/83/78/19/1048837819.db2.gz FGZJBCHDEIMOLV-HNNXBMFYSA-N -1 3 339.744 4.375 20 0 EIADHM CC[C@@H](C)[C@H](C)N(C(=O)c1cc([O-])cc(Br)c1)C1CC1 ZINC001144848415 1048868398 /nfs/dbraw/zinc/86/83/98/1048868398.db2.gz AJNJDORXZXPXGE-MNOVXSKESA-N -1 3 340.261 4.194 20 0 EIADHM CCc1ccc([C@H]2CCCCCN2C(=O)c2ccc(OC)cc2[O-])o1 ZINC001147299136 1049119533 /nfs/dbraw/zinc/11/95/33/1049119533.db2.gz VOZWYZZJHXKFGM-QGZVFWFLSA-N -1 3 343.423 4.314 20 0 EIADHM CC(C)c1cc(C(=O)[N-]c2cc(-c3ccc(Cl)s3)on2)no1 ZINC001147476332 1049155545 /nfs/dbraw/zinc/15/55/45/1049155545.db2.gz VSBJAFBMCYDSLU-UHFFFAOYSA-N -1 3 337.788 4.420 20 0 EIADHM O=C([N-]c1cc(F)c(F)cc1F)c1cc(-c2ccc(F)cc2)on1 ZINC000135467238 1049185033 /nfs/dbraw/zinc/18/50/33/1049185033.db2.gz IHIWQAAEHSHLPK-UHFFFAOYSA-N -1 3 336.244 4.150 20 0 EIADHM CSc1nsc([N-]C(=O)c2oc3ccc(Cl)cc3c2C)n1 ZINC000078387286 1049203209 /nfs/dbraw/zinc/20/32/09/1049203209.db2.gz LRYWVQDJNGBMNV-UHFFFAOYSA-N -1 3 339.829 4.220 20 0 EIADHM COCc1ccc(C(=O)[N-]c2c(SC)cc(C)nc2SC)cc1 ZINC001148432299 1049309589 /nfs/dbraw/zinc/30/95/89/1049309589.db2.gz IRAGTCLMKOSPQS-UHFFFAOYSA-N -1 3 348.493 4.233 20 0 EIADHM CCc1ccc(C(=O)Nc2cccc(-n3nc(C)cc3C)c2)c([O-])c1 ZINC001136214554 1049309789 /nfs/dbraw/zinc/30/97/89/1049309789.db2.gz FQZCWMCNRQBGMI-UHFFFAOYSA-N -1 3 335.407 4.009 20 0 EIADHM Cc1ccc(C(=O)Nc2ccc3c(c2)Cc2cc(N)ccc2-3)c([O-])c1 ZINC001148500517 1049328450 /nfs/dbraw/zinc/32/84/50/1049328450.db2.gz ONBWPQANTHYCRA-UHFFFAOYSA-N -1 3 330.387 4.106 20 0 EIADHM Cc1ccc(C(=O)Nc2ccc(N3CCC(F)(F)CC3)cc2)c([O-])c1 ZINC001148500034 1049328639 /nfs/dbraw/zinc/32/86/39/1049328639.db2.gz HWQCCLJBDOBBSF-UHFFFAOYSA-N -1 3 346.377 4.188 20 0 EIADHM CC(=O)c1cc(C(=O)Nc2ccccc2Cc2ccccc2)ccc1[O-] ZINC001148664034 1049355916 /nfs/dbraw/zinc/35/59/16/1049355916.db2.gz HDSRZGQEANXJHP-UHFFFAOYSA-N -1 3 345.398 4.438 20 0 EIADHM O=C(Nc1ccc(F)c([O-])c1)c1ccc(OC(F)(F)F)c(Cl)c1 ZINC001149034896 1049414408 /nfs/dbraw/zinc/41/44/08/1049414408.db2.gz RJSDQHADMVDSAA-UHFFFAOYSA-N -1 3 349.667 4.336 20 0 EIADHM O=C(C[C@H](Cc1ccccc1)c1ccccc1)[N-]OC/C=C/Cl ZINC000812403918 1049450893 /nfs/dbraw/zinc/45/08/93/1049450893.db2.gz UEVLTMNSTFGJAW-NUCSPZLJSA-N -1 3 329.827 4.203 20 0 EIADHM Cc1sc2[n-]c([C@H](C)OC(=O)[C@H]3CCCC[C@H]3C)nc(=O)c2c1C ZINC000820938429 1049577424 /nfs/dbraw/zinc/57/74/24/1049577424.db2.gz CJGRQVYQXDSZBZ-CDMKHQONSA-N -1 3 348.468 4.444 20 0 EIADHM CC(C)Oc1ccc(NC(=O)c2[n-]cnc2C(F)(F)F)cc1Cl ZINC000821455754 1049641751 /nfs/dbraw/zinc/64/17/51/1049641751.db2.gz WPYBNIMOMXSSHF-UHFFFAOYSA-N -1 3 347.724 4.121 20 0 EIADHM CC(C)Oc1ccc(NC(=O)c2nc[n-]c2C(F)(F)F)cc1Cl ZINC000821455754 1049641758 /nfs/dbraw/zinc/64/17/58/1049641758.db2.gz WPYBNIMOMXSSHF-UHFFFAOYSA-N -1 3 347.724 4.121 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]C(C)(C)c2ccc(Cl)c(Cl)c2)o1 ZINC000773293260 1049696666 /nfs/dbraw/zinc/69/66/66/1049696666.db2.gz VWBQWFGGNUPXLU-UHFFFAOYSA-N -1 3 348.251 4.108 20 0 EIADHM O=C([N-]c1c(F)cc(Cl)cc1F)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000180358616 1049887255 /nfs/dbraw/zinc/88/72/55/1049887255.db2.gz LGPXQLZNMDOXKL-UHFFFAOYSA-N -1 3 347.104 4.432 20 0 EIADHM Cc1ccccc1C(F)(F)C(=O)[N-][C@@H](C)c1ccc(F)c(F)c1 ZINC001136834767 1049902483 /nfs/dbraw/zinc/90/24/83/1049902483.db2.gz BVFZHQDAVORAOG-NSHDSACASA-N -1 3 325.305 4.242 20 0 EIADHM CC[C@H](NCc1ccc(C(=O)[O-])cc1)c1ccccc1OC(F)F ZINC000263561742 1049977203 /nfs/dbraw/zinc/97/72/03/1049977203.db2.gz CIRHLADZXXJUFE-HNNXBMFYSA-N -1 3 335.350 4.227 20 0 EIADHM CCc1onc(C)c1[N-]C(=O)c1csc(-c2ccc(F)cc2)n1 ZINC000089397943 1050117205 /nfs/dbraw/zinc/11/72/05/1050117205.db2.gz OUYQUQBIFBESEE-UHFFFAOYSA-N -1 3 331.372 4.060 20 0 EIADHM CSc1ccc([O-])c(C(=O)N2CC3(CCCC3)[C@H]2c2ccco2)c1 ZINC000617920910 1050129289 /nfs/dbraw/zinc/12/92/89/1050129289.db2.gz KSXGBWWTBPHUDM-QGZVFWFLSA-N -1 3 343.448 4.465 20 0 EIADHM CC(=O)Nc1ccc([O-])c(C(=O)N(C)C2CC(C)(C)CC(C)(C)C2)c1 ZINC000618071417 1050231713 /nfs/dbraw/zinc/23/17/13/1050231713.db2.gz XZHCQLPTMFZKRW-UHFFFAOYSA-N -1 3 346.471 4.028 20 0 EIADHM C[C@@H](NC(=O)Nc1ccc(Br)cc1[O-])C1CCCCC1 ZINC001186338810 1050302781 /nfs/dbraw/zinc/30/27/81/1050302781.db2.gz SKRGVEXMCURSOL-SNVBAGLBSA-N -1 3 341.249 4.245 20 0 EIADHM C[C@@H](NC(=O)Nc1ccc([O-])c(Br)c1)C1CCCCC1 ZINC001186343209 1050303439 /nfs/dbraw/zinc/30/34/39/1050303439.db2.gz RYHHWLHCLCGUBR-SNVBAGLBSA-N -1 3 341.249 4.245 20 0 EIADHM O=C(Nc1nc2c(cccc2[O-])s1)N[C@H]1CCCc2ccccc21 ZINC001186415393 1050321914 /nfs/dbraw/zinc/32/19/14/1050321914.db2.gz AUYASUJNRYAXKQ-ZDUSSCGKSA-N -1 3 339.420 4.201 20 0 EIADHM [O-]c1cncc(-c2nc(-c3ccc(Cl)c(C(F)(F)F)c3)no2)c1 ZINC001212708894 1050330070 /nfs/dbraw/zinc/33/00/70/1050330070.db2.gz WBYJTDLSZJCMBS-UHFFFAOYSA-N -1 3 341.676 4.176 20 0 EIADHM Cc1cc(=O)[n-]c(-c2ccc(NC(=O)[C@H]3C[C@H](C)C[C@H](C)C3)cc2)n1 ZINC000253558633 1050491333 /nfs/dbraw/zinc/49/13/33/1050491333.db2.gz HDVCQHHKFDSJNJ-VIKVFOODSA-N -1 3 339.439 4.168 20 0 EIADHM CC1(C)CO[C@H](c2cccc(Cl)c2)CN1C(=O)c1ccccc1[O-] ZINC000618784146 1050522078 /nfs/dbraw/zinc/52/20/78/1050522078.db2.gz OHWMSDCVWBAMTI-KRWDZBQOSA-N -1 3 345.826 4.038 20 0 EIADHM Cc1cc(C)c([N-]S(=O)(=O)c2cnc(Cl)c(C)c2)c(Cl)c1 ZINC000763510720 1050595182 /nfs/dbraw/zinc/59/51/82/1050595182.db2.gz PUFRCQATYWEAND-UHFFFAOYSA-N -1 3 345.251 4.114 20 0 EIADHM Cc1ccc(NC(=O)Nc2c([O-])cccc2Br)cc1F ZINC001187986016 1050663626 /nfs/dbraw/zinc/66/36/26/1050663626.db2.gz RAUSTJXNZXFNBS-UHFFFAOYSA-N -1 3 339.164 4.246 20 0 EIADHM COc1ccc(C)cc1Nc1cc(Br)cc(F)c1[O-] ZINC001173985682 1050664595 /nfs/dbraw/zinc/66/45/95/1050664595.db2.gz CHNLJVSNXDPCEN-UHFFFAOYSA-N -1 3 326.165 4.354 20 0 EIADHM CCC(CC)(CC)C[N-]S(=O)(=O)c1cccc(Cl)c1Cl ZINC001188140649 1050709575 /nfs/dbraw/zinc/70/95/75/1050709575.db2.gz HTZBZAZGHGECML-UHFFFAOYSA-N -1 3 338.300 4.488 20 0 EIADHM CC(C)CC1(C[N-]S(=O)(=O)c2c(Cl)cccc2Cl)CC1 ZINC001188148303 1050713360 /nfs/dbraw/zinc/71/33/60/1050713360.db2.gz JKWKWSAUWLEURF-UHFFFAOYSA-N -1 3 336.284 4.098 20 0 EIADHM CCc1cccc(C(=O)N2CCC[C@@]2(C)Cc2cccs2)c1[O-] ZINC001179558533 1050725094 /nfs/dbraw/zinc/72/50/94/1050725094.db2.gz VBDWOSMVQYOSNZ-IBGZPJMESA-N -1 3 329.465 4.254 20 0 EIADHM O=C([N-]c1cc(-c2ccccn2)no1)Nc1cccc(Cl)c1F ZINC001188386269 1050757322 /nfs/dbraw/zinc/75/73/22/1050757322.db2.gz ZBMMIDHZDVDUOL-UHFFFAOYSA-N -1 3 332.722 4.173 20 0 EIADHM COc1ccc(NC(=O)Nc2cc([O-])cc(Cl)c2)cc1Cl ZINC001188475108 1050782764 /nfs/dbraw/zinc/78/27/64/1050782764.db2.gz ZSMZPUJOIRSHSH-UHFFFAOYSA-N -1 3 327.167 4.352 20 0 EIADHM Cc1cccc([O-])c1C(=O)Nc1c[nH]c2ccc(Br)cc12 ZINC001188640038 1050820805 /nfs/dbraw/zinc/82/08/05/1050820805.db2.gz CEEDEFSXVDLOBG-UHFFFAOYSA-N -1 3 345.196 4.197 20 0 EIADHM O=C(NCc1ccco1)c1cccc(Nc2ccc([O-])c(Cl)c2)c1 ZINC001174201276 1050837755 /nfs/dbraw/zinc/83/77/55/1050837755.db2.gz XAHWIQBCKJEZBF-UHFFFAOYSA-N -1 3 342.782 4.312 20 0 EIADHM CC1CCN(C(=O)c2cccc(Nc3cc(F)c([O-])c(F)c3)c2)CC1 ZINC001174205638 1050840988 /nfs/dbraw/zinc/84/09/88/1050840988.db2.gz NZNBIADDZHGERJ-UHFFFAOYSA-N -1 3 346.377 4.286 20 0 EIADHM O=C(Nc1ccccc1)c1cccc(Nc2ncc(Cl)cc2[O-])c1 ZINC001174206181 1050841616 /nfs/dbraw/zinc/84/16/16/1050841616.db2.gz FXASMELEESIGIG-UHFFFAOYSA-N -1 3 339.782 4.437 20 0 EIADHM COc1cccc(C)c1C(=O)[N-]c1c(SC)cc(C)nc1SC ZINC001188778549 1050842916 /nfs/dbraw/zinc/84/29/16/1050842916.db2.gz ADDIWCQQDVHFLP-UHFFFAOYSA-N -1 3 348.493 4.403 20 0 EIADHM O=C(c1cc(Nc2ccc([O-])c(Cl)c2)ccc1F)N1CCCC1 ZINC001188861338 1050854985 /nfs/dbraw/zinc/85/49/85/1050854985.db2.gz PWNUOYWMNYJEOD-UHFFFAOYSA-N -1 3 334.778 4.164 20 0 EIADHM C[C@@H]1CC[C@H]([N-]S(=O)(=O)c2cc(Cl)ccc2Cl)C[C@@H]1C ZINC001189050161 1050894870 /nfs/dbraw/zinc/89/48/70/1050894870.db2.gz ZTBHBUVRZHTHAX-SCVCMEIPSA-N -1 3 336.284 4.096 20 0 EIADHM [O-]c1c(Cl)cc(Br)cc1Nc1cccc2[nH]ncc21 ZINC001174347868 1050903924 /nfs/dbraw/zinc/90/39/24/1050903924.db2.gz NWIMNKZFDYJRHK-UHFFFAOYSA-N -1 3 338.592 4.428 20 0 EIADHM C[C@H](CSCc1nnc(-c2ccccc2[O-])o1)c1ccccc1 ZINC001189276244 1050956057 /nfs/dbraw/zinc/95/60/57/1050956057.db2.gz JIPPZCHVOATUOX-CYBMUJFWSA-N -1 3 326.421 4.479 20 0 EIADHM CCCCOc1ccc(NC(=O)Nc2cccc(C(C)=O)c2[O-])cc1 ZINC001189315007 1050961299 /nfs/dbraw/zinc/96/12/99/1050961299.db2.gz IMOBEVGBLVGPBR-UHFFFAOYSA-N -1 3 342.395 4.418 20 0 EIADHM COc1ccc(Cn2cc(Nc3cccc(Cl)c3[O-])cn2)cc1 ZINC001174438054 1050968186 /nfs/dbraw/zinc/96/81/86/1050968186.db2.gz WUENZTPVFHFIOP-UHFFFAOYSA-N -1 3 329.787 4.043 20 0 EIADHM COc1ccc(F)cc1CNCc1cc(Cl)cc(Cl)c1[O-] ZINC000189199620 1050988236 /nfs/dbraw/zinc/98/82/36/1050988236.db2.gz LWAIYSZLBSXUHT-UHFFFAOYSA-N -1 3 330.186 4.137 20 0 EIADHM [O-]c1c(Br)ccc(Cl)c1Nc1ccc2c[nH]nc2c1 ZINC001174502659 1051036354 /nfs/dbraw/zinc/03/63/54/1051036354.db2.gz WPAKAWOBQRWIML-UHFFFAOYSA-N -1 3 338.592 4.428 20 0 EIADHM [O-]c1cccc2sc(Nc3ccc(N4CCCCC4)nc3)nc21 ZINC001174521271 1051051971 /nfs/dbraw/zinc/05/19/71/1051051971.db2.gz BSXZOXKHMUQQNS-UHFFFAOYSA-N -1 3 326.425 4.131 20 0 EIADHM C[C@H](O)c1ncc(C(=O)[N-]c2ccccc2SC(F)(F)F)s1 ZINC000773904102 1051159994 /nfs/dbraw/zinc/15/99/94/1051159994.db2.gz LGGLCDMDOQDTSG-ZETCQYMHSA-N -1 3 348.371 4.061 20 0 EIADHM O=C(Nc1ccc(Cl)cc1[O-])c1cc(F)ccc1Br ZINC000153537610 1051190845 /nfs/dbraw/zinc/19/08/45/1051190845.db2.gz MCWNRJWPCILOFF-UHFFFAOYSA-N -1 3 344.567 4.200 20 0 EIADHM O=S(=O)([N-]c1ccc(Cl)c(F)c1F)c1ccc(C2CC2)cc1 ZINC001190499752 1051193196 /nfs/dbraw/zinc/19/31/96/1051193196.db2.gz GTOKZPUGADLTRZ-UHFFFAOYSA-N -1 3 343.782 4.296 20 0 EIADHM O=C(Nc1ccc(Cl)cc1[O-])c1ccc(F)cc1C(F)(F)F ZINC000153587304 1051199627 /nfs/dbraw/zinc/19/96/27/1051199627.db2.gz RZCUSLUTVQXFKS-UHFFFAOYSA-N -1 3 333.668 4.456 20 0 EIADHM CC(=O)c1ccc(OCCCC(=O)Nc2ccc(Cl)cc2[O-])cc1 ZINC000153650794 1051209446 /nfs/dbraw/zinc/20/94/46/1051209446.db2.gz DHIAYVRYYUICOH-UHFFFAOYSA-N -1 3 347.798 4.046 20 0 EIADHM Cc1cc(C(=O)Nc2ccc([O-])c(C(F)(F)F)c2)c(C)n1C1CC1 ZINC000153685943 1051214455 /nfs/dbraw/zinc/21/44/55/1051214455.db2.gz JYYDTVUXQKYQHN-UHFFFAOYSA-N -1 3 338.329 4.417 20 0 EIADHM CCc1c(NCc2ccc([O-])c(F)c2)cnn1-c1cccc(C)c1 ZINC001181383233 1051216156 /nfs/dbraw/zinc/21/61/56/1051216156.db2.gz RAOSHFNPPVVAGT-UHFFFAOYSA-N -1 3 325.387 4.200 20 0 EIADHM O=C(Nc1ccc([O-])c(F)c1)Nc1ccccc1OC(F)(F)F ZINC001190680579 1051254629 /nfs/dbraw/zinc/25/46/29/1051254629.db2.gz KQRHRFXGDRFADE-UHFFFAOYSA-N -1 3 330.237 4.074 20 0 EIADHM O=C(Nc1ccc(OC(F)(F)F)cc1)Nc1ccc(F)c([O-])c1 ZINC001190746013 1051270583 /nfs/dbraw/zinc/27/05/83/1051270583.db2.gz NKPYZAPBSNJFQQ-UHFFFAOYSA-N -1 3 330.237 4.074 20 0 EIADHM O=c1cc(Nc2cc(F)cc(C(F)(F)F)c2)[n-]n1-c1ccccc1 ZINC001175063333 1051315083 /nfs/dbraw/zinc/31/50/83/1051315083.db2.gz XQSYIWPPZJVFHU-UHFFFAOYSA-N -1 3 337.276 4.479 20 0 EIADHM COCc1ccc(Br)c(Nc2c(F)cc([O-])cc2F)c1 ZINC001175102487 1051350151 /nfs/dbraw/zinc/35/01/51/1051350151.db2.gz MLWRZRBKBVGEPH-UHFFFAOYSA-N -1 3 344.155 4.323 20 0 EIADHM COc1cc(Nc2cc(Br)cc(F)c2[O-])cc(OC)c1 ZINC001175109669 1051353892 /nfs/dbraw/zinc/35/38/92/1051353892.db2.gz YIBSHUCSXBGEFY-UHFFFAOYSA-N -1 3 342.164 4.055 20 0 EIADHM CC(=O)c1ccc(Nc2c(F)cc([O-])cc2F)c(Br)c1 ZINC001175096588 1051380103 /nfs/dbraw/zinc/38/01/03/1051380103.db2.gz DOFDLVKJQBZCFK-UHFFFAOYSA-N -1 3 342.139 4.379 20 0 EIADHM C[C@H](NC(=O)NCc1ccc([O-])c(F)c1)c1cccc2ccccc21 ZINC000155354715 1051410120 /nfs/dbraw/zinc/41/01/20/1051410120.db2.gz HUSJDVHHIPYWMM-ZDUSSCGKSA-N -1 3 338.382 4.245 20 0 EIADHM O=C(Nc1ccc(F)c([O-])c1)Nc1cc(F)cc(C(F)(F)F)c1 ZINC001191589652 1051483558 /nfs/dbraw/zinc/48/35/58/1051483558.db2.gz SBKVQWMSAPQKMJ-UHFFFAOYSA-N -1 3 332.228 4.333 20 0 EIADHM O=C(Nc1cc(F)cc(C(F)(F)F)c1)Nc1ncc([O-])cc1Cl ZINC001191565822 1051489935 /nfs/dbraw/zinc/48/99/35/1051489935.db2.gz PDMHXNJKQGLWKH-UHFFFAOYSA-N -1 3 349.671 4.243 20 0 EIADHM [O-]c1ccc(F)c(Nc2ccc(Br)c(F)c2F)c1F ZINC001175267645 1051502519 /nfs/dbraw/zinc/50/25/19/1051502519.db2.gz DVQWBMMSOGTLKE-UHFFFAOYSA-N -1 3 336.082 4.455 20 0 EIADHM [O-]c1ccc(F)c(Nc2ccccc2I)c1F ZINC001175265805 1051502676 /nfs/dbraw/zinc/50/26/76/1051502676.db2.gz PLCCYHWYUKPXKF-UHFFFAOYSA-N -1 3 347.102 4.019 20 0 EIADHM [O-]c1ccc(F)c(Nc2cc(F)ccc2OC[C@@H]2CCCO2)c1F ZINC001175268363 1051503588 /nfs/dbraw/zinc/50/35/88/1051503588.db2.gz LDODIXWWNVCLKS-NSHDSACASA-N -1 3 339.313 4.111 20 0 EIADHM Cc1cc(Br)cc(Nc2c(F)ccc([O-])c2F)c1N ZINC001175268118 1051504385 /nfs/dbraw/zinc/50/43/85/1051504385.db2.gz HYCYWVZHWFZPBF-UHFFFAOYSA-N -1 3 329.144 4.067 20 0 EIADHM Cc1cc(Nc2c(F)ccc([O-])c2F)n(Cc2ccccc2F)n1 ZINC001175265928 1051504515 /nfs/dbraw/zinc/50/45/15/1051504515.db2.gz MRIQROSTIMXIFD-UHFFFAOYSA-N -1 3 333.313 4.106 20 0 EIADHM CC(C)(C)OC(=O)c1ccc(Nc2c(F)ccc([O-])c2F)cc1O ZINC001175269478 1051506619 /nfs/dbraw/zinc/50/66/19/1051506619.db2.gz GJJDSQPQQTXVOX-UHFFFAOYSA-N -1 3 337.322 4.075 20 0 EIADHM COc1cc(C)c(Nc2c(F)ccc([O-])c2F)cc1Br ZINC001175270160 1051507109 /nfs/dbraw/zinc/50/71/09/1051507109.db2.gz UXFLXBPMAZALGS-UHFFFAOYSA-N -1 3 344.155 4.494 20 0 EIADHM COc1cc(Br)cc(F)c1Nc1c(F)ccc([O-])c1F ZINC001175270045 1051507786 /nfs/dbraw/zinc/50/77/86/1051507786.db2.gz UDBMNAFWCYGIFZ-UHFFFAOYSA-N -1 3 348.118 4.324 20 0 EIADHM COCCCNc1cccc(F)c1Nc1c(F)ccc([O-])c1F ZINC001175270892 1051509781 /nfs/dbraw/zinc/50/97/81/1051509781.db2.gz NEVMZZDKQFWRCZ-UHFFFAOYSA-N -1 3 326.318 4.002 20 0 EIADHM O=C(Nc1cc(C2CCCC2)[nH]n1)c1cc2sccc2c([O-])c1 ZINC000774418126 1051586028 /nfs/dbraw/zinc/58/60/28/1051586028.db2.gz GPGFZIPQLXUDMV-UHFFFAOYSA-N -1 3 327.409 4.240 20 0 EIADHM c1ccc(COc2ccc(Nc3ccc(-c4nn[n-]n4)cc3)cc2)cc1 ZINC001175428821 1051587461 /nfs/dbraw/zinc/58/74/61/1051587461.db2.gz MLOYNJRLJXZBGP-UHFFFAOYSA-N -1 3 343.390 4.189 20 0 EIADHM Cc1cc(Nc2cc(Br)cc(F)c2[O-])cc2c[nH]nc21 ZINC001175521074 1051648774 /nfs/dbraw/zinc/64/87/74/1051648774.db2.gz IQJIEUARHKMORF-UHFFFAOYSA-N -1 3 336.164 4.222 20 0 EIADHM Cc1ccc2n[nH]cc2c1Nc1cc(Br)cc(F)c1[O-] ZINC001175527617 1051653304 /nfs/dbraw/zinc/65/33/04/1051653304.db2.gz RMWBRQCVIOBUKY-UHFFFAOYSA-N -1 3 336.164 4.222 20 0 EIADHM CC(C)(C)c1ccc(C(=O)N2CC[C@@](CF)(C(F)(F)F)C2)c([O-])c1 ZINC001192313842 1051689268 /nfs/dbraw/zinc/68/92/68/1051689268.db2.gz IWJDQSQVYAZQIK-INIZCTEOSA-N -1 3 347.352 4.054 20 0 EIADHM CC(C)(C)c1ccc(C(=O)N[C@@H](c2ccnc(F)c2)C2CC2)c([O-])c1 ZINC001192339899 1051694672 /nfs/dbraw/zinc/69/46/72/1051694672.db2.gz MFSZYGQAXZDIOA-GOSISDBHSA-N -1 3 342.414 4.105 20 0 EIADHM Cc1cc(F)c(Br)cc1NCc1c(F)ccc([O-])c1F ZINC001205596072 1051706913 /nfs/dbraw/zinc/70/69/13/1051706913.db2.gz PMACMZVUWLADQL-UHFFFAOYSA-N -1 3 346.146 4.493 20 0 EIADHM COc1c(Cl)ccc(F)c1Nc1ncc(Br)cc1[O-] ZINC001250098700 1051767676 /nfs/dbraw/zinc/76/76/76/1051767676.db2.gz ABTBGICCJBZQIB-UHFFFAOYSA-N -1 3 347.571 4.094 20 0 EIADHM COC(=O)C1(c2ccc(Nc3ccc(C)c([O-])c3Cl)cc2)CC1 ZINC001175921429 1051844308 /nfs/dbraw/zinc/84/43/08/1051844308.db2.gz YGKYTXIPRYLJOK-UHFFFAOYSA-N -1 3 331.799 4.302 20 0 EIADHM O=c1ccn(-c2ccc(Nc3ccc(-c4ccccn4)cc3)cc2)[n-]1 ZINC001176040066 1051883756 /nfs/dbraw/zinc/88/37/56/1051883756.db2.gz MOFLAJAMDCCNEN-UHFFFAOYSA-N -1 3 328.375 4.384 20 0 EIADHM O=C(Nc1csc2cnccc12)c1ccc([O-])cc1C(F)(F)F ZINC001193735858 1051977052 /nfs/dbraw/zinc/97/70/52/1051977052.db2.gz VKTYDGXKIXFBKN-UHFFFAOYSA-N -1 3 338.310 4.273 20 0 EIADHM CCN(C(=O)c1cc([O-])cc(C(F)(F)F)c1)[C@H](C)c1cccnc1 ZINC000621871025 1051986786 /nfs/dbraw/zinc/98/67/86/1051986786.db2.gz ZJKIYUNZDXRPIJ-LLVKDONJSA-N -1 3 338.329 4.029 20 0 EIADHM CC(C)(CNC(=O)c1ccc([O-])cc1C(F)(F)F)CC(F)(F)F ZINC001193759093 1051990846 /nfs/dbraw/zinc/99/08/46/1051990846.db2.gz MMMRKDZNLXFJJE-UHFFFAOYSA-N -1 3 343.267 4.119 20 0 EIADHM C[C@@H]1C[C@@H](NC(=O)c2ccc([O-])cc2C(F)(F)F)c2ccccc21 ZINC001193758055 1051991391 /nfs/dbraw/zinc/99/13/91/1051991391.db2.gz JXJUQPGZJMOBFX-QLJPJBMISA-N -1 3 335.325 4.389 20 0 EIADHM O=C(NCc1ncccc1[O-])c1ccccc1-c1cccc(Cl)c1 ZINC001193814269 1052001844 /nfs/dbraw/zinc/00/18/44/1052001844.db2.gz FMSJPPTZCAZWLS-UHFFFAOYSA-N -1 3 338.794 4.038 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)N(Cc1ccccc1)CC1CCC1 ZINC000163756195 1052005208 /nfs/dbraw/zinc/00/52/08/1052005208.db2.gz JVLIGQOQQKPKRW-UHFFFAOYSA-N -1 3 342.414 4.043 20 0 EIADHM Cc1cc(O)cc([O-])c1C(=O)Nc1cccc(-c2cccs2)c1 ZINC001193938606 1052024454 /nfs/dbraw/zinc/02/44/54/1052024454.db2.gz QVJACCNHYAGRTG-UHFFFAOYSA-N -1 3 325.389 4.387 20 0 EIADHM [O-]c1cc(F)c(Nc2cccc3c2cnn3[C@H]2CCCCO2)c(F)c1 ZINC001176322134 1052027759 /nfs/dbraw/zinc/02/77/59/1052027759.db2.gz DJUOMZAUJPUMDT-QGZVFWFLSA-N -1 3 345.349 4.463 20 0 EIADHM Cc1nc(C)c(C)c(Sc2nnc([N-]c3ccccc3F)s2)n1 ZINC001184571991 1052046663 /nfs/dbraw/zinc/04/66/63/1052046663.db2.gz JUBGHCKXFXVGHS-UHFFFAOYSA-N -1 3 347.444 4.287 20 0 EIADHM O=C([O-])C[C@H](NCc1cccc(OC2CCCC2)c1)c1cccs1 ZINC000671162228 1052073559 /nfs/dbraw/zinc/07/35/59/1052073559.db2.gz PAEUEYIFMTWBTL-KRWDZBQOSA-N -1 3 345.464 4.375 20 0 EIADHM CCN(CC)C(=O)c1cc(Nc2c(F)cc([O-])cc2F)ccc1F ZINC001176521552 1052108935 /nfs/dbraw/zinc/10/89/35/1052108935.db2.gz YJPKJONNWLWJFL-UHFFFAOYSA-N -1 3 338.329 4.035 20 0 EIADHM Cc1cc(Br)ccc1NC(=O)Nc1ccc(F)c([O-])c1 ZINC001184817212 1052111545 /nfs/dbraw/zinc/11/15/45/1052111545.db2.gz JLLQIJDXAUPHGP-UHFFFAOYSA-N -1 3 339.164 4.246 20 0 EIADHM Cc1cc(S(=O)(=O)[N-][C@@H]2CC[C@H]3CCCC[C@H]3C2)sc1Cl ZINC001184928598 1052132329 /nfs/dbraw/zinc/13/23/29/1052132329.db2.gz RLANXSVPPLSSQQ-FRRDWIJNSA-N -1 3 347.933 4.347 20 0 EIADHM O=C(Nc1cc([O-])cc(Cl)c1)Oc1ccc(Br)cc1 ZINC001194599696 1052177050 /nfs/dbraw/zinc/17/70/50/1052177050.db2.gz HXFPFRIAVWPUBH-UHFFFAOYSA-N -1 3 342.576 4.419 20 0 EIADHM Cc1cccc(C)c1S(=O)(=O)[N-]c1c(Cl)ncc2ccccc21 ZINC001194606183 1052178355 /nfs/dbraw/zinc/17/83/55/1052178355.db2.gz WVUVCYGQGQZHJU-UHFFFAOYSA-N -1 3 346.839 4.306 20 0 EIADHM COc1ccc([N-]S(=O)(=O)c2c(C)cccc2C)cc1C(C)C ZINC001194643807 1052184806 /nfs/dbraw/zinc/18/48/06/1052184806.db2.gz NSSKTLGCLODUQM-UHFFFAOYSA-N -1 3 333.453 4.236 20 0 EIADHM CC(C)[C@H]1CCCN(C(=O)c2cc([O-])cc(C(F)(F)F)c2)CC1 ZINC000622374638 1052228567 /nfs/dbraw/zinc/22/85/67/1052228567.db2.gz WIZZLBAHJHRDJY-LBPRGKRZSA-N -1 3 329.362 4.309 20 0 EIADHM Cc1ccc(CNC(=O)Nc2cc(Br)c(C)cc2[O-])cc1 ZINC001185407251 1052240505 /nfs/dbraw/zinc/24/05/05/1052240505.db2.gz WEKAJWFADDNHQL-UHFFFAOYSA-N -1 3 349.228 4.093 20 0 EIADHM CC[C@@H](NC(=O)c1cc(Cc2ccccc2)ccc1[O-])c1ccncc1 ZINC000622388677 1052241965 /nfs/dbraw/zinc/24/19/65/1052241965.db2.gz ZKXVJQVMVAVSQS-HXUWFJFHSA-N -1 3 346.430 4.259 20 0 EIADHM CC[C@@H](Cc1ccc(C)cc1)N(C)C(=O)c1cc([O-])ccc1Cl ZINC000622396362 1052252235 /nfs/dbraw/zinc/25/22/35/1052252235.db2.gz IULIBGPBHUBTIH-HNNXBMFYSA-N -1 3 331.843 4.447 20 0 EIADHM Cc1cc(S(=O)(=O)[N-]c2c(C)cc(F)cc2C)ccc1Cl ZINC001185532009 1052258368 /nfs/dbraw/zinc/25/83/68/1052258368.db2.gz INXYTTRYOWZPFX-UHFFFAOYSA-N -1 3 327.808 4.205 20 0 EIADHM CCCNc1ccc(Cl)cc1NC(=O)Cc1ccc([O-])c(F)c1 ZINC000622443119 1052278287 /nfs/dbraw/zinc/27/82/87/1052278287.db2.gz JRDYKISOOYSVRO-UHFFFAOYSA-N -1 3 336.794 4.188 20 0 EIADHM O=C(Nc1ccc2c(c1)CCC2)Nc1ccc(Br)cc1[O-] ZINC001185757600 1052292869 /nfs/dbraw/zinc/29/28/69/1052292869.db2.gz CBOHRYPREAFUOA-UHFFFAOYSA-N -1 3 347.212 4.287 20 0 EIADHM CC(C)C[C@@]1(C)CCCN1C(=O)c1cc([O-])cc(C(F)(F)F)c1 ZINC000622637638 1052360686 /nfs/dbraw/zinc/36/06/86/1052360686.db2.gz BOROODWYCVUSJP-MRXNPFEDSA-N -1 3 329.362 4.452 20 0 EIADHM O=C(c1cc([O-])cc(C(F)(F)F)c1)N1CC[C@H](C2CCCCC2)C1 ZINC000622750521 1052424312 /nfs/dbraw/zinc/42/43/12/1052424312.db2.gz JXZNSFKFZQEBJV-ZDUSSCGKSA-N -1 3 341.373 4.453 20 0 EIADHM Cc1cc(=O)[n-]c([C@@H](C)N[C@@H](Cc2ccccc2)c2cccs2)n1 ZINC000192777933 1052638221 /nfs/dbraw/zinc/63/82/21/1052638221.db2.gz XMZHGPWPKWZASD-ZBFHGGJFSA-N -1 3 339.464 4.187 20 0 EIADHM CCc1onc(C)c1[N-]C(=O)c1sc(C)nc1-c1ccccc1 ZINC000179018885 1052720152 /nfs/dbraw/zinc/72/01/52/1052720152.db2.gz CBEYODDEOAPVQD-UHFFFAOYSA-N -1 3 327.409 4.230 20 0 EIADHM CC(C)(C(=O)Nc1cc(Br)ccc1[O-])c1cccs1 ZINC000179653724 1052745957 /nfs/dbraw/zinc/74/59/57/1052745957.db2.gz PVKMCCRKRGTMBS-UHFFFAOYSA-N -1 3 340.242 4.133 20 0 EIADHM O=C([N-]c1c(F)cc(Cl)cc1F)c1coc(Br)c1 ZINC000180349887 1052795275 /nfs/dbraw/zinc/79/52/75/1052795275.db2.gz WTOLUCKXUXGWPV-UHFFFAOYSA-N -1 3 336.519 4.226 20 0 EIADHM C[C@H](CC(=O)Nc1cccc([O-])c1F)C(=O)c1ccc(Cl)cc1 ZINC000180928097 1052819262 /nfs/dbraw/zinc/81/92/62/1052819262.db2.gz YBUWUHJJBPHFAS-SNVBAGLBSA-N -1 3 335.762 4.032 20 0 EIADHM O=C(CC1CCC(F)(F)CC1)Nc1ccc(Br)cc1[O-] ZINC000624056456 1052857460 /nfs/dbraw/zinc/85/74/60/1052857460.db2.gz BAOKBLUYZVHGJL-UHFFFAOYSA-N -1 3 348.187 4.309 20 0 EIADHM Cc1sc2[n-]c([C@@H](C)OC(=O)[C@@H]3CCC3(C)C)nc(=O)c2c1C ZINC000850070678 1053066073 /nfs/dbraw/zinc/06/60/73/1053066073.db2.gz ULQFRVMPGDXJMB-KOLCDFICSA-N -1 3 334.441 4.054 20 0 EIADHM O=c1ccnc(C=Cc2ccc(Oc3cc(F)cc(F)c3)cc2)[n-]1 ZINC000764433068 1053099872 /nfs/dbraw/zinc/09/98/72/1053099872.db2.gz AYAXCEJMADYPCV-ZZXKWVIFSA-N -1 3 326.302 4.423 20 0 EIADHM O=c1ccnc(C=Cc2ccc(-c3cccc(Br)c3)o2)[n-]1 ZINC000764440921 1053103900 /nfs/dbraw/zinc/10/39/00/1053103900.db2.gz CSACNRRJDJGVLG-FNORWQNLSA-N -1 3 343.180 4.375 20 0 EIADHM COc1cc(C)c(S(=O)(=O)[N-]c2ccccc2C2CC2)c(C)c1C ZINC001194835546 1053126410 /nfs/dbraw/zinc/12/64/10/1053126410.db2.gz KAUNCCXGRPIHJR-UHFFFAOYSA-N -1 3 345.464 4.299 20 0 EIADHM O=C([O-])CCc1cccc(CNCc2ccc(C(F)(F)F)cc2)c1 ZINC000864517873 1053300972 /nfs/dbraw/zinc/30/09/72/1053300972.db2.gz NQJAGZNDNJATJI-UHFFFAOYSA-N -1 3 337.341 4.012 20 0 EIADHM CC(=O)c1cccc([O-])c1NC(=O)c1cc(Cl)c(Cl)s1 ZINC001195176218 1053319175 /nfs/dbraw/zinc/31/91/75/1053319175.db2.gz IMGQYLKHFACPDI-UHFFFAOYSA-N -1 3 330.192 4.215 20 0 EIADHM Cc1ccc(Cl)c([N-]S(=O)(=O)c2c(C)cccc2Cl)c1 ZINC001195309168 1053373412 /nfs/dbraw/zinc/37/34/12/1053373412.db2.gz JRKOPXFHNNJZJO-UHFFFAOYSA-N -1 3 330.236 4.411 20 0 EIADHM CSc1ccc([N-]S(=O)(=O)c2c(C)cccc2Cl)c(F)c1 ZINC001195316672 1053373505 /nfs/dbraw/zinc/37/35/05/1053373505.db2.gz SLZYLHZCKOWLGL-UHFFFAOYSA-N -1 3 345.848 4.310 20 0 EIADHM Cc1cc(=O)[n-]c(-c2cccc(OC(=O)[C@@]3(C)CC=C(C)CC3)c2)n1 ZINC000850860513 1053375209 /nfs/dbraw/zinc/37/52/09/1053375209.db2.gz KGICKPWNTHDVBB-FQEVSTJZSA-N -1 3 338.407 4.200 20 0 EIADHM O=C(Nc1ccc2[nH][n-]c(=O)c2c1)c1sccc1-c1ccccc1 ZINC001195719639 1053470528 /nfs/dbraw/zinc/47/05/28/1053470528.db2.gz YCGPWHJFRYYRBS-UHFFFAOYSA-N -1 3 335.388 4.249 20 0 EIADHM CCC[C@H](O)CCCSCc1nc2c3ccccc3oc2c(=O)[n-]1 ZINC000865382741 1053488779 /nfs/dbraw/zinc/48/87/79/1053488779.db2.gz WBFYCQFLEGJXKW-LBPRGKRZSA-N -1 3 346.452 4.256 20 0 EIADHM COc1cccc(C(=O)Nc2cccc3c(Cl)c(C)cnc23)c1[O-] ZINC001168539327 1053503875 /nfs/dbraw/zinc/50/38/75/1053503875.db2.gz ZSHITJFGPGYOEV-UHFFFAOYSA-N -1 3 342.782 4.163 20 0 EIADHM O=C1[N-]C(=O)/C(=C\c2ccc(-c3ccccc3Cl)o2)c2ccccc21 ZINC000015662001 1053511814 /nfs/dbraw/zinc/51/18/14/1053511814.db2.gz ORPNXKMJPPBTKZ-WJDWOHSUSA-N -1 3 349.773 4.411 20 0 EIADHM Cc1nc(C)c(Cc2nc(C3CC(C)(C)CC(C)(C)C3)no2)c(=O)[n-]1 ZINC000854098295 1053757828 /nfs/dbraw/zinc/75/78/28/1053757828.db2.gz KEEFMAUMCYIGNI-UHFFFAOYSA-N -1 3 344.459 4.093 20 0 EIADHM Cc1ccc(NC(=S)NCc2ccccc2Cl)c(Cl)c1[O-] ZINC001196828846 1053769145 /nfs/dbraw/zinc/76/91/45/1053769145.db2.gz VKCXJAMSHFUAAA-UHFFFAOYSA-N -1 3 341.263 4.494 20 0 EIADHM [O-]c1cc(C(F)(F)F)ccc1NC(=S)Nc1ccc(F)cc1 ZINC001196941773 1053810555 /nfs/dbraw/zinc/81/05/55/1053810555.db2.gz YQVXCZUFLRNUFT-UHFFFAOYSA-N -1 3 330.306 4.359 20 0 EIADHM CCCN(Cc1ccccc1)Cc1nc2c3ccccc3oc2c(=O)[n-]1 ZINC000024820555 1053818384 /nfs/dbraw/zinc/81/83/84/1053818384.db2.gz SXFIGBVTYWCAJO-UHFFFAOYSA-N -1 3 347.418 4.494 20 0 EIADHM O=C(Nc1ccc(-c2cnco2)cc1)c1cc([O-])c2ccccc2c1 ZINC000471797382 1053844797 /nfs/dbraw/zinc/84/47/97/1053844797.db2.gz IOJUWHPUTCVIAV-UHFFFAOYSA-N -1 3 330.343 4.453 20 0 EIADHM [O-]c1cccc(F)c1NC(=S)Nc1ccccc1OC(F)(F)F ZINC001198162379 1054088208 /nfs/dbraw/zinc/08/82/08/1054088208.db2.gz AVRKIEXQKGOIOY-UHFFFAOYSA-N -1 3 346.305 4.239 20 0 EIADHM Cc1cn(-c2ccc(Cl)cc2)nc1NC(=O)c1ccc(C)cc1[O-] ZINC001626046691 1054088329 /nfs/dbraw/zinc/08/83/29/1054088329.db2.gz KDDVYLHFNYCXBT-UHFFFAOYSA-N -1 3 341.798 4.100 20 0 EIADHM CC[C@H](NC(=O)c1cc(=O)c2ccccc2[n-]1)c1ccc(Cl)cc1 ZINC000041866372 1054152820 /nfs/dbraw/zinc/15/28/20/1054152820.db2.gz NUZYMAOKNPEZGA-HNNXBMFYSA-N -1 3 340.810 4.063 20 0 EIADHM C[C@H]1CN(C(=O)c2cc([O-])c3ccccc3c2)C[C@@H](c2ccccc2)O1 ZINC000471878098 1054193183 /nfs/dbraw/zinc/19/31/83/1054193183.db2.gz WMPDCRGIXVGIDI-BTYIYWSLSA-N -1 3 347.414 4.148 20 0 EIADHM O=C([N-]Cc1cccc(O)c1)C(F)(F)c1cccc(Cl)c1Cl ZINC000857452073 1054249196 /nfs/dbraw/zinc/24/91/96/1054249196.db2.gz NWOWWCUOHBQUMS-UHFFFAOYSA-N -1 3 346.160 4.107 20 0 EIADHM C[C@H](CC(=O)[N-]OCc1ccc(F)cc1)Cc1ccc(Cl)cc1 ZINC000857484339 1054270760 /nfs/dbraw/zinc/27/07/60/1054270760.db2.gz BURDRBHMHHBQBL-ZDUSSCGKSA-N -1 3 335.806 4.296 20 0 EIADHM O=S(=O)([N-]c1ccc(-n2cccc2)cc1)c1ccc2occc2c1 ZINC001198817360 1054271935 /nfs/dbraw/zinc/27/19/35/1054271935.db2.gz ZKQNRJVTIULCNG-UHFFFAOYSA-N -1 3 338.388 4.024 20 0 EIADHM CCOCCC1(CNC(=O)c2cc([O-])c3ccccc3c2)CCCC1 ZINC000472320775 1054273925 /nfs/dbraw/zinc/27/39/25/1054273925.db2.gz XKSQVEFXOBYKNI-UHFFFAOYSA-N -1 3 341.451 4.262 20 0 EIADHM COc1ccc(S(=O)(=O)[N-]c2cc(C(C)C)ccc2C)c(C)c1 ZINC001198943556 1054307944 /nfs/dbraw/zinc/30/79/44/1054307944.db2.gz JKZNCFVSCMSHFK-UHFFFAOYSA-N -1 3 333.453 4.236 20 0 EIADHM C[C@H](N[C@@H](c1ccc(F)cc1)[C@H]1CCCO1)c1cccc([O-])c1F ZINC000872028594 1054348298 /nfs/dbraw/zinc/34/82/98/1054348298.db2.gz KRWSIASQEWXGEA-WILYLXEWSA-N -1 3 333.378 4.241 20 0 EIADHM Cc1ccc2oc(C(=O)[N-]c3c4nsnc4ccc3Cl)cc2n1 ZINC000776961468 1054353358 /nfs/dbraw/zinc/35/33/58/1054353358.db2.gz USOHFLCKFAQCLK-UHFFFAOYSA-N -1 3 344.783 4.047 20 0 EIADHM CCCC[C@H](CC)C(=O)Nc1cccc(-c2nc(CC)cc(=O)[n-]2)c1 ZINC000046066186 1054363703 /nfs/dbraw/zinc/36/37/03/1054363703.db2.gz GCRSMIGQELBZKI-AWEZNQCLSA-N -1 3 341.455 4.154 20 0 EIADHM Cc1cc(C(=O)CCC(=O)Nc2ccc(Cl)cc2[O-])c(C)s1 ZINC000339007158 1054366984 /nfs/dbraw/zinc/36/69/84/1054366984.db2.gz NJOAIZVGFSJEMQ-UHFFFAOYSA-N -1 3 337.828 4.326 20 0 EIADHM O=C([O-])c1ccc(CN2CCC(c3cccc(F)c3)CC2)cc1F ZINC000872165781 1054418164 /nfs/dbraw/zinc/41/81/64/1054418164.db2.gz LGGFOAGZYWRRBK-UHFFFAOYSA-N -1 3 331.362 4.043 20 0 EIADHM Cc1nc(C2CCN([C@@H](C)c3ccccc3F)CC2)sc1C(=O)[O-] ZINC000872165311 1054418822 /nfs/dbraw/zinc/41/88/22/1054418822.db2.gz SBSXDFYJWRLBKD-LBPRGKRZSA-N -1 3 348.443 4.229 20 0 EIADHM CC(=O)c1cccc([O-])c1NC(=O)c1ccc(C(C)C)nc1Cl ZINC001199703105 1054446955 /nfs/dbraw/zinc/44/69/55/1054446955.db2.gz LKHNVFAEQNNSNW-UHFFFAOYSA-N -1 3 332.787 4.019 20 0 EIADHM C[C@@H]1CN(Cc2ccc(-c3ccccc3C(=O)[O-])o2)C[C@H](C)C1(F)F ZINC000859818892 1054736690 /nfs/dbraw/zinc/73/66/90/1054736690.db2.gz XAUMYWLPNUWKFH-BETUJISGSA-N -1 3 349.377 4.368 20 0 EIADHM CC(=O)Nc1cccc(NC(=O)c2cc([O-])c3ccccc3c2)c1C ZINC000352242791 1054895303 /nfs/dbraw/zinc/89/53/03/1054895303.db2.gz ZCHHQCCEGQIFEU-UHFFFAOYSA-N -1 3 334.375 4.065 20 0 EIADHM COc1cccc(-c2cc([N-]C(=O)Nc3ccc(F)cc3F)on2)c1 ZINC001202012611 1054980707 /nfs/dbraw/zinc/98/07/07/1054980707.db2.gz YPRWDYJKOYFPFW-UHFFFAOYSA-N -1 3 345.305 4.272 20 0 EIADHM CCOC(=O)c1nc(C2CC2)oc1[N-]C(=O)Nc1ccccc1Cl ZINC001202052960 1055001198 /nfs/dbraw/zinc/00/11/98/1055001198.db2.gz JMZYEUVTQTUGOK-UHFFFAOYSA-N -1 3 349.774 4.026 20 0 EIADHM O=C(Nc1ccc(Br)cc1[O-])Nc1c(F)cccc1F ZINC001202041780 1055016754 /nfs/dbraw/zinc/01/67/54/1055016754.db2.gz LAPJDTINJANPBI-UHFFFAOYSA-N -1 3 343.127 4.077 20 0 EIADHM CC1(NC(=O)c2cc3sccc3c([O-])c2)CCC(F)(F)CC1 ZINC000862692214 1055097403 /nfs/dbraw/zinc/09/74/03/1055097403.db2.gz APMQWHOYNRXMQW-UHFFFAOYSA-N -1 3 325.380 4.305 20 0 EIADHM O=C([N-]c1cc([N+](=O)[O-])ccc1F)c1cc2cccc(Cl)c2o1 ZINC000084520698 1055103060 /nfs/dbraw/zinc/10/30/60/1055103060.db2.gz BDSGHTAODSXDJI-UHFFFAOYSA-N -1 3 334.690 4.386 20 0 EIADHM O=C([N-]c1cc(-c2ccccn2)no1)Nc1cccc(C(F)(F)F)c1 ZINC001202290668 1055126462 /nfs/dbraw/zinc/12/64/62/1055126462.db2.gz VGKKPULGBORJFL-UHFFFAOYSA-N -1 3 348.284 4.399 20 0 EIADHM CC[C@@H](NC(=O)c1cc(=O)c2ccccc2[n-]1)C(C)(C)c1ccccc1 ZINC000266047819 1055127169 /nfs/dbraw/zinc/12/71/69/1055127169.db2.gz FMQDYFIACBONOL-HXUWFJFHSA-N -1 3 348.446 4.427 20 0 EIADHM CCN(Cc1nnc(-c2ccccc2[O-])o1)[C@H](C)c1ccc(F)cc1 ZINC000877990609 1055171932 /nfs/dbraw/zinc/17/19/32/1055171932.db2.gz IBAFCSYWNNWQIG-CYBMUJFWSA-N -1 3 341.386 4.164 20 0 EIADHM O=C([N-]c1cc(C(F)(F)F)no1)Nc1ccc(C(F)(F)F)cc1 ZINC001202403850 1055173600 /nfs/dbraw/zinc/17/36/00/1055173600.db2.gz RAYTWBFLHORKSF-UHFFFAOYSA-N -1 3 339.195 4.356 20 0 EIADHM C[C@@H]1CCN(Cc2nnc(-c3ccccc3[O-])o2)[C@H](c2ccco2)C1 ZINC000878151859 1055195231 /nfs/dbraw/zinc/19/52/31/1055195231.db2.gz DOFZQVCPRYDKIA-HIFRSBDPSA-N -1 3 339.395 4.008 20 0 EIADHM O=C([N-]c1nnc(C2CC2)s1)c1sccc1SC(F)F ZINC000107102068 1055207987 /nfs/dbraw/zinc/20/79/87/1055207987.db2.gz CIZQSVNEFOKOLK-UHFFFAOYSA-N -1 3 333.410 4.044 20 0 EIADHM C[C@H](NCc1nnc(-c2ccccc2[O-])o1)c1ccc2c(c1)CCCC2 ZINC000878346127 1055248199 /nfs/dbraw/zinc/24/81/99/1055248199.db2.gz DYVZINMFIGRJPU-AWEZNQCLSA-N -1 3 349.434 4.172 20 0 EIADHM Cc1ccc(-c2nsc([N-]C(=O)c3ncsc3C3CC3)n2)s1 ZINC000878665562 1055369142 /nfs/dbraw/zinc/36/91/42/1055369142.db2.gz KISOQIXVRMWQAP-UHFFFAOYSA-N -1 3 348.478 4.161 20 0 EIADHM CCCCc1nc(NC(=O)[C@H](C)CC2CCCC2)c(C(=O)OCC)[n-]1 ZINC001128074517 1055716990 /nfs/dbraw/zinc/71/69/90/1055716990.db2.gz ZUDKZIUMYOYORL-CYBMUJFWSA-N -1 3 349.475 4.084 20 0 EIADHM O=C(NCc1cccc2cccnc21)c1cc([O-])c2ccccc2c1 ZINC000354003979 1056195857 /nfs/dbraw/zinc/19/58/57/1056195857.db2.gz WGMYNJMHJLTGPC-UHFFFAOYSA-N -1 3 328.371 4.024 20 0 EIADHM Cc1c(Cl)cccc1OCC(=O)Nc1cc(Cl)ccc1[O-] ZINC000303930895 1056357496 /nfs/dbraw/zinc/35/74/96/1056357496.db2.gz XFDAMEDHLVJTKE-UHFFFAOYSA-N -1 3 326.179 4.025 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1ccn(-c2cccc(Cl)c2)n1 ZINC000111211054 1056773092 /nfs/dbraw/zinc/77/30/92/1056773092.db2.gz PQHSOFRVDBWCJD-UHFFFAOYSA-N -1 3 348.189 4.137 20 0 EIADHM CC[C@](C)([N-]C(=O)C(F)(F)c1ccc(F)cc1)c1nc(C)cs1 ZINC000741616880 1058310392 /nfs/dbraw/zinc/31/03/92/1058310392.db2.gz QPWKNTDMTZPVPS-HNNXBMFYSA-N -1 3 342.386 4.124 20 0 EIADHM CCCc1ncc(C(=O)[N-]c2nnc(C3CCCCC3)s2)s1 ZINC000741897447 1058453495 /nfs/dbraw/zinc/45/34/95/1058453495.db2.gz PZVCBSPBLOVJOI-UHFFFAOYSA-N -1 3 336.486 4.247 20 0 EIADHM COc1cccc(-c2noc([N-]Cc3ccc([C@@H]4C[C@@H]4C)o3)n2)c1 ZINC000742394831 1058593859 /nfs/dbraw/zinc/59/38/59/1058593859.db2.gz YGPLVASYWKKJRR-XHDPSFHLSA-N -1 3 325.368 4.074 20 0 EIADHM O=C(Nc1ncccc1[O-])c1ccc(-c2cc(F)c(F)c(F)c2)cc1 ZINC000743291946 1058920348 /nfs/dbraw/zinc/92/03/48/1058920348.db2.gz XLLZYBOACQCCCV-UHFFFAOYSA-N -1 3 344.292 4.124 20 0 EIADHM Cc1cc(C(=O)Oc2cccc(-c3nc(C)cc(=O)[n-]3)c2)c(C)s1 ZINC000744219082 1059337051 /nfs/dbraw/zinc/33/70/51/1059337051.db2.gz ZZHMIVCQEMCHQB-UHFFFAOYSA-N -1 3 340.404 4.055 20 0 EIADHM Cc1cc(=O)[n-]c(-c2cccc(OC(=O)C[C@@H]3CCCC[C@@H]3C)c2)n1 ZINC000744219276 1059337308 /nfs/dbraw/zinc/33/73/08/1059337308.db2.gz QJHGRETVJGPPBY-ZFWWWQNUSA-N -1 3 340.423 4.279 20 0 EIADHM Cc1noc(C(F)(F)F)c1C(=O)[N-]c1nc2c(cccc2C)s1 ZINC000746102347 1060026109 /nfs/dbraw/zinc/02/61/09/1060026109.db2.gz ZPVKMRXZEYBUIG-UHFFFAOYSA-N -1 3 341.314 4.172 20 0 EIADHM CCN(Cc1nc2c3ccccc3oc2c(=O)[n-]1)c1ccc(C)cc1 ZINC000746108158 1060029520 /nfs/dbraw/zinc/02/95/20/1060029520.db2.gz XOLBRSAGXOLCLX-UHFFFAOYSA-N -1 3 333.391 4.417 20 0 EIADHM [O-]c1ccc(Cl)c(Nc2cnc(Br)c(F)c2)c1F ZINC001214559314 1060198127 /nfs/dbraw/zinc/19/81/27/1060198127.db2.gz MDCMWDILODMOML-UHFFFAOYSA-N -1 3 335.535 4.225 20 0 EIADHM Cc1c([N-]S(=O)(=O)/C=C\c2ccc(C)cc2)cnn1C1CCCC1 ZINC000766576839 1060606714 /nfs/dbraw/zinc/60/67/14/1060606714.db2.gz HVCFYYBEEVXCLL-QXMHVHEDSA-N -1 3 345.468 4.028 20 0 EIADHM C[C@@H]1CCc2c(sc(Nc3ccc(Cl)c([O-])c3)c2C(N)=O)C1 ZINC001212588377 1060759433 /nfs/dbraw/zinc/75/94/33/1060759433.db2.gz NEHNOWPXCMFOTN-MRVPVSSYSA-N -1 3 336.844 4.074 20 0 EIADHM Cc1ccc(NCc2ccc(C)c3ccccc23)cc1-c1nnn[n-]1 ZINC001169416157 1060809024 /nfs/dbraw/zinc/80/90/24/1060809024.db2.gz CTQBIDARJRFFHS-UHFFFAOYSA-N -1 3 329.407 4.249 20 0 EIADHM Cc1ccc(NCc2ccc(C)c3ccccc23)cc1-c1nn[n-]n1 ZINC001169416157 1060809026 /nfs/dbraw/zinc/80/90/26/1060809026.db2.gz CTQBIDARJRFFHS-UHFFFAOYSA-N -1 3 329.407 4.249 20 0 EIADHM COc1ccc(Cn2ncc(C)c2Nc2ccc(Cl)c([O-])c2)cc1 ZINC001212590377 1060826616 /nfs/dbraw/zinc/82/66/16/1060826616.db2.gz JQFNLHAHEAMTAH-UHFFFAOYSA-N -1 3 343.814 4.351 20 0 EIADHM Nc1cc(Br)cc2c1ccn2-c1ccc(Cl)c([O-])c1 ZINC001212591418 1060857712 /nfs/dbraw/zinc/85/77/12/1060857712.db2.gz LLWYHLPOOWDNTD-UHFFFAOYSA-N -1 3 337.604 4.334 20 0 EIADHM [O-]c1cc(Nc2ccc(OC3CCOCC3)c(F)c2)ccc1Cl ZINC001212593786 1060914021 /nfs/dbraw/zinc/91/40/21/1060914021.db2.gz KAIOJOGBJLTTIO-UHFFFAOYSA-N -1 3 337.778 4.486 20 0 EIADHM [O-]c1cccnc1CNc1c(C(F)(F)F)cccc1C(F)(F)F ZINC001169730585 1060933358 /nfs/dbraw/zinc/93/33/58/1060933358.db2.gz CHJUPMDKFKFHIL-UHFFFAOYSA-N -1 3 336.235 4.437 20 0 EIADHM [O-]c1cc(Nc2cccc(F)c2OC[C@@H]2CCCO2)ccc1Cl ZINC001212595458 1060977184 /nfs/dbraw/zinc/97/71/84/1060977184.db2.gz VEOAPCCWEIERFI-LBPRGKRZSA-N -1 3 337.778 4.486 20 0 EIADHM O=C([N-][C@H]1CCCc2sccc21)C(F)(F)c1c(F)cccc1F ZINC000767143158 1061114575 /nfs/dbraw/zinc/11/45/75/1061114575.db2.gz ZUBAJFPKDGQZCV-LBPRGKRZSA-N -1 3 343.345 4.312 20 0 EIADHM C[C@H]([N-]S(=O)(=O)c1cc(F)ccc1F)c1ccc2ccccc2c1 ZINC000021175697 212214139 /nfs/dbraw/zinc/21/41/39/212214139.db2.gz DEZXUFRARZORCL-LBPRGKRZSA-N -1 3 347.386 4.158 20 0 EIADHM Cc1c(Cl)cccc1C(=O)Nc1cc(Br)ccc1[O-] ZINC000426957121 1026649288 /nfs/dbraw/zinc/64/92/88/1026649288.db2.gz WYOWNSUWAAEAQT-UHFFFAOYSA-N -1 3 340.604 4.369 20 0 EIADHM CCC(CC)CN(CC)Cc1ccc(C(=O)[O-])cc1Br ZINC000226722413 1031102162 /nfs/dbraw/zinc/10/21/62/1031102162.db2.gz TZFCYFWZKOUKRN-UHFFFAOYSA-N -1 3 342.277 4.405 20 0 EIADHM CC(C)Cc1nnc([N-]C(=O)c2csc(-c3ccccc3)n2)s1 ZINC000025445292 1032156001 /nfs/dbraw/zinc/15/60/01/1032156001.db2.gz ZKQBARYAUVNTDT-UHFFFAOYSA-N -1 3 344.465 4.112 20 0 EIADHM COC(=O)c1cnc(S[C@H](C)c2ccc3cc(OC)ccc3c2)[n-]1 ZINC000193543686 1032158708 /nfs/dbraw/zinc/15/87/08/1032158708.db2.gz YNUDBJYTDVGMNZ-LLVKDONJSA-N -1 3 342.420 4.211 20 0 EIADHM CCCc1cc(=O)[n-]c(C(=Cc2cnc(C(C)(C)C)s2)CC)n1 ZINC000193619469 1032166113 /nfs/dbraw/zinc/16/61/13/1032166113.db2.gz WSLCVUKCQSBQPO-FMIVXFBMSA-N -1 3 331.485 4.427 20 0 EIADHM O=C([N-]c1nnc(C(F)F)s1)c1cc2cc(F)ccc2s1 ZINC000194405447 1032172885 /nfs/dbraw/zinc/17/28/85/1032172885.db2.gz TWCQKESBWCESFI-UHFFFAOYSA-N -1 3 329.328 4.082 20 0 EIADHM Cc1ccc([C@@H]2CCCCN2C(=O)Cc2ccc([O-])c(F)c2)cc1 ZINC000449983428 1032187511 /nfs/dbraw/zinc/18/75/11/1032187511.db2.gz BAOCVHIOKNGXBI-SFHVURJKSA-N -1 3 327.399 4.136 20 0 EIADHM CC[C@@H](CC(F)(F)F)C(=O)Nc1cc(Br)ccc1[O-] ZINC000450046004 1032249231 /nfs/dbraw/zinc/24/92/31/1032249231.db2.gz HRGDIXJMIUKPRI-ZETCQYMHSA-N -1 3 340.139 4.072 20 0 EIADHM CC(C)(C)c1cc2cccnc2c(NC([O-])=NO[C@@H]2CCCCO2)c1 ZINC000529276929 1032277351 /nfs/dbraw/zinc/27/73/51/1032277351.db2.gz VVLGJBHEJDIPFY-MRXNPFEDSA-N -1 3 343.427 4.112 20 0 EIADHM CC(C)(C)c1cc2cccnc2c(NC(=O)[N-]O[C@@H]2CCCCO2)c1 ZINC000529276929 1032277364 /nfs/dbraw/zinc/27/73/64/1032277364.db2.gz VVLGJBHEJDIPFY-MRXNPFEDSA-N -1 3 343.427 4.112 20 0 EIADHM CC(C)(C)C(=O)CCCC(=O)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000450084735 1032289299 /nfs/dbraw/zinc/28/92/99/1032289299.db2.gz JAHSORQYZJPVAR-UHFFFAOYSA-N -1 3 331.334 4.135 20 0 EIADHM CC(C)(c1ccc(NC([O-])=NO[C@H]2CCCCO2)cc1)C(F)(F)F ZINC000760146943 1032411187 /nfs/dbraw/zinc/41/11/87/1032411187.db2.gz UBOYUEVQFCSENB-ZDUSSCGKSA-N -1 3 346.349 4.106 20 0 EIADHM CC(C)(c1ccc(NC(=O)[N-]O[C@H]2CCCCO2)cc1)C(F)(F)F ZINC000760146943 1032411198 /nfs/dbraw/zinc/41/11/98/1032411198.db2.gz UBOYUEVQFCSENB-ZDUSSCGKSA-N -1 3 346.349 4.106 20 0 EIADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)C3=CC[C@H](C)CC3)c2)n1 ZINC000454781154 1032490559 /nfs/dbraw/zinc/49/05/59/1032490559.db2.gz AKESVJTWNQLPPM-ZDUSSCGKSA-N -1 3 337.423 4.097 20 0 EIADHM O=C1c2ccccc2N[C@@H](c2ccc([O-])c(F)c2)N1Cc1ccccc1 ZINC000339387369 1018831475 /nfs/dbraw/zinc/83/14/75/1018831475.db2.gz JDCKLKZIFADSIR-HXUWFJFHSA-N -1 3 348.377 4.298 20 0 EIADHM O=C(Nc1cccc([O-])c1F)c1cc(F)c(C(F)(F)F)c(F)c1 ZINC000683250622 1019764788 /nfs/dbraw/zinc/76/47/88/1019764788.db2.gz LXIZPHIYBHHEOV-UHFFFAOYSA-N -1 3 335.203 4.081 20 0 EIADHM O=c1cc(C(F)(F)F)nc(CNc2ccccc2-c2ccccc2)[n-]1 ZINC000535621215 1019895966 /nfs/dbraw/zinc/89/59/66/1019895966.db2.gz MWYDOOOEDHAHBU-UHFFFAOYSA-N -1 3 345.324 4.480 20 0 EIADHM CC(C)Cc1nc(C(=O)[N-]c2nnc(-c3ccccc3)s2)cs1 ZINC000109394249 1019972330 /nfs/dbraw/zinc/97/23/30/1019972330.db2.gz VPEKBHYKSACZPV-UHFFFAOYSA-N -1 3 344.465 4.112 20 0 EIADHM CN(Cc1ccc(F)cc1Cl)C(=O)c1cc([O-])ccc1Cl ZINC000340029969 1020240954 /nfs/dbraw/zinc/24/09/54/1020240954.db2.gz FYAJYERQYAGIPI-UHFFFAOYSA-N -1 3 328.170 4.110 20 0 EIADHM Cc1cccc(CN(C)Cc2nc3c4ccccc4oc3c(=O)[n-]2)c1 ZINC000340406818 1020908774 /nfs/dbraw/zinc/90/87/74/1020908774.db2.gz AIQUFVWVSKBZRL-UHFFFAOYSA-N -1 3 333.391 4.022 20 0 EIADHM Cc1c(NC(=O)c2c[n-]c3ccccc3c2=O)cccc1C(F)(F)F ZINC000113733882 1021119734 /nfs/dbraw/zinc/11/97/34/1021119734.db2.gz VNSBRVLKKZYTOI-UHFFFAOYSA-N -1 3 346.308 4.108 20 0 EIADHM O=C([N-]OCc1ccccc1)Nc1ncc(C2CCCCC2)s1 ZINC000782636478 1021327238 /nfs/dbraw/zinc/32/72/38/1021327238.db2.gz CTMHECMWFKHVIZ-UHFFFAOYSA-N -1 3 331.441 4.444 20 0 EIADHM CCc1ccccc1[N-]S(=O)(=O)c1ccc(OC2CCCC2)cc1 ZINC000096659256 1032973983 /nfs/dbraw/zinc/97/39/83/1032973983.db2.gz WZRWQSKQMVRPBO-UHFFFAOYSA-N -1 3 345.464 4.371 20 0 EIADHM Cc1ccc(OC2CCN([C@@H](C)c3ccc(C(=O)[O-])o3)CC2)cc1C ZINC000580085615 1021628786 /nfs/dbraw/zinc/62/87/86/1021628786.db2.gz VTBNBMGTWMXMNN-HNNXBMFYSA-N -1 3 343.423 4.199 20 0 EIADHM Cc1cccc(C2=CCN(C(=O)c3cc([O-])ccc3Cl)CC2)c1 ZINC000345055294 1033014129 /nfs/dbraw/zinc/01/41/29/1033014129.db2.gz HHAVTIYIJHOJNR-UHFFFAOYSA-N -1 3 327.811 4.284 20 0 EIADHM FC(F)(F)[C@H](C[C@@H]1CCCO1)[N-]c1nc(-c2ccccc2)ns1 ZINC000656224494 1022056814 /nfs/dbraw/zinc/05/68/14/1022056814.db2.gz JVEHHLBGFPLDPF-RYUDHWBXSA-N -1 3 343.374 4.117 20 0 EIADHM FC(F)(F)[C@H](C[C@@H]1CCCO1)[N-]c1nc(C2CCCC2)ns1 ZINC000656227140 1022064804 /nfs/dbraw/zinc/06/48/04/1022064804.db2.gz JVNQDOVXCWVJDA-QWRGUYRKSA-N -1 3 335.395 4.108 20 0 EIADHM CCOc1ccc(NC(=O)CCCc2ccc([O-])c(F)c2)cc1F ZINC000468640421 1022279046 /nfs/dbraw/zinc/27/90/46/1022279046.db2.gz IIOQRXQBJDMSJQ-UHFFFAOYSA-N -1 3 335.350 4.031 20 0 EIADHM O=C([N-]c1nc(-c2cccs2)ns1)c1cc2ccccc2o1 ZINC000182150536 1022320005 /nfs/dbraw/zinc/32/00/05/1022320005.db2.gz KOQFOWZLBNIQBI-UHFFFAOYSA-N -1 3 327.390 4.265 20 0 EIADHM CCCCN(C)c1ccc([N-]S(=O)(=O)c2ccccc2C)cc1 ZINC000243311363 1022350684 /nfs/dbraw/zinc/35/06/84/1022350684.db2.gz LHWNMTDOOSNWCA-UHFFFAOYSA-N -1 3 332.469 4.032 20 0 EIADHM CC(C)c1ccc(C(=O)N2CCC[C@@H]2[C@H]2CCCC[C@@]2(C)O)c([O-])c1 ZINC000408409712 1033048405 /nfs/dbraw/zinc/04/84/05/1033048405.db2.gz BXHHVXOUIDWWGN-DBXWQHBBSA-N -1 3 345.483 4.061 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2ccc(CCC(F)(F)F)cc2)cc1 ZINC000175776049 1022457480 /nfs/dbraw/zinc/45/74/80/1022457480.db2.gz RFBXRNSACSOXEG-UHFFFAOYSA-N -1 3 343.370 4.291 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N1CC[C@](F)(c2ccccc2)C1 ZINC000580761908 1022477452 /nfs/dbraw/zinc/47/74/52/1022477452.db2.gz YXGCGDFQRWHJMU-OAQYLSRUSA-N -1 3 335.378 4.256 20 0 EIADHM CCn1c2ccccc2nc1[C@@H](C)[N-]c1nnc(Cc2ccccc2)o1 ZINC000893192696 1022631121 /nfs/dbraw/zinc/63/11/21/1022631121.db2.gz YQLUZZWKECWWRL-CQSZACIVSA-N -1 3 347.422 4.203 20 0 EIADHM O=C(Cc1cc2c(ccc3ccccc23)o1)NCc1ccc([O-])c(F)c1 ZINC000511550370 1022822912 /nfs/dbraw/zinc/82/29/12/1022822912.db2.gz GDHADDPKOVVAQC-UHFFFAOYSA-N -1 3 349.361 4.290 20 0 EIADHM O=C(CCc1ccc2ccccc2n1)Nc1cc(Cl)ccc1[O-] ZINC000581135641 1022849164 /nfs/dbraw/zinc/84/91/64/1022849164.db2.gz KLLAFRNXGHMIRK-UHFFFAOYSA-N -1 3 326.783 4.165 20 0 EIADHM CC[C@@H]([N-]S(=O)(=O)c1c(F)cccc1F)c1cccc(Cl)c1 ZINC000046746855 1022891107 /nfs/dbraw/zinc/89/11/07/1022891107.db2.gz MSHJNCKHFJSGCA-CQSZACIVSA-N -1 3 345.798 4.048 20 0 EIADHM Cc1ccc(C(C)C)c(O[C@H](C)C(=O)Nc2cccc([O-])c2F)c1 ZINC000128575824 1022919481 /nfs/dbraw/zinc/91/94/81/1022919481.db2.gz CSGOYHBYSGDDDP-CYBMUJFWSA-N -1 3 331.387 4.369 20 0 EIADHM C[C@@H](NC(=O)c1cc([O-])ccc1Cl)c1ccc(OC(F)F)cc1 ZINC000431894708 1022943631 /nfs/dbraw/zinc/94/36/31/1022943631.db2.gz SUSSXCNWAMQFNO-SECBINFHSA-N -1 3 341.741 4.138 20 0 EIADHM CCc1cccc(C)c1NC(=O)c1c[n-]c2c(C)cc(F)cc2c1=O ZINC000340960493 1023013867 /nfs/dbraw/zinc/01/38/67/1023013867.db2.gz YPHWMDMPKBIDNO-UHFFFAOYSA-N -1 3 338.382 4.099 20 0 EIADHM O=C([N-]OCc1ccc(F)cc1)Nc1ncc(-c2ccccc2)s1 ZINC000185300241 1023030557 /nfs/dbraw/zinc/03/05/57/1023030557.db2.gz WZHSFMOMECGENW-UHFFFAOYSA-N -1 3 343.383 4.203 20 0 EIADHM Cc1c2cccc(F)c2oc1C(=O)[N-]c1nnc(C(F)(F)F)s1 ZINC000031564943 1023127334 /nfs/dbraw/zinc/12/73/34/1023127334.db2.gz YLSUKFOSVLPAMO-UHFFFAOYSA-N -1 3 345.277 4.003 20 0 EIADHM CS[C@@H]1CCCCN([C@H](C(=O)[O-])c2ccc(Cl)cc2Cl)C1 ZINC000584637768 1023138834 /nfs/dbraw/zinc/13/88/34/1023138834.db2.gz BUZFEGLIFGBYFW-RISCZKNCSA-N -1 3 348.295 4.337 20 0 EIADHM O=C([N-]c1nnc(Cc2ccccc2)s1)c1ccc(Cl)s1 ZINC000021564351 1023215180 /nfs/dbraw/zinc/21/51/80/1023215180.db2.gz HXMULDJUKALXFG-UHFFFAOYSA-N -1 3 335.841 4.096 20 0 EIADHM CCOc1ccc(CN[C@@H](CC(=O)[O-])c2cccc(Cl)c2)c(C)c1 ZINC000656565085 1023226242 /nfs/dbraw/zinc/22/62/42/1023226242.db2.gz CXTVIDCLKUFNRE-SFHVURJKSA-N -1 3 347.842 4.353 20 0 EIADHM CCc1cccc2cc(CN[C@H]3C[C@@H](C(=O)[O-])c4ccccc43)oc21 ZINC000656566366 1023226528 /nfs/dbraw/zinc/22/65/28/1023226528.db2.gz IZYKMRJFDPXQPK-MOPGFXCFSA-N -1 3 335.403 4.398 20 0 EIADHM O=C(COc1ccccc1-c1ccccc1)Nc1cc(F)ccc1[O-] ZINC000536221854 1023256461 /nfs/dbraw/zinc/25/64/61/1023256461.db2.gz WQSKMJRSGWUSBY-UHFFFAOYSA-N -1 3 337.350 4.216 20 0 EIADHM O=C([O-])c1ccc2c(c1)CN(CC1CCC(C(F)(F)F)CC1)C2 ZINC000659790759 1023270205 /nfs/dbraw/zinc/27/02/05/1023270205.db2.gz MLXODWAMUQPNAG-UHFFFAOYSA-N -1 3 327.346 4.069 20 0 EIADHM C[C@H]1CCN(CCSc2cc(Cl)ccc2Cl)C[C@@H]1C(=O)[O-] ZINC000584779977 1023310822 /nfs/dbraw/zinc/31/08/22/1023310822.db2.gz ZISHGQYQBOTYBS-JQWIXIFHSA-N -1 3 348.295 4.128 20 0 EIADHM O=C([O-])C[C@H](NCc1cc(F)cc(C(F)(F)F)c1)c1cccs1 ZINC000322751032 1023316582 /nfs/dbraw/zinc/31/65/82/1023316582.db2.gz XGXYNPHQSSVYJN-LBPRGKRZSA-N -1 3 347.333 4.212 20 0 EIADHM COc1ccc([C@@H](CCC(=O)[O-])NCc2sccc2Cl)cc1 ZINC000417582276 1023364506 /nfs/dbraw/zinc/36/45/06/1023364506.db2.gz VAYOFTYIEXOFQH-CQSZACIVSA-N -1 3 339.844 4.106 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)N1CCC[C@@H]1c1cccs1 ZINC000468557311 1023383386 /nfs/dbraw/zinc/38/33/86/1023383386.db2.gz YNQCBYWQJYNLST-OAHLLOKOSA-N -1 3 333.428 4.279 20 0 EIADHM CC[C@H](C)C[C@@H](C)NC(=O)Nc1ccc(-c2cc(=O)[n-]c(C)n2)cc1 ZINC000341238629 1023425032 /nfs/dbraw/zinc/42/50/32/1023425032.db2.gz AROPHYLVZVVLFH-QWHCGFSZSA-N -1 3 342.443 4.104 20 0 EIADHM O=C([O-])[C@H](c1cccc(Cl)c1Cl)N1CCC[C@H](CCF)C1 ZINC000656764665 1023505736 /nfs/dbraw/zinc/50/57/36/1023505736.db2.gz ZYJUMLLCBUDPIX-YGRLFVJLSA-N -1 3 334.218 4.191 20 0 EIADHM O=C([O-])[C@@H]1CCN(Cc2ccc(Cl)c(Cl)c2)[C@@H]2CCCC[C@@H]12 ZINC000656764927 1023509933 /nfs/dbraw/zinc/50/99/33/1023509933.db2.gz LRTODGJOYWRETO-WOSRLPQWSA-N -1 3 342.266 4.459 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N3CCC[C@@H](C(C)(C)C)C3)nc2)n1 ZINC000581701471 1023622697 /nfs/dbraw/zinc/62/26/97/1023622697.db2.gz XMIHBCOZDYPFJX-OAHLLOKOSA-N -1 3 340.471 4.069 20 0 EIADHM Cc1ccc([O-])c(C(=O)Nc2cccc(NC(=O)c3ccccc3)c2)c1 ZINC000500314674 1023691439 /nfs/dbraw/zinc/69/14/39/1023691439.db2.gz LAYAPGFCKBXBGK-UHFFFAOYSA-N -1 3 346.386 4.205 20 0 EIADHM CC(C)(C)c1ncsc1C(=O)[N-]c1nc(-c2ccccc2)ns1 ZINC000080066403 1023705193 /nfs/dbraw/zinc/70/51/93/1023705193.db2.gz CEMLYHATVFPLML-UHFFFAOYSA-N -1 3 344.465 4.211 20 0 EIADHM C[C@H](Oc1ccccc1Cl)C(=O)Nc1cc(Cl)ccc1[O-] ZINC000588925603 1023896553 /nfs/dbraw/zinc/89/65/53/1023896553.db2.gz HYNNHDGTZRIYBY-VIFPVBQESA-N -1 3 326.179 4.105 20 0 EIADHM CSc1ccccc1[N-]C(=O)c1cc(-c2ccccc2F)on1 ZINC000047586805 1023984704 /nfs/dbraw/zinc/98/47/04/1023984704.db2.gz PBQAXTMGXBQQAJ-UHFFFAOYSA-N -1 3 328.368 4.455 20 0 EIADHM O=c1nc(CN2C[C@@H]3CCCC[C@@H]32)[n-]c2scc(-c3ccco3)c21 ZINC000660929695 1024125215 /nfs/dbraw/zinc/12/52/15/1024125215.db2.gz DWFNCGLRTCHGJZ-AAEUAGOBSA-N -1 3 341.436 4.031 20 0 EIADHM O=C(Nc1nc(-c2ccccc2)cs1)c1cc([O-])ccc1Cl ZINC000430893658 1024192506 /nfs/dbraw/zinc/19/25/06/1024192506.db2.gz JXIIBOIMEPVCRY-UHFFFAOYSA-N -1 3 330.796 4.421 20 0 EIADHM Cc1ccc(-c2nc(=O)c3c(-c4ccc(F)cc4)csc3[n-]2)o1 ZINC000047681852 1024338612 /nfs/dbraw/zinc/33/86/12/1024338612.db2.gz WQFVMPSYVQPXOP-UHFFFAOYSA-N -1 3 326.352 4.359 20 0 EIADHM O=C(Nc1cccc([O-])c1F)c1c2c(sc1-n1cccc1)CCC2 ZINC000535657276 1024365549 /nfs/dbraw/zinc/36/55/49/1024365549.db2.gz CKMMMUXXTXTEBI-UHFFFAOYSA-N -1 3 342.395 4.125 20 0 EIADHM C[C@H]1CO[C@H](c2ccccc2Cl)CN1Cc1cc([O-])cc(F)c1 ZINC000473142205 1024456356 /nfs/dbraw/zinc/45/63/56/1024456356.db2.gz PSQLKEQAGVBEHU-SGTLLEGYSA-N -1 3 335.806 4.147 20 0 EIADHM Fc1c(Cl)ccc(-c2noc(-c3cc(Cl)n[n-]3)n2)c1Cl ZINC001213498357 1033220658 /nfs/dbraw/zinc/22/06/58/1033220658.db2.gz KAAMGWWXWCHHHI-UHFFFAOYSA-N -1 3 333.537 4.226 20 0 EIADHM Cc1cc(-c2nc3ccc(F)cc3c(=O)[n-]2)cc(C)c1Br ZINC000548462296 1024763313 /nfs/dbraw/zinc/76/33/13/1024763313.db2.gz HJHUOPIJBVNEBQ-UHFFFAOYSA-N -1 3 347.187 4.109 20 0 EIADHM CC(C)C[C@H]1CCCCN1Cc1coc(-c2ccc(C(=O)[O-])cc2)n1 ZINC000652425684 1024826010 /nfs/dbraw/zinc/82/60/10/1024826010.db2.gz HALMNAVTJYQVLZ-GOSISDBHSA-N -1 3 342.439 4.440 20 0 EIADHM O=C([O-])[C@@H]1CN(CCCc2cccc3ccccc32)Cc2ccccc21 ZINC000652470992 1024846934 /nfs/dbraw/zinc/84/69/34/1024846934.db2.gz PNBHNMFYFLPXRA-JOCHJYFZSA-N -1 3 345.442 4.456 20 0 EIADHM [O-]c1c(Cl)cc(Cl)cc1/C=N/[C@@H]1CCN(Cc2ccccc2)C1 ZINC000022768597 1024933649 /nfs/dbraw/zinc/93/36/49/1024933649.db2.gz PWENJJIROCZNFV-PPAWOMOGSA-N -1 3 349.261 4.392 20 0 EIADHM CCc1onc(C)c1[N-]C(=O)c1csc(-c2ccc(F)c(F)c2)n1 ZINC000181266443 1025138421 /nfs/dbraw/zinc/13/84/21/1025138421.db2.gz VFHAAIGKUNTPEG-UHFFFAOYSA-N -1 3 349.362 4.199 20 0 EIADHM O=C([N-]CC1CC(F)(F)C1)C(F)(F)c1cccc(Cl)c1Cl ZINC000843596966 1025360604 /nfs/dbraw/zinc/36/06/04/1025360604.db2.gz GIWGCIXXCDTKRV-UHFFFAOYSA-N -1 3 344.135 4.247 20 0 EIADHM Cc1ccc(Cl)c(NC(=O)c2c[n-]c3c(C)cc(F)cc3c2=O)c1 ZINC000342225606 1025495811 /nfs/dbraw/zinc/49/58/11/1025495811.db2.gz IOZAESRLAQTXGP-UHFFFAOYSA-N -1 3 344.773 4.190 20 0 EIADHM CCc1cc(=O)[n-]c(CN[C@H](CC2CCCC2)c2ccccc2)n1 ZINC000342227467 1025501377 /nfs/dbraw/zinc/50/13/77/1025501377.db2.gz RCRFEVSVBMXLQA-GOSISDBHSA-N -1 3 325.456 4.156 20 0 EIADHM CC(C)COc1ccc(CC(=O)Nc2cc(Cl)ccc2[O-])cc1 ZINC000303282424 1025504416 /nfs/dbraw/zinc/50/44/16/1025504416.db2.gz IYXMRXJBBNPPIM-UHFFFAOYSA-N -1 3 333.815 4.262 20 0 EIADHM O=c1[n-]c(CSc2ccccc2F)nc2c3ccccc3oc21 ZINC000006996382 1025807995 /nfs/dbraw/zinc/80/79/95/1025807995.db2.gz SJQJSTFETIQDOX-UHFFFAOYSA-N -1 3 326.352 4.101 20 0 EIADHM CCc1ccc([O-])c(C(=O)Nc2cccc(COCC3CC3)c2)c1 ZINC000111100214 1026081187 /nfs/dbraw/zinc/08/11/87/1026081187.db2.gz JZLUYWAGAOLMNQ-UHFFFAOYSA-N -1 3 325.408 4.134 20 0 EIADHM CSc1ccc([O-])c(C(=O)N[C@]2(c3ccccc3)CC2(C)C)c1 ZINC001167972993 1026154128 /nfs/dbraw/zinc/15/41/28/1026154128.db2.gz OTSFMPGTYFHMKV-IBGZPJMESA-N -1 3 327.449 4.169 20 0 EIADHM CC[C@@]1(C)CCN(Cc2nc(=O)c3c(-c4ccco4)csc3[n-]2)C1 ZINC000344247188 1026176767 /nfs/dbraw/zinc/17/67/67/1026176767.db2.gz REYNSLVKULGUGC-SFHVURJKSA-N -1 3 343.452 4.279 20 0 EIADHM C[C@H](c1ccc2ccccc2c1)N(C)Cc1nc(=O)c2sccc2[n-]1 ZINC000053643059 1026206863 /nfs/dbraw/zinc/20/68/63/1026206863.db2.gz LKXIGCNJMVGRQD-CYBMUJFWSA-N -1 3 349.459 4.331 20 0 EIADHM C[C@@H](NCc1ccc([O-])c(F)c1)c1ccc(C(F)(F)F)nc1Cl ZINC000894612618 1026258856 /nfs/dbraw/zinc/25/88/56/1026258856.db2.gz KLOFBDQNTBFQLF-MRVPVSSYSA-N -1 3 348.727 4.449 20 0 EIADHM O=C(Nc1n[n-]c(-c2ccccn2)n1)c1ccc(C2CCCCC2)cc1 ZINC000059007701 1026322569 /nfs/dbraw/zinc/32/25/69/1026322569.db2.gz QLBJYVNBVZVQNR-UHFFFAOYSA-N -1 3 347.422 4.167 20 0 EIADHM O=C(c1cc([O-])ccc1Cl)N1CCC(Cc2ccccc2)CC1 ZINC000391127215 1026327571 /nfs/dbraw/zinc/32/75/71/1026327571.db2.gz ORERLBSXGWYGGT-UHFFFAOYSA-N -1 3 329.827 4.141 20 0 EIADHM CC(C)Cc1ccc([C@@H]([N-]C(=O)C(F)(F)C(F)F)C2CC2)cc1 ZINC001125588933 1026381559 /nfs/dbraw/zinc/38/15/59/1026381559.db2.gz JYBRVJYHRMHTBX-CQSZACIVSA-N -1 3 331.353 4.353 20 0 EIADHM Cc1cc2[nH]c(CN[C@@H](CC(=O)[O-])c3ccsc3)cc2c(C)c1 ZINC000426683394 1026473242 /nfs/dbraw/zinc/47/32/42/1026473242.db2.gz RONPFXFBWNGUPR-INIZCTEOSA-N -1 3 328.437 4.152 20 0 EIADHM C[C@H](CCC[C@@H](C)C(=O)[O-])NCc1ncc(-c2ccccc2)s1 ZINC000426685065 1026474440 /nfs/dbraw/zinc/47/44/40/1026474440.db2.gz FSVGFJKYAQCEPG-ZIAGYGMSSA-N -1 3 332.469 4.179 20 0 EIADHM COc1ccc2cc(CN[C@H](CC(=O)[O-])c3ccsc3)ccc2c1 ZINC000426696469 1026480827 /nfs/dbraw/zinc/48/08/27/1026480827.db2.gz RUOJQYBGRYZEHY-GOSISDBHSA-N -1 3 341.432 4.216 20 0 EIADHM COc1ccccc1-c1ccc(CNCc2ccc(C(=O)[O-])cc2)cc1 ZINC000426696209 1026484051 /nfs/dbraw/zinc/48/40/51/1026484051.db2.gz QXYDHXRXWGTEJD-UHFFFAOYSA-N -1 3 347.414 4.350 20 0 EIADHM Cc1ccc([C@@H](NCc2cc(F)cc(C(F)(F)F)c2)C(=O)[O-])cc1 ZINC000426715562 1026496036 /nfs/dbraw/zinc/49/60/36/1026496036.db2.gz RSVWCXGFERSMLK-OAHLLOKOSA-N -1 3 341.304 4.068 20 0 EIADHM Cc1cc(=O)[n-]c([C@H](C)N2CCC([C@H](F)c3ccccc3F)CC2)n1 ZINC000511105550 1026512792 /nfs/dbraw/zinc/51/27/92/1026512792.db2.gz JDKHQUQGEAGAOC-UGSOOPFHSA-N -1 3 347.409 4.114 20 0 EIADHM O=C([O-])C[C@@H](NCc1cccc(F)c1)c1cc(Cl)cc(Cl)c1 ZINC000426750573 1026536363 /nfs/dbraw/zinc/53/63/63/1026536363.db2.gz OHYUKKPFGAUTEJ-OAHLLOKOSA-N -1 3 342.197 4.438 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)N[C@@H]1CCSc2ccccc21 ZINC000344704165 1026548206 /nfs/dbraw/zinc/54/82/06/1026548206.db2.gz LZDNFSDQLWQKAJ-MRXNPFEDSA-N -1 3 345.439 4.207 20 0 EIADHM O=C([O-])[C@H](NCc1cc(Cl)cc(C(F)(F)F)c1)c1cccs1 ZINC000426787556 1026562755 /nfs/dbraw/zinc/56/27/55/1026562755.db2.gz FUZBKRPCWGIBMV-GFCCVEGCSA-N -1 3 349.761 4.336 20 0 EIADHM O=C(N[C@@H](c1ccc(F)cc1)C(F)(F)F)c1cc([O-])ccc1Cl ZINC000506978188 1026571158 /nfs/dbraw/zinc/57/11/58/1026571158.db2.gz BAKFYRXZNCJURP-ZDUSSCGKSA-N -1 3 347.695 4.218 20 0 EIADHM O=C([O-])C[C@H](NCc1cc2c(cccc2F)[nH]1)c1cccc(Cl)c1 ZINC000426802850 1026571500 /nfs/dbraw/zinc/57/15/00/1026571500.db2.gz YESCXNQBGHFNIA-KRWDZBQOSA-N -1 3 346.789 4.266 20 0 EIADHM CCOc1ccc(CN[C@@H](CC(=O)[O-])c2cccc(Cl)c2)cc1 ZINC000426808896 1026572838 /nfs/dbraw/zinc/57/28/38/1026572838.db2.gz SZIVVCXLDSJVHX-KRWDZBQOSA-N -1 3 333.815 4.044 20 0 EIADHM CC(C)c1ccc([C@@H](CC(=O)[O-])NCc2ccc(F)c(F)c2)cc1 ZINC000426813993 1026575916 /nfs/dbraw/zinc/57/59/16/1026575916.db2.gz BKFXCEGCSWFMKL-GOSISDBHSA-N -1 3 333.378 4.394 20 0 EIADHM CCc1ccc([C@@H](NCc2cccc(C(F)(F)F)c2)C(=O)[O-])cc1 ZINC000426818640 1026576757 /nfs/dbraw/zinc/57/67/57/1026576757.db2.gz SIMJVSIGCIIOIQ-MRXNPFEDSA-N -1 3 337.341 4.183 20 0 EIADHM COc1c(Br)cc(F)cc1Nc1ncc(Cl)cc1[O-] ZINC001211708281 1026619188 /nfs/dbraw/zinc/61/91/88/1026619188.db2.gz PAWOEYRUANTLNB-UHFFFAOYSA-N -1 3 347.571 4.094 20 0 EIADHM CCC(CC)N(CC)C(=O)Nc1ccc(-c2cc(=O)[n-]c(C)n2)cc1 ZINC000342624058 1026757191 /nfs/dbraw/zinc/75/71/91/1026757191.db2.gz WUSSCUWCGJWVKL-UHFFFAOYSA-N -1 3 342.443 4.200 20 0 EIADHM CCOCCN(CC[C@@H]1CCC[C@H](C)C1)Cc1ccc(C(=O)[O-])o1 ZINC000519605037 1026790002 /nfs/dbraw/zinc/79/00/02/1026790002.db2.gz KZTSSUMIIJXHLJ-HOTGVXAUSA-N -1 3 337.460 4.033 20 0 EIADHM COc1ccccc1CSc1ccccc1[N-]C(=O)c1cocn1 ZINC000125709344 1026937912 /nfs/dbraw/zinc/93/79/12/1026937912.db2.gz XALQQXJABKWDEO-UHFFFAOYSA-N -1 3 340.404 4.228 20 0 EIADHM Cc1cccc(OC(F)F)c1NC(=O)c1cc([O-])ccc1Cl ZINC000519820620 1027013023 /nfs/dbraw/zinc/01/30/23/1027013023.db2.gz ABZRXXHDAZQWOW-UHFFFAOYSA-N -1 3 327.714 4.208 20 0 EIADHM CC(C)(CC(=O)Nc1ccc(Br)cc1[O-])c1ccccc1 ZINC000520057371 1027153368 /nfs/dbraw/zinc/15/33/68/1027153368.db2.gz QIMXPMNDIJVZHM-UHFFFAOYSA-N -1 3 348.240 4.461 20 0 EIADHM O=C(Cc1c(F)cccc1Cl)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000440982900 1027159940 /nfs/dbraw/zinc/15/99/40/1027159940.db2.gz QFLIFYIAFGASDA-UHFFFAOYSA-N -1 3 347.695 4.385 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1ncoc1-c1ccc(F)cc1 ZINC000474533703 1027190377 /nfs/dbraw/zinc/19/03/77/1027190377.db2.gz LFKPETOZLXXHCB-UHFFFAOYSA-N -1 3 332.718 4.092 20 0 EIADHM Cc1ccc(O[C@H](C)C(=O)Nc2ccc([O-])c(C(F)(F)F)c2)cc1 ZINC000441015459 1027190729 /nfs/dbraw/zinc/19/07/29/1027190729.db2.gz YVESNQQGFVPKBX-LLVKDONJSA-N -1 3 339.313 4.125 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N3CCC(C)(C(C)C)CC3)nc2)n1 ZINC000302487771 1027319362 /nfs/dbraw/zinc/31/93/62/1027319362.db2.gz YUVUABJWWKIDNE-UHFFFAOYSA-N -1 3 340.471 4.069 20 0 EIADHM COc1cccc(-c2noc([N-]Cc3coc(-c4ccccc4)n3)n2)c1 ZINC000078341123 1027328919 /nfs/dbraw/zinc/32/89/19/1027328919.db2.gz YOPWMOHMFOJHTC-UHFFFAOYSA-N -1 3 348.362 4.012 20 0 EIADHM CCN(Cc1csc(-c2ccc(C(=O)[O-])cc2)n1)C1CCCC1 ZINC000566359060 1027364124 /nfs/dbraw/zinc/36/41/24/1027364124.db2.gz PLNYEVQIVJHWSX-UHFFFAOYSA-N -1 3 330.453 4.273 20 0 EIADHM [O-]c1c(F)cc(Nc2cnc(Br)c(Cl)c2)cc1F ZINC001213374986 1027499038 /nfs/dbraw/zinc/49/90/38/1027499038.db2.gz JJZLMARKFADAOZ-UHFFFAOYSA-N -1 3 335.535 4.225 20 0 EIADHM O=C([O-])c1cccc(-c2nc(CN(C3CC3)C3CCCC3)cs2)c1 ZINC000579251067 1027525781 /nfs/dbraw/zinc/52/57/81/1027525781.db2.gz XIUSFVOQEBVBFT-UHFFFAOYSA-N -1 3 342.464 4.415 20 0 EIADHM C[C@@H](CC(=O)[N-]OCc1ccccc1)c1ccccc1C(F)(F)F ZINC000303833599 1027674664 /nfs/dbraw/zinc/67/46/64/1027674664.db2.gz BVFOSWNRYZWXMZ-ZDUSSCGKSA-N -1 3 337.341 4.447 20 0 EIADHM CSc1ccccc1S(=O)(=O)[N-]c1cc(F)c(F)cc1Cl ZINC000188462122 1027838754 /nfs/dbraw/zinc/83/87/54/1027838754.db2.gz MJZBXCJBHRSENM-UHFFFAOYSA-N -1 3 349.811 4.141 20 0 EIADHM CC(C)c1ccc(S(=O)(=O)[N-]c2ccc3c(c2)OC(C)(C)O3)cc1 ZINC000614806843 1027843609 /nfs/dbraw/zinc/84/36/09/1027843609.db2.gz FJYISBJBKYBDCX-UHFFFAOYSA-N -1 3 347.436 4.118 20 0 EIADHM CC(C)n1c2ccccc2nc1[C@@H]1CCCN1CC1(CC(=O)[O-])CC1 ZINC000583089211 1027979147 /nfs/dbraw/zinc/97/91/47/1027979147.db2.gz ATRZCCCWBMLYHP-KRWDZBQOSA-N -1 3 341.455 4.009 20 0 EIADHM O=S(=O)([N-][C@@H](c1ccccc1)c1cccc(Cl)c1)c1ccco1 ZINC000188612140 1028011378 /nfs/dbraw/zinc/01/13/78/1028011378.db2.gz MCKBCLHKUUUIEG-KRWDZBQOSA-N -1 3 347.823 4.001 20 0 EIADHM Cc1cc(F)ccc1[C@H]1CCCN1C(=O)NCc1ccc([O-])c(F)c1 ZINC000458428125 1028249338 /nfs/dbraw/zinc/24/93/38/1028249338.db2.gz VBNSSYYMWQNSCS-QGZVFWFLSA-N -1 3 346.377 4.026 20 0 EIADHM Cc1cc(C)cc(-c2nnc([N-]C(=O)c3cc(F)ccc3F)s2)c1 ZINC000523709474 1028319611 /nfs/dbraw/zinc/31/96/11/1028319611.db2.gz VTPJNQBFCDTXOB-UHFFFAOYSA-N -1 3 345.374 4.352 20 0 EIADHM Cc1oc(CN(C)CCn2ccc3cc(Cl)ccc32)cc1C(=O)[O-] ZINC000583327678 1028509936 /nfs/dbraw/zinc/50/99/36/1028509936.db2.gz YNBXFNBGCRLLFW-UHFFFAOYSA-N -1 3 346.814 4.026 20 0 EIADHM CC(C)c1ccc(-c2nc(Cc3ccc(F)c(F)c3)no2)c([O-])c1 ZINC000445441002 1028565788 /nfs/dbraw/zinc/56/57/88/1028565788.db2.gz BRIIZJCJLNKKSI-UHFFFAOYSA-N -1 3 330.334 4.435 20 0 EIADHM Cc1cccc(Nc2cc(F)c([O-])c(F)c2)c1N1CCCCC1=O ZINC001213386828 1028798994 /nfs/dbraw/zinc/79/89/94/1028798994.db2.gz XSPBRXMNFINKKO-UHFFFAOYSA-N -1 3 332.350 4.239 20 0 EIADHM CC[C@H](c1ccc(Br)cc1)N1CCC(C)(C(=O)[O-])CC1 ZINC000086776871 1029099841 /nfs/dbraw/zinc/09/98/41/1029099841.db2.gz NQTGZRVLBZVMDV-CQSZACIVSA-N -1 3 340.261 4.087 20 0 EIADHM CCSc1ccc(Cl)cc1[N-]C(=O)c1ccc(COC)o1 ZINC000104482043 1029320981 /nfs/dbraw/zinc/32/09/81/1029320981.db2.gz AUGXCCBWBQNWLV-UHFFFAOYSA-N -1 3 325.817 4.444 20 0 EIADHM Cc1cc(=O)[n-]c([C@H](C)N[C@H](C)c2cc(F)c(Cl)cc2Cl)n1 ZINC000192722524 1029367796 /nfs/dbraw/zinc/36/77/96/1029367796.db2.gz KEXBONLPGMTERJ-BDAKNGLRSA-N -1 3 344.217 4.348 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2ccc(OC(C)C)c(C)c2)cc1C ZINC000525021288 1029394126 /nfs/dbraw/zinc/39/41/26/1029394126.db2.gz XLYTZPUQDQTKMV-UHFFFAOYSA-N -1 3 333.453 4.200 20 0 EIADHM CC(C)(Cc1cccc(Cl)c1)C(=O)NCc1ccc([O-])c(F)c1 ZINC000427938683 1029457379 /nfs/dbraw/zinc/45/73/79/1029457379.db2.gz FCZMPTRHQLVOAU-UHFFFAOYSA-N -1 3 335.806 4.070 20 0 EIADHM O=C(c1ccc(O)cc1[O-])N(Cc1cccs1)Cc1cccs1 ZINC000192924577 1029646880 /nfs/dbraw/zinc/64/68/80/1029646880.db2.gz DYTNROBSHDWGQB-UHFFFAOYSA-N -1 3 345.445 4.063 20 0 EIADHM Cc1ccc(NC(=O)C(C)(C)C)cc1NCc1ccc([O-])c(F)c1 ZINC000892372650 1029658319 /nfs/dbraw/zinc/65/83/19/1029658319.db2.gz JIKAFBYVXOYVAS-UHFFFAOYSA-N -1 3 330.403 4.436 20 0 EIADHM CCCOc1cc(C)ccc1CNC(=O)c1cc([O-])ccc1Cl ZINC000584247183 1029695138 /nfs/dbraw/zinc/69/51/38/1029695138.db2.gz GHYCVMNQGQHMPY-UHFFFAOYSA-N -1 3 333.815 4.073 20 0 EIADHM CSc1ccccc1[N-]C(=O)c1c(C)onc1-c1ccccn1 ZINC000159335840 1029696908 /nfs/dbraw/zinc/69/69/08/1029696908.db2.gz QPDIRKAIKSDFGB-UHFFFAOYSA-N -1 3 325.393 4.019 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N3CCC[C@@H](C(C)C)CC3)nc2)n1 ZINC000301280400 1029699701 /nfs/dbraw/zinc/69/97/01/1029699701.db2.gz JUZRLAJKZHYICW-OAHLLOKOSA-N -1 3 340.471 4.069 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(NC3CCC(C(C)C)CC3)nc2)n1 ZINC000301661123 1029783048 /nfs/dbraw/zinc/78/30/48/1029783048.db2.gz JWVBILOJKPYCNL-UHFFFAOYSA-N -1 3 340.471 4.433 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(NCC3(CC)CCCC3)nc2)n1 ZINC000301655453 1029783141 /nfs/dbraw/zinc/78/31/41/1029783141.db2.gz KYNMXORWSAGABV-UHFFFAOYSA-N -1 3 326.444 4.189 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(NCCc3c(C)cccc3C)nc2)n1 ZINC000301705289 1029792891 /nfs/dbraw/zinc/79/28/91/1029792891.db2.gz IAECLIQYYIAWRK-UHFFFAOYSA-N -1 3 348.450 4.078 20 0 EIADHM CCS[C@@H]1CCCCN(Cc2cc(C(=O)[O-])ccc2Cl)C1 ZINC000584415953 1029837011 /nfs/dbraw/zinc/83/70/11/1029837011.db2.gz FLVROPQGDWSFHC-CQSZACIVSA-N -1 3 327.877 4.146 20 0 EIADHM CSc1ccc(O[C@@H](C)C(=O)Nc2c([O-])cccc2Cl)cc1 ZINC000584426960 1029849318 /nfs/dbraw/zinc/84/93/18/1029849318.db2.gz ADWWFKIVFDGDDI-JTQLQIEISA-N -1 3 337.828 4.174 20 0 EIADHM Cc1nscc1C(=O)[N-]c1cc(F)ccc1SCC(F)F ZINC000182040580 1029933075 /nfs/dbraw/zinc/93/30/75/1029933075.db2.gz KBOVGMOVZZLSSR-UHFFFAOYSA-N -1 3 332.372 4.200 20 0 EIADHM CC(C)c1nc(C(=O)[N-]c2nc(-c3cccs3)ns2)cs1 ZINC000182122586 1029947247 /nfs/dbraw/zinc/94/72/47/1029947247.db2.gz QCUGZZCEBLNWSI-UHFFFAOYSA-N -1 3 336.467 4.099 20 0 EIADHM Cc1cccnc1CSc1nnc([N-]c2ccccc2F)s1 ZINC000092850108 1029947798 /nfs/dbraw/zinc/94/77/98/1029947798.db2.gz GZAVTYZQJGXKRY-UHFFFAOYSA-N -1 3 332.429 4.417 20 0 EIADHM CCc1cccc(C(=O)Nc2c(C)nn(-c3ccccc3)c2C)c1[O-] ZINC000093909806 1030000287 /nfs/dbraw/zinc/00/02/87/1030000287.db2.gz ZUKIGGRXNYTMLR-UHFFFAOYSA-N -1 3 335.407 4.009 20 0 EIADHM C[C@@H]1CC[C@H](C(=O)[O-])CN1CCSc1cc(Cl)ccc1Cl ZINC000396993442 1030193081 /nfs/dbraw/zinc/19/30/81/1030193081.db2.gz BIBNPWZKDGBBSH-MNOVXSKESA-N -1 3 348.295 4.271 20 0 EIADHM CCc1ccc(C(=O)N2CCC(F)(c3ccccc3)CC2)c([O-])c1 ZINC000447607617 1030227060 /nfs/dbraw/zinc/22/70/60/1030227060.db2.gz ALMXGSFMTWRFAY-UHFFFAOYSA-N -1 3 327.399 4.056 20 0 EIADHM C[C@H]1CC[C@@H](c2ccccc2)N(C(=O)Cc2ccc([O-])c(F)c2)C1 ZINC000451691724 1030660687 /nfs/dbraw/zinc/66/06/87/1030660687.db2.gz RTPNHDWSNGLKFF-KSSFIOAISA-N -1 3 327.399 4.074 20 0 EIADHM CC[C@H](C(=O)Nc1cc(Br)ccc1[O-])c1ccccc1 ZINC000530916575 1030806673 /nfs/dbraw/zinc/80/66/73/1030806673.db2.gz IMNFESGDDDUNOY-ZDUSSCGKSA-N -1 3 334.213 4.287 20 0 EIADHM CCc1cccc(C(=O)N2CCC(=Cc3cccc(F)c3)CC2)c1[O-] ZINC000530958275 1030814694 /nfs/dbraw/zinc/81/46/94/1030814694.db2.gz GHPWMUKSAUAXIM-UHFFFAOYSA-N -1 3 339.410 4.413 20 0 EIADHM O=C([O-])[C@H](NCc1ccc(SC(F)(F)F)cc1)c1ccccc1 ZINC000321459964 1030821040 /nfs/dbraw/zinc/82/10/40/1030821040.db2.gz OUQQKQONNJYVOE-CQSZACIVSA-N -1 3 341.354 4.214 20 0 EIADHM COc1ccc([O-])c(C(=O)Nc2ccc(CCC(F)(F)F)cc2)c1 ZINC000530996894 1030826938 /nfs/dbraw/zinc/82/69/38/1030826938.db2.gz NMGFDKREABKWAF-UHFFFAOYSA-N -1 3 339.313 4.148 20 0 EIADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)CCCC(C)C)c2)n1 ZINC000448722460 1030986668 /nfs/dbraw/zinc/98/66/68/1030986668.db2.gz CPGAQHHGFBHTQZ-UHFFFAOYSA-N -1 3 327.428 4.176 20 0 EIADHM CCCCN(C(=O)Cc1ccc([O-])c(F)c1)[C@H](C)c1ccc(C)o1 ZINC000648214364 1031048356 /nfs/dbraw/zinc/04/83/56/1031048356.db2.gz UTALPKVIGZCZFH-CQSZACIVSA-N -1 3 333.403 4.365 20 0 EIADHM CN(Cc1ccc(C(=O)[O-])cc1Br)CC1CCCCC1 ZINC000226722749 1031105030 /nfs/dbraw/zinc/10/50/30/1031105030.db2.gz NPGPYLBTAHHMSR-UHFFFAOYSA-N -1 3 340.261 4.159 20 0 EIADHM Cc1ccccc1-c1nc(C(=O)Nc2cc(F)ccc2[O-])cs1 ZINC000531373051 1031156424 /nfs/dbraw/zinc/15/64/24/1031156424.db2.gz DCSFHLNPBUIRLY-UHFFFAOYSA-N -1 3 328.368 4.216 20 0 EIADHM C[C@@H](Oc1cccc(Cl)c1Cl)C(=O)Nc1cc(F)ccc1[O-] ZINC000531373990 1031158749 /nfs/dbraw/zinc/15/87/49/1031158749.db2.gz TZOJMRAEXWKNRQ-MRVPVSSYSA-N -1 3 344.169 4.244 20 0 EIADHM O=C(Nc1ccc(Br)cc1[O-])C1(Cc2ccccc2)CC1 ZINC000531458580 1031270308 /nfs/dbraw/zinc/27/03/08/1031270308.db2.gz BDQTUJKHWPCMLA-UHFFFAOYSA-N -1 3 346.224 4.116 20 0 EIADHM O=[S@](Cc1ncc(-c2ccc(Cl)cc2)o1)c1ccc([O-])cc1 ZINC000108085407 1031287454 /nfs/dbraw/zinc/28/74/54/1031287454.db2.gz SKJQXIXLLIYXAJ-QFIPXVFZSA-N -1 3 333.796 4.008 20 0 EIADHM O=C([N-]c1nc(-c2ccsc2)ns1)c1ccc(Cl)s1 ZINC000109111327 1031296213 /nfs/dbraw/zinc/29/62/13/1031296213.db2.gz PAYSFAHKAZDWNW-UHFFFAOYSA-N -1 3 327.843 4.234 20 0 EIADHM Cc1c(Br)ccc([O-])c1NC(=O)[C@@H]1CCCC(F)(F)C1 ZINC000452760845 1031314146 /nfs/dbraw/zinc/31/41/46/1031314146.db2.gz WPGXNQNOLFGLNY-SECBINFHSA-N -1 3 348.187 4.227 20 0 EIADHM CCCc1cc(=O)[n-]c(C(=Cc2cnc(N(CC)CC)s2)CC)n1 ZINC000453023861 1031499699 /nfs/dbraw/zinc/49/96/99/1031499699.db2.gz IMQNVPRNZFOJRX-RAXLEYEMSA-N -1 3 346.500 4.388 20 0 EIADHM O=C(N[C@@H](c1ccccc1)[C@H]1CCOC1)c1cc([O-])c2ccccc2c1 ZINC000375921200 1031517018 /nfs/dbraw/zinc/51/70/18/1031517018.db2.gz QLAGJSVUQNLYQB-UWJYYQICSA-N -1 3 347.414 4.053 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N1CC[C@@H](c2ccccc2F)C1 ZINC000502114485 1031684324 /nfs/dbraw/zinc/68/43/24/1031684324.db2.gz DTYOQTLLHDRXJF-OAHLLOKOSA-N -1 3 335.378 4.314 20 0 EIADHM O=C([N-]c1ccccc1SC(F)(F)F)c1cnc(C2CC2)o1 ZINC000888218603 1031850882 /nfs/dbraw/zinc/85/08/82/1031850882.db2.gz DBDCRFSIZXHROJ-UHFFFAOYSA-N -1 3 328.315 4.416 20 0 EIADHM CC[C@@H](NC(=O)c1c[n-]c2ccccc2c1=O)c1cccc(Cl)c1 ZINC000053799213 1032038682 /nfs/dbraw/zinc/03/86/82/1032038682.db2.gz IBJCIEIABVOOFK-MRXNPFEDSA-N -1 3 340.810 4.063 20 0 EIADHM [O-]c1cccc(CN2CCC[C@@]3(C2)OCc2ccccc23)c1Cl ZINC000512683365 1033701800 /nfs/dbraw/zinc/70/18/00/1033701800.db2.gz QTORPBFUZZAVGP-IBGZPJMESA-N -1 3 329.827 4.067 20 0 EIADHM CCCN(CCC)C(=O)c1ccc([N-]c2noc(C(C)(C)C)n2)cc1 ZINC001211760459 1033846538 /nfs/dbraw/zinc/84/65/38/1033846538.db2.gz FYJBXOYLIWJQBN-UHFFFAOYSA-N -1 3 344.459 4.373 20 0 EIADHM Cc1ccccc1[C@@]1(F)CCN(C(=O)c2cc([O-])ccc2Cl)C1 ZINC000512873619 1034110529 /nfs/dbraw/zinc/11/05/29/1034110529.db2.gz CDGKOFJRWZKWPJ-GOSISDBHSA-N -1 3 333.790 4.065 20 0 EIADHM CSc1ccc([O-])c(C(=O)N2CC[C@@](C)(c3ccc(F)cc3)C2)c1 ZINC000614349125 1034382372 /nfs/dbraw/zinc/38/23/72/1034382372.db2.gz RHCMSJSIKZRVOG-LJQANCHMSA-N -1 3 345.439 4.057 20 0 EIADHM C[C@H](c1ccc(OC(F)F)cc1)N1Cc2ccccc2[C@@H](C(=O)[O-])C1 ZINC000327504945 1034645102 /nfs/dbraw/zinc/64/51/02/1034645102.db2.gz LKLBYOYZABGDSD-PXAZEXFGSA-N -1 3 347.361 4.033 20 0 EIADHM C[C@@H](c1ccc(OC(F)F)cc1)N1Cc2ccccc2[C@H](C(=O)[O-])C1 ZINC000327504958 1034649001 /nfs/dbraw/zinc/64/90/01/1034649001.db2.gz LKLBYOYZABGDSD-YVEFUNNKSA-N -1 3 347.361 4.033 20 0 EIADHM Cc1ccc2oc(C(=O)[N-]c3nnc(C4CCCCC4)s3)cc2n1 ZINC000729172761 1034740933 /nfs/dbraw/zinc/74/09/33/1034740933.db2.gz XPCZKRSDGZBXDB-UHFFFAOYSA-N -1 3 342.424 4.288 20 0 EIADHM CC(C)(CNC(=O)c1cc([O-])ccc1Cl)c1ccccc1Cl ZINC000559532780 1035027887 /nfs/dbraw/zinc/02/78/87/1035027887.db2.gz BJSCIDSHFZLRHT-UHFFFAOYSA-N -1 3 338.234 4.407 20 0 EIADHM CCC(CC)n1ccc(CSCc2cc(=O)[n-]c(C3CC3)n2)n1 ZINC000419447071 1035351980 /nfs/dbraw/zinc/35/19/80/1035351980.db2.gz OZDYUBAGRIXESL-UHFFFAOYSA-N -1 3 332.473 4.051 20 0 EIADHM CC(C)c1cc(C(=O)[N-]c2ccc(C(=O)OC(C)(C)C)cc2F)on1 ZINC000490904854 1035709785 /nfs/dbraw/zinc/70/97/85/1035709785.db2.gz CAUQSYSZTYNCGH-UHFFFAOYSA-N -1 3 348.374 4.145 20 0 EIADHM O=c1nc([C@H]2CC2(Cl)Cl)[n-]c2sc(C(F)(F)F)cc21 ZINC000905031714 1035720249 /nfs/dbraw/zinc/72/02/49/1035720249.db2.gz MYTUQMSRIRLVGL-SCSAIBSYSA-N -1 3 329.130 4.077 20 0 EIADHM Cc1ccc(-c2nnc([N-]C(=O)c3ccoc3Cl)s2)c(C)c1 ZINC000434127102 1035774682 /nfs/dbraw/zinc/77/46/82/1035774682.db2.gz YHYJUMOXMDFGJV-UHFFFAOYSA-N -1 3 333.800 4.321 20 0 EIADHM Cc1ccc([O-])c(C(=O)Nc2cccc(NC(=O)OCC(C)C)c2)c1 ZINC000060046093 1035844341 /nfs/dbraw/zinc/84/43/41/1035844341.db2.gz SMHCHIFDMQAEPL-UHFFFAOYSA-N -1 3 342.395 4.157 20 0 EIADHM O=C([O-])c1ccc(CN[C@H](c2ccc(Cl)cc2)C2CCC2)nc1 ZINC000905724502 1035875620 /nfs/dbraw/zinc/87/56/20/1035875620.db2.gz KXPBZSZCWYBPRL-KRWDZBQOSA-N -1 3 330.815 4.064 20 0 EIADHM Cc1ccc(NC(=O)c2cccc(C)c2[O-])c(OCC(F)(F)F)c1 ZINC000195645584 1035875815 /nfs/dbraw/zinc/87/58/15/1035875815.db2.gz IMPLBYGVBMGGMQ-UHFFFAOYSA-N -1 3 339.313 4.202 20 0 EIADHM CCOCCOc1c(Cl)cccc1NC(=O)c1cc(C)ccc1[O-] ZINC000195728333 1035883153 /nfs/dbraw/zinc/88/31/53/1035883153.db2.gz PBNTWURUDPTGOS-UHFFFAOYSA-N -1 3 349.814 4.022 20 0 EIADHM O=S(=O)([N-]c1ccc(F)cc1F)c1ccccc1-c1ccccc1 ZINC000485772907 1036252594 /nfs/dbraw/zinc/25/25/94/1036252594.db2.gz NWXIZOROWILYFK-UHFFFAOYSA-N -1 3 345.370 4.433 20 0 EIADHM O=C([O-])[C@@H](c1ccccc1F)N1CC[C@H](C(F)(F)F)C2(CCC2)C1 ZINC000571811390 1036261932 /nfs/dbraw/zinc/26/19/32/1036261932.db2.gz UUHMQWPKSQKIOZ-UONOGXRCSA-N -1 3 345.336 4.006 20 0 EIADHM CCN(Cc1c[nH]c2ccccc12)[C@@H](C)c1cc(C(=O)[O-])c(C)o1 ZINC000572048996 1036403575 /nfs/dbraw/zinc/40/35/75/1036403575.db2.gz PWUJKAGJCYDVRS-LBPRGKRZSA-N -1 3 326.396 4.351 20 0 EIADHM CCn1c2ccc(C(=O)[O-])cc2nc1CN1CCC[C@H](C(C)C)CC1 ZINC000572008727 1036406353 /nfs/dbraw/zinc/40/63/53/1036406353.db2.gz YSSUXLZFQFNOJN-HNNXBMFYSA-N -1 3 343.471 4.013 20 0 EIADHM O=c1cc(C(F)(F)F)nc(CNc2csc3ccccc23)[n-]1 ZINC000486101966 1036474936 /nfs/dbraw/zinc/47/49/36/1036474936.db2.gz HIAIBGAWYAYKMB-UHFFFAOYSA-N -1 3 325.315 4.028 20 0 EIADHM CO[C@@H](C)c1cccc([N-]S(=O)(=O)c2c(C)c(C)cc(C)c2C)c1 ZINC000588833877 1036545211 /nfs/dbraw/zinc/54/52/11/1036545211.db2.gz VRFZXXFYRHXZJY-INIZCTEOSA-N -1 3 347.480 4.428 20 0 EIADHM CCSCC[C@@H](C)N(C)C(=O)c1cc([O-])cc(C(F)(F)F)c1 ZINC000598688196 1036748267 /nfs/dbraw/zinc/74/82/67/1036748267.db2.gz GPVRYRCEDNXABM-SNVBAGLBSA-N -1 3 335.391 4.015 20 0 EIADHM CCCCc1nc(C)c(CC(=O)Nc2c([O-])cccc2Cl)s1 ZINC000908413359 1036850594 /nfs/dbraw/zinc/85/05/94/1036850594.db2.gz JULJBRPTKKGCQF-UHFFFAOYSA-N -1 3 338.860 4.334 20 0 EIADHM Cc1cccc(Br)c1C(=O)Nc1cc(Cl)ccc1[O-] ZINC000486972237 1036911134 /nfs/dbraw/zinc/91/11/34/1036911134.db2.gz UDHKJUGIIWPZBG-UHFFFAOYSA-N -1 3 340.604 4.369 20 0 EIADHM O=C([N-]c1ncn(C2CCCCC2)n1)c1occc1-c1ccccc1 ZINC000273173654 1037370871 /nfs/dbraw/zinc/37/08/71/1037370871.db2.gz HYOXKWYRKUOJFM-UHFFFAOYSA-N -1 3 336.395 4.296 20 0 EIADHM O=c1cc(CSCc2cc(F)cc3cccnc32)nc(C2CC2)[n-]1 ZINC000591381013 1037404169 /nfs/dbraw/zinc/40/41/69/1037404169.db2.gz DLKRJMDWXRQBKG-UHFFFAOYSA-N -1 3 341.411 4.180 20 0 EIADHM CSc1ccc([O-])c(C(=O)N(CCc2ccc(F)cc2)C2CC2)c1 ZINC000668850710 1037561331 /nfs/dbraw/zinc/56/13/31/1037561331.db2.gz IKQHNLGEPPLGCD-UHFFFAOYSA-N -1 3 345.439 4.101 20 0 EIADHM CCSc1cccc(F)c1[N-]S(=O)(=O)c1ccc(C)cc1 ZINC000573533498 1037562783 /nfs/dbraw/zinc/56/27/83/1037562783.db2.gz NDPYMGJOGPIYMZ-UHFFFAOYSA-N -1 3 325.430 4.047 20 0 EIADHM CC(C)c1ccc(C(=O)N2CCCO[C@@H](c3ccccc3)C2)c([O-])c1 ZINC000591831716 1037609184 /nfs/dbraw/zinc/60/91/84/1037609184.db2.gz LSCWGMCWNYWFBH-HXUWFJFHSA-N -1 3 339.435 4.119 20 0 EIADHM O=C(Nc1cccc(-c2cccs2)c1)c1cc(F)cc2n[n-]nc21 ZINC000503487663 1037785554 /nfs/dbraw/zinc/78/55/54/1037785554.db2.gz OKLSGPBOYAUJDS-UHFFFAOYSA-N -1 3 338.367 4.078 20 0 EIADHM CC[C@@H](C)N(CC(=O)[O-])Cc1cc(Cl)c(C)cc1Br ZINC000414682386 1037805998 /nfs/dbraw/zinc/80/59/98/1037805998.db2.gz NOPKBSCIMQBANL-SNVBAGLBSA-N -1 3 348.668 4.096 20 0 EIADHM O=C([O-])[C@@H](CNCc1cc(Cl)sc1Cl)Cc1ccccc1 ZINC000669469958 1037917837 /nfs/dbraw/zinc/91/78/37/1037917837.db2.gz QRCKKLZRWPRSNH-GFCCVEGCSA-N -1 3 344.263 4.088 20 0 EIADHM O=C([O-])C[C@@H](NCc1cnc(C2CCCC2)s1)c1cccs1 ZINC000669472630 1037940448 /nfs/dbraw/zinc/94/04/48/1037940448.db2.gz GKPHCDIXZJLNIT-CYBMUJFWSA-N -1 3 336.482 4.168 20 0 EIADHM CC(C)c1ccc([C@@H](C)CC(=O)NCc2ccc([O-])c(F)c2)cc1 ZINC000606536748 1038150942 /nfs/dbraw/zinc/15/09/42/1038150942.db2.gz ZYDVEIIQRMAYHJ-AWEZNQCLSA-N -1 3 329.415 4.465 20 0 EIADHM CCCCN(CC)c1ccc(C(=O)NCc2ccc([O-])c(F)c2)cc1 ZINC000606537128 1038155172 /nfs/dbraw/zinc/15/51/72/1038155172.db2.gz OHBNODYCFDSEAT-UHFFFAOYSA-N -1 3 344.430 4.088 20 0 EIADHM Cn1c(=O)[n-]nc1SCc1cccc(SCc2ccccc2)c1 ZINC000574310697 1038162032 /nfs/dbraw/zinc/16/20/32/1038162032.db2.gz KKUIAWDTMGOXOY-UHFFFAOYSA-N -1 3 343.477 4.105 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2ccc(OC(C)(C)C)cc2)cc1F ZINC000607615995 1038240815 /nfs/dbraw/zinc/24/08/15/1038240815.db2.gz KUYUMBVMVBOILK-UHFFFAOYSA-N -1 3 337.416 4.112 20 0 EIADHM CCc1ccc(S(=O)(=O)[N-]c2ccc(OC(C)(C)C)cc2)cc1 ZINC000607616044 1038241467 /nfs/dbraw/zinc/24/14/67/1038241467.db2.gz QSUGFJBNAMSOHJ-UHFFFAOYSA-N -1 3 333.453 4.227 20 0 EIADHM Cc1ccc(CNC(=O)c2cc([O-])ccc2Cl)c(OC(C)C)c1 ZINC000574470432 1038244582 /nfs/dbraw/zinc/24/45/82/1038244582.db2.gz NLEYYVCZMXWCSH-UHFFFAOYSA-N -1 3 333.815 4.071 20 0 EIADHM O=C([N-]c1ccccc1SC(F)F)c1csc([N+](=O)[O-])c1 ZINC000044315314 1038285362 /nfs/dbraw/zinc/28/53/62/1038285362.db2.gz YTINMRQFGLCORS-UHFFFAOYSA-N -1 3 330.337 4.223 20 0 EIADHM O=c1[n-]c(SCC2CCC2)nc2c1cnn2-c1cccc(Cl)c1 ZINC000608101913 1038610153 /nfs/dbraw/zinc/61/01/53/1038610153.db2.gz QLICWTPZPGOJOH-UHFFFAOYSA-N -1 3 346.843 4.067 20 0 EIADHM COc1cc(C(=O)/C=C/c2ccc(SC)c(OC)c2)ccc1[O-] ZINC000063867132 1038859816 /nfs/dbraw/zinc/85/98/16/1038859816.db2.gz MXOKNMWPGOEUAB-QPJJXVBHSA-N -1 3 330.405 4.027 20 0 EIADHM CC(=O)c1cccc(NC(=O)c2ccc3[nH]c4c(c3c2)CCCC4)c1[O-] ZINC000552069438 1039093898 /nfs/dbraw/zinc/09/38/98/1039093898.db2.gz SETBFWPJULIZAQ-UHFFFAOYSA-N -1 3 348.402 4.207 20 0 EIADHM CC(=O)c1cccc(NC(=O)c2ccc(-c3ccccc3F)o2)c1[O-] ZINC000552069291 1039095247 /nfs/dbraw/zinc/09/52/47/1039095247.db2.gz MWLAGMHDLLAETA-UHFFFAOYSA-N -1 3 339.322 4.246 20 0 EIADHM CC(=O)c1cccc(NC(=O)[C@H](C)Sc2ccc(Cl)cc2)c1[O-] ZINC000552069353 1039095309 /nfs/dbraw/zinc/09/53/09/1039095309.db2.gz OWELXQBLXBPLIV-NSHDSACASA-N -1 3 349.839 4.368 20 0 EIADHM CC[C@@H](C)Oc1ccc(-c2nc3ccc(Cl)cc3c(=O)[n-]2)cc1 ZINC000481201844 1039114060 /nfs/dbraw/zinc/11/40/60/1039114060.db2.gz URTHNFAWTHVALK-LLVKDONJSA-N -1 3 328.799 4.421 20 0 EIADHM COc1ccc(N(CC2CC2)C(=O)c2cc([O-])ccc2Cl)cc1 ZINC000456183158 1039155850 /nfs/dbraw/zinc/15/58/50/1039155850.db2.gz UHRCWCMTYWAXEN-UHFFFAOYSA-N -1 3 331.799 4.111 20 0 EIADHM CC(C)[C@H](CCc1ccccc1)C(=O)NCc1ccc([O-])c(F)c1 ZINC000481253681 1039188247 /nfs/dbraw/zinc/18/82/47/1039188247.db2.gz FWQUWIVVDHZEMR-KRWDZBQOSA-N -1 3 329.415 4.053 20 0 EIADHM O=C([N-]c1nc(Sc2ccccc2)ns1)c1cccc(F)c1F ZINC000600183013 1039359648 /nfs/dbraw/zinc/35/96/48/1039359648.db2.gz CAEBKFWUWRXLKO-UHFFFAOYSA-N -1 3 349.387 4.220 20 0 EIADHM C/C=C\c1ccc(OCC(=O)Nc2ccc(Cl)cc2[O-])c(OC)c1 ZINC000534709885 1039720032 /nfs/dbraw/zinc/72/00/32/1039720032.db2.gz VLPQJYMBBMNKMT-ARJAWSKDSA-N -1 3 347.798 4.105 20 0 EIADHM O=c1[n-]c(SCC2CCCCC2)nc2c1cnn2-c1ccccc1 ZINC000476640176 1039809725 /nfs/dbraw/zinc/80/97/25/1039809725.db2.gz RRKHOMFJGCPBED-UHFFFAOYSA-N -1 3 340.452 4.194 20 0 EIADHM CCn1cc(CC(=O)Nc2c([O-])cccc2Cl)c2ccccc21 ZINC000552783380 1039816892 /nfs/dbraw/zinc/81/68/92/1039816892.db2.gz SLXMUOQDHCRHGT-UHFFFAOYSA-N -1 3 328.799 4.201 20 0 EIADHM Cc1c(C)c(C)c(S(=O)(=O)[N-]c2ncccc2Cl)c(C)c1C ZINC000481941361 1039898226 /nfs/dbraw/zinc/89/82/26/1039898226.db2.gz HUOUSHMLKQEJRR-UHFFFAOYSA-N -1 3 338.860 4.078 20 0 EIADHM O=c1[n-]c(-c2ccc3c(c2)CCCCC3=O)nc2ccc(Cl)cc12 ZINC000479184967 1040200398 /nfs/dbraw/zinc/20/03/98/1040200398.db2.gz NWCBYOBIEGPDJJ-UHFFFAOYSA-N -1 3 338.794 4.153 20 0 EIADHM Cc1noc(C)c1[N-]C(=O)c1csc(-c2ccc(Cl)cc2)n1 ZINC000063489376 1040210640 /nfs/dbraw/zinc/21/06/40/1040210640.db2.gz HGLOWUSZBSVODH-UHFFFAOYSA-N -1 3 333.800 4.321 20 0 EIADHM CCc1cc(=O)[n-]c(CSCc2coc(-c3ccc(C)cc3)n2)n1 ZINC000477355921 1040432624 /nfs/dbraw/zinc/43/26/24/1040432624.db2.gz ZOIHZJFCGHRWFV-UHFFFAOYSA-N -1 3 341.436 4.141 20 0 EIADHM CCc1ccc(NC(=O)NCc2ccc([O-])c(Br)c2)cc1 ZINC000479666694 1040545625 /nfs/dbraw/zinc/54/56/25/1040545625.db2.gz XXZCAMVJNBYIFK-UHFFFAOYSA-N -1 3 349.228 4.039 20 0 EIADHM CC[C@@H](C)c1cc(C(=O)[N-]c2c(F)cccc2Br)on1 ZINC000084245182 1040547765 /nfs/dbraw/zinc/54/77/65/1040547765.db2.gz GUQOGMWEDQZAFX-MRVPVSSYSA-N -1 3 341.180 4.342 20 0 EIADHM COc1ccccc1C1(C(=O)Nc2cccc([O-])c2F)CCCCC1 ZINC000551919937 1040704848 /nfs/dbraw/zinc/70/48/48/1040704848.db2.gz WIZAAUAIAIZTHG-UHFFFAOYSA-N -1 3 343.398 4.381 20 0 EIADHM Cc1ccc(/C=C\S(=O)(=O)[N-]c2ccccc2OC(C)C)cc1 ZINC000096137184 1040783264 /nfs/dbraw/zinc/78/32/64/1040783264.db2.gz ZLYGRGMOHZGLIE-SEYXRHQNSA-N -1 3 331.437 4.195 20 0 EIADHM CCc1ccc([O-])c(C(=O)N2CCCc3cc(OC(F)F)ccc32)c1 ZINC000539844984 1040835439 /nfs/dbraw/zinc/83/54/39/1040835439.db2.gz JRCQOIFAUWACPZ-UHFFFAOYSA-N -1 3 347.361 4.149 20 0 EIADHM O=C(Nc1ccc([O-])c(C(F)(F)F)c1)[C@H]1C[C@H]1c1ccc(F)cc1 ZINC000540202965 1041261464 /nfs/dbraw/zinc/26/14/64/1041261464.db2.gz SOTHJEYPHRNURK-STQMWFEESA-N -1 3 339.288 4.292 20 0 EIADHM CC(F)(F)CC(=O)[N-][C@@H](c1ccc(F)c(Cl)c1)C(F)(F)F ZINC000436468979 1041267233 /nfs/dbraw/zinc/26/72/33/1041267233.db2.gz KNAPFDYONFGKCL-JTQLQIEISA-N -1 3 333.659 4.244 20 0 EIADHM CO[C@@H](C)c1cccc(NC(=O)c2cc3c(cc2[O-])CCCC3)c1 ZINC000436511604 1041295795 /nfs/dbraw/zinc/29/57/95/1041295795.db2.gz HGDNDLREOBOWQC-ZDUSSCGKSA-N -1 3 325.408 4.231 20 0 EIADHM Cc1cccc([C@@H](CC(=O)[O-])NCc2cnc(C(C)(C)C)s2)c1 ZINC000904042481 1041297898 /nfs/dbraw/zinc/29/78/98/1041297898.db2.gz FARGIAZRPSRQRY-OAHLLOKOSA-N -1 3 332.469 4.055 20 0 EIADHM Cc1cccc([C@H](CC(=O)[O-])NCc2cnc(C(C)(C)C)s2)c1 ZINC000904042479 1041298271 /nfs/dbraw/zinc/29/82/71/1041298271.db2.gz FARGIAZRPSRQRY-HNNXBMFYSA-N -1 3 332.469 4.055 20 0 EIADHM Cc1cccc([C@H](CC(=O)[O-])NCc2cnc(C3CCCC3)s2)c1 ZINC000904046200 1041302217 /nfs/dbraw/zinc/30/22/17/1041302217.db2.gz XGAFFFMLJMYBBE-KRWDZBQOSA-N -1 3 344.480 4.415 20 0 EIADHM Cc1nc2c(cccc2-c2noc(-c3cc4ccccc4cc3[O-])n2)[nH]1 ZINC000436523021 1041304200 /nfs/dbraw/zinc/30/42/00/1041304200.db2.gz YNHMXZZXPFUTGC-UHFFFAOYSA-N -1 3 342.358 4.447 20 0 EIADHM Cc1ccc(C(=O)N2CCS[C@H](C)[C@H]2c2ccccc2)c([O-])c1 ZINC000436526885 1041309696 /nfs/dbraw/zinc/30/96/96/1041309696.db2.gz FRFQDPCRFZZPIB-KDOFPFPSSA-N -1 3 327.449 4.019 20 0 EIADHM Cc1ccc(C(=O)Nc2ccccc2NCC(F)(F)F)c([O-])c1C ZINC000436540828 1041332618 /nfs/dbraw/zinc/33/26/18/1041332618.db2.gz ULGMIHXPLKTRIB-UHFFFAOYSA-N -1 3 338.329 4.236 20 0 EIADHM [O-]c1ccc(Cc2ccccc2)cc1-c1nc(Cc2cncs2)no1 ZINC000436596205 1041354805 /nfs/dbraw/zinc/35/48/05/1041354805.db2.gz OZSARMJRSCBDCX-UHFFFAOYSA-N -1 3 349.415 4.080 20 0 EIADHM Cc1ccc(CO)cc1NC(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436595169 1041355949 /nfs/dbraw/zinc/35/59/49/1041355949.db2.gz LDPWRETYEFDTPK-UHFFFAOYSA-N -1 3 347.414 4.036 20 0 EIADHM CSC[C@H]1CCCN1C(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436598330 1041357707 /nfs/dbraw/zinc/35/77/07/1041357707.db2.gz YMRGNBCIMBEBON-CQSZACIVSA-N -1 3 343.448 4.152 20 0 EIADHM CC(C)c1ccc(C(=O)N2C[C@H](C)O[C@@H](c3ccsc3)C2)c([O-])c1 ZINC000436589133 1041366308 /nfs/dbraw/zinc/36/63/08/1041366308.db2.gz VNHIYUVQVBAHEP-SCLBCKFNSA-N -1 3 345.464 4.179 20 0 EIADHM CC(C)c1ccc(C(=O)NCCc2nc3ccccc3s2)c([O-])c1 ZINC000436633602 1041383611 /nfs/dbraw/zinc/38/36/11/1041383611.db2.gz ILIMNTVXVYQMKG-UHFFFAOYSA-N -1 3 340.448 4.098 20 0 EIADHM COc1ccccc1-c1csc(NC(=O)c2cccc(C)c2[O-])n1 ZINC000436636333 1041385682 /nfs/dbraw/zinc/38/56/82/1041385682.db2.gz QXLIBNGKENSJIB-UHFFFAOYSA-N -1 3 340.404 4.085 20 0 EIADHM O=c1cc(CSCc2nc(Cl)ccc2Cl)nc(C2CC2)[n-]1 ZINC000842193802 1041393088 /nfs/dbraw/zinc/39/30/88/1041393088.db2.gz AIUMRPCNCVEZEY-UHFFFAOYSA-N -1 3 342.251 4.195 20 0 EIADHM CC(=O)c1ccc(C(=O)N2CCCC[C@@H]2c2ccc(F)cc2)cc1[O-] ZINC000436658914 1041413235 /nfs/dbraw/zinc/41/32/35/1041413235.db2.gz WIVDCNTUVWXAOR-GOSISDBHSA-N -1 3 341.382 4.101 20 0 EIADHM O=C(c1ccc(O)cc1[O-])N1CCCCC[C@H]1/C=C/c1ccccc1 ZINC000436677884 1041417256 /nfs/dbraw/zinc/41/72/56/1041417256.db2.gz FYGXGOOQQNPEJR-DVQDXYAYSA-N -1 3 337.419 4.196 20 0 EIADHM CCCCN(C(=O)c1cc(OC)c([O-])c(OC)c1)[C@@H]1CCC[C@H](C)C1 ZINC000436701707 1041432125 /nfs/dbraw/zinc/43/21/25/1041432125.db2.gz ALKHCYJWSXBUIP-GOEBONIOSA-N -1 3 349.471 4.230 20 0 EIADHM CCN(C(=O)c1cc(C)ccc1[O-])c1ccc(Br)cc1 ZINC000436758900 1041455362 /nfs/dbraw/zinc/45/53/62/1041455362.db2.gz ZBLZMDVJOJLWBO-UHFFFAOYSA-N -1 3 334.213 4.130 20 0 EIADHM CCN(C(=O)c1cccc(C)c1[O-])c1ccc(Br)cc1 ZINC000436756238 1041455826 /nfs/dbraw/zinc/45/58/26/1041455826.db2.gz OXZUTDFPFTTWLQ-UHFFFAOYSA-N -1 3 334.213 4.130 20 0 EIADHM COc1ccc(CN(C)C(=O)c2ccc(C(C)C)cc2[O-])cc1C ZINC000436813218 1041493002 /nfs/dbraw/zinc/49/30/02/1041493002.db2.gz DFBHYRYZOCEFTK-UHFFFAOYSA-N -1 3 327.424 4.105 20 0 EIADHM CCc1ccc(C(=O)Nc2cnn([C@@H](C)CC)c2C2CC2)c([O-])c1 ZINC000436832569 1041498116 /nfs/dbraw/zinc/49/81/16/1041498116.db2.gz SJOYMPSCOIRPLM-LBPRGKRZSA-N -1 3 327.428 4.252 20 0 EIADHM O=C(c1cc(CCc2ccccc2)ccc1[O-])N1CC[C@H]2CCC[C@@H]21 ZINC000436838578 1041505614 /nfs/dbraw/zinc/50/56/14/1041505614.db2.gz ROROKRMZUFQPSM-QUCCMNQESA-N -1 3 335.447 4.192 20 0 EIADHM CCc1ccc(-c2nc(Cc3csc(C(C)C)n3)no2)c([O-])c1 ZINC000436848245 1041516539 /nfs/dbraw/zinc/51/65/39/1041516539.db2.gz NSTZXBQWUJHHGA-UHFFFAOYSA-N -1 3 329.425 4.175 20 0 EIADHM CCc1ccc([O-])c(C(=O)N2CCn3cccc3[C@H]2c2ccccc2)c1 ZINC000538744157 1041518679 /nfs/dbraw/zinc/51/86/79/1041518679.db2.gz PGITVOMGTGLQGY-OAQYLSRUSA-N -1 3 346.430 4.002 20 0 EIADHM CCSc1cccc(F)c1[N-]C(=O)c1ccc2nsnc2c1 ZINC000484926869 1041524816 /nfs/dbraw/zinc/52/48/16/1041524816.db2.gz MTJWAWFWRGYDOI-UHFFFAOYSA-N -1 3 333.413 4.195 20 0 EIADHM Cn1ccc(-c2noc(-c3cc(Cc4ccccc4)ccc3[O-])n2)c1 ZINC000436879599 1041537456 /nfs/dbraw/zinc/53/74/56/1041537456.db2.gz GLIRSGIZMUTVOW-UHFFFAOYSA-N -1 3 331.375 4.039 20 0 EIADHM [O-]c1cc2ccccc2cc1-c1nc(-c2n[nH]c3ccccc32)no1 ZINC000436938805 1041566816 /nfs/dbraw/zinc/56/68/16/1041566816.db2.gz MZMNUCDXCXGTFN-UHFFFAOYSA-N -1 3 328.331 4.139 20 0 EIADHM Cc1cc(Cc2noc(-c3ccccc3[O-])n2)ccc1Br ZINC000436954888 1041574514 /nfs/dbraw/zinc/57/45/14/1041574514.db2.gz INRVMGIVSTUJSU-UHFFFAOYSA-N -1 3 345.196 4.104 20 0 EIADHM CCCCOc1ccc(C(=O)N2CC[C@H]2Cc2ccccc2)c([O-])c1 ZINC000436987129 1041581925 /nfs/dbraw/zinc/58/19/25/1041581925.db2.gz LUCSMXDAQBTTAO-KRWDZBQOSA-N -1 3 339.435 4.028 20 0 EIADHM CC(=O)Nc1ccc(-c2noc(-c3ccc(C(C)C)cc3[O-])n2)cc1 ZINC000436998264 1041585916 /nfs/dbraw/zinc/58/59/16/1041585916.db2.gz PDTBGHZOOULHEZ-UHFFFAOYSA-N -1 3 337.379 4.191 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1ccc([C@H]2CCCOC2)cc1 ZINC000505963457 1041634759 /nfs/dbraw/zinc/63/47/59/1041634759.db2.gz AFUYCFQCIGMZCW-AWEZNQCLSA-N -1 3 331.799 4.192 20 0 EIADHM CCOC(=O)c1ccc(NC(=O)c2ccc(C)c(C)c2Cl)c([O-])c1 ZINC000541247192 1041867381 /nfs/dbraw/zinc/86/73/81/1041867381.db2.gz ZNTUEHRKPCYEFQ-UHFFFAOYSA-N -1 3 347.798 4.091 20 0 EIADHM COc1ccc([O-])c(C(=O)Nc2sc(-c3ccccc3)nc2C)c1 ZINC000541437013 1041941528 /nfs/dbraw/zinc/94/15/28/1041941528.db2.gz TWDPECLVGREPCJ-UHFFFAOYSA-N -1 3 340.404 4.085 20 0 EIADHM CCOc1cccc2[nH]cc(CC(=O)Nc3ccc(Cl)cc3[O-])c21 ZINC000438149567 1042068628 /nfs/dbraw/zinc/06/86/28/1042068628.db2.gz HEDAQUGFPLJQBO-UHFFFAOYSA-N -1 3 344.798 4.107 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1cc(-c2cccc(F)c2)no1 ZINC000517561485 1042075543 /nfs/dbraw/zinc/07/55/43/1042075543.db2.gz NDSHCAJIQJINQO-UHFFFAOYSA-N -1 3 332.718 4.092 20 0 EIADHM Cc1ccc2ncc(C(=O)[O-])c(N3CCC(OC(C)(C)C)CC3)c2c1 ZINC000517747585 1042166670 /nfs/dbraw/zinc/16/66/70/1042166670.db2.gz YGDOMMOJTJLBMD-UHFFFAOYSA-N -1 3 342.439 4.025 20 0 EIADHM CC(C)[C@H]1CCN(Cc2nc(=O)c3c(-c4ccco4)csc3[n-]2)C1 ZINC000438489093 1042208852 /nfs/dbraw/zinc/20/88/52/1042208852.db2.gz IQAYQEFESAWUFB-LBPRGKRZSA-N -1 3 343.452 4.135 20 0 EIADHM Cc1cscc1NC(=O)Nc1ccc(-c2cc(=O)[n-]c(C)n2)cc1 ZINC000439114887 1042502048 /nfs/dbraw/zinc/50/20/48/1042502048.db2.gz BAZSZFGJJXIUPQ-UHFFFAOYSA-N -1 3 340.408 4.172 20 0 EIADHM COC(=O)c1coc(C(=O)[N-]c2c(Cl)cc(Cl)cc2Cl)c1 ZINC000439266211 1042565990 /nfs/dbraw/zinc/56/59/90/1042565990.db2.gz ANOINZMRGVCFRV-UHFFFAOYSA-N -1 3 348.569 4.279 20 0 EIADHM O=C(Nc1ccc(-c2ccccc2)cc1)c1c[n-]c2ccccc2c1=O ZINC000088259876 1042682554 /nfs/dbraw/zinc/68/25/54/1042682554.db2.gz JHPSSVKLFZOOOD-UHFFFAOYSA-N -1 3 340.382 4.447 20 0 EIADHM CCc1ccc(C(=O)N2CC[C@@H](C(F)(F)F)C(C)(C)C2)c([O-])c1 ZINC000190695895 1042968026 /nfs/dbraw/zinc/96/80/26/1042968026.db2.gz DUGBDJXINNEMTA-CQSZACIVSA-N -1 3 329.362 4.005 20 0 EIADHM [O-]c1cc(F)cc(CNc2cccc(COCc3ccco3)c2)c1 ZINC000185481239 1043189814 /nfs/dbraw/zinc/18/98/14/1043189814.db2.gz RMHIOMUTWYRNAU-UHFFFAOYSA-N -1 3 327.355 4.453 20 0 EIADHM CC(C)(CNC(=O)c1cc([O-])c2ccccc2c1)c1cccs1 ZINC000526894513 1043243515 /nfs/dbraw/zinc/24/35/15/1043243515.db2.gz GYXMRQJWLVCYDX-UHFFFAOYSA-N -1 3 325.433 4.315 20 0 EIADHM O=C(NCCCc1c[nH]c2ccccc12)c1cc([O-])c2ccccc2c1 ZINC000526880732 1043243923 /nfs/dbraw/zinc/24/39/23/1043243923.db2.gz PCSIBEXXQHFGIL-UHFFFAOYSA-N -1 3 344.414 4.389 20 0 EIADHM Cc1ccc2c(c1)N(C(=O)c1cc([O-])c3ccccc3c1)C[C@H](C)O2 ZINC000526928187 1043245296 /nfs/dbraw/zinc/24/52/96/1043245296.db2.gz LURIFXSVKZFEKH-AWEZNQCLSA-N -1 3 333.387 4.282 20 0 EIADHM Cc1ccc(OCCN(C)C(=O)c2cc([O-])c3ccccc3c2)cc1 ZINC000526908840 1043245325 /nfs/dbraw/zinc/24/53/25/1043245325.db2.gz DJICCPPESIGUSD-UHFFFAOYSA-N -1 3 335.403 4.005 20 0 EIADHM CC(C)(C)OC1CC(CCNC(=O)c2cc([O-])c3ccccc3c2)C1 ZINC000526934417 1043245776 /nfs/dbraw/zinc/24/57/76/1043245776.db2.gz QYKOAZOJQNCMED-UHFFFAOYSA-N -1 3 341.451 4.259 20 0 EIADHM CC(C)[C@@H](CC(F)(F)F)NC(=O)c1cc([O-])c2ccccc2c1 ZINC000527179537 1043252815 /nfs/dbraw/zinc/25/28/15/1043252815.db2.gz GUOMGAZVKSVMEI-CQSZACIVSA-N -1 3 325.330 4.252 20 0 EIADHM C[C@@H](CNC(=O)c1cc([O-])c2ccccc2c1)COCc1ccccc1 ZINC000527450927 1043260569 /nfs/dbraw/zinc/26/05/69/1043260569.db2.gz VCAAJNXTASGEDD-INIZCTEOSA-N -1 3 349.430 4.128 20 0 EIADHM CC(C)(C)[C@H](NC(=O)c1cc([O-])c2ccccc2c1)C(F)(F)F ZINC000527466543 1043263241 /nfs/dbraw/zinc/26/32/41/1043263241.db2.gz WQMJYKGUBICZMG-HNNXBMFYSA-N -1 3 325.330 4.252 20 0 EIADHM O=C(N[C@@H]1CCOC2(CCCCC2)C1)c1cc([O-])c2ccccc2c1 ZINC000281691183 1043299889 /nfs/dbraw/zinc/29/98/89/1043299889.db2.gz VDTPYWAXEYAQDL-QGZVFWFLSA-N -1 3 339.435 4.157 20 0 EIADHM O=C(Nc1cc(F)ccc1[O-])c1cccc(Oc2nccs2)c1 ZINC000674015878 1043304711 /nfs/dbraw/zinc/30/47/11/1043304711.db2.gz WUCGHKHLPODRRB-UHFFFAOYSA-N -1 3 330.340 4.032 20 0 EIADHM O=C([N-][C@H](c1ccco1)c1ccccc1)C(F)(F)c1ccccc1F ZINC000766058155 1043369253 /nfs/dbraw/zinc/36/92/53/1043369253.db2.gz CJBSDUZJZVJETR-KRWDZBQOSA-N -1 3 345.320 4.416 20 0 EIADHM [O-]c1c(F)cc(F)cc1Nc1ncc(Cl)cc1Br ZINC001212477804 1043407629 /nfs/dbraw/zinc/40/76/29/1043407629.db2.gz MUMYHCFQRRMPCO-UHFFFAOYSA-N -1 3 335.535 4.225 20 0 EIADHM CC(C)(C)c1nsc([N-]C(=O)c2sccc2SC(F)F)n1 ZINC000730493684 1043538765 /nfs/dbraw/zinc/53/87/65/1043538765.db2.gz HBJNBKOZWSTYGV-UHFFFAOYSA-N -1 3 349.453 4.464 20 0 EIADHM C[C@H](OC(=O)c1cccc(Cl)c1[O-])c1ccc(C(F)(F)F)cn1 ZINC001128382799 1043659863 /nfs/dbraw/zinc/65/98/63/1043659863.db2.gz HVUDHSOFKUOYFC-QMMMGPOBSA-N -1 3 345.704 4.377 20 0 EIADHM Cc1cccc(C(=O)Nc2ccccc2NC(=O)OC(C)(C)C)c1[O-] ZINC000730965414 1043669320 /nfs/dbraw/zinc/66/93/20/1043669320.db2.gz VRQJLUOLXCBORT-UHFFFAOYSA-N -1 3 342.395 4.300 20 0 EIADHM O=C([N-]c1ccc(F)c(F)c1F)c1cc(-c2ccccc2F)on1 ZINC000078743639 1043749452 /nfs/dbraw/zinc/74/94/52/1043749452.db2.gz OOCHOKMQBSQWFP-UHFFFAOYSA-N -1 3 336.244 4.150 20 0 EIADHM Cc1ccc(SC2CCCC2)c(C(=O)Nc2ncccc2[O-])c1 ZINC000543095255 1043817226 /nfs/dbraw/zinc/81/72/26/1043817226.db2.gz LOYQYXYFDHGFFL-UHFFFAOYSA-N -1 3 328.437 4.383 20 0 EIADHM Cc1ccnc(CSc2nnc([N-]c3ccccc3F)s2)c1 ZINC000682849806 1043862220 /nfs/dbraw/zinc/86/22/20/1043862220.db2.gz KAPRAMYZBNBZMQ-UHFFFAOYSA-N -1 3 332.429 4.417 20 0 EIADHM CCc1nc([C@@H](C)[N-]C(=O)C(F)(F)c2cccc(Cl)c2)cs1 ZINC000732032777 1043867246 /nfs/dbraw/zinc/86/72/46/1043867246.db2.gz RRHKJATYLCPJHC-SECBINFHSA-N -1 3 344.814 4.328 20 0 EIADHM Cc1ccc(-c2nc(CC(=O)Nc3cc(Cl)ccc3[O-])cs2)o1 ZINC000067145548 1043870571 /nfs/dbraw/zinc/87/05/71/1043870571.db2.gz DBTPKUGTLRHZIL-UHFFFAOYSA-N -1 3 348.811 4.252 20 0 EIADHM Cc1ccc(Cl)c([N-]S(=O)(=O)c2cnc3ccccc3c2)c1C ZINC000509240511 1044176197 /nfs/dbraw/zinc/17/61/97/1044176197.db2.gz NAFBDRKPBDUCIM-UHFFFAOYSA-N -1 3 346.839 4.306 20 0 EIADHM Cc1ccc(C(=O)Nc2ccc(NC(=O)OC(C)(C)C)cc2)c([O-])c1 ZINC000729535303 1044181786 /nfs/dbraw/zinc/18/17/86/1044181786.db2.gz APRMHQKNSISTPP-UHFFFAOYSA-N -1 3 342.395 4.300 20 0 EIADHM Cc1c(C(=O)Nc2cc(Cl)ccc2[O-])[nH]c2c1C(=O)CC(C)(C)C2 ZINC000195680357 1044201173 /nfs/dbraw/zinc/20/11/73/1044201173.db2.gz XCKJIOLIVPIEOD-UHFFFAOYSA-N -1 3 346.814 4.090 20 0 EIADHM COc1cccc([O-])c1C(=O)N[C@@H]1C[C@H](C)C[C@H](c2ccccc2)C1 ZINC001299308695 1044339080 /nfs/dbraw/zinc/33/90/80/1044339080.db2.gz GQTUQIMSRNFUAA-HYVNUMGLSA-N -1 3 339.435 4.103 20 0 EIADHM COc1cccc([O-])c1C(=O)N[C@@H]1C[C@@H](C)C[C@H](c2ccccc2)C1 ZINC001299308693 1044340382 /nfs/dbraw/zinc/34/03/82/1044340382.db2.gz GQTUQIMSRNFUAA-BHYGNILZSA-N -1 3 339.435 4.103 20 0 EIADHM CSc1ccc([O-])c(C(=O)N[C@H](C)Cc2ccccc2Cl)c1 ZINC001141750289 1044505942 /nfs/dbraw/zinc/50/59/42/1044505942.db2.gz HSJFKHMRWNGTNH-LLVKDONJSA-N -1 3 335.856 4.129 20 0 EIADHM CC[C@@H](Oc1ccnc(=S)[n-]1)c1ccc(Br)cc1 ZINC001226938535 1044577729 /nfs/dbraw/zinc/57/77/29/1044577729.db2.gz APKMEQLOIXKLBE-LLVKDONJSA-N -1 3 325.231 4.058 20 0 EIADHM C[C@@H](CC(=O)NCc1ccc([O-])c(Br)c1)CC(C)(C)C ZINC000676055692 1044622796 /nfs/dbraw/zinc/62/27/96/1044622796.db2.gz KHXKHSBKHMWQAF-NSHDSACASA-N -1 3 342.277 4.233 20 0 EIADHM CC(C)(C(=O)NCc1ccc([O-])c(F)c1)c1ccc2ccccc2c1 ZINC000676157020 1044665265 /nfs/dbraw/zinc/66/52/65/1044665265.db2.gz PCCFICYTZPIMDO-UHFFFAOYSA-N -1 3 337.394 4.279 20 0 EIADHM O=C(c1ccc([O-])cc1)C1CCN(CCc2ccccc2Cl)CC1 ZINC000261385103 1044705228 /nfs/dbraw/zinc/70/52/28/1044705228.db2.gz VKTMRZBOSHVXGT-UHFFFAOYSA-N -1 3 343.854 4.183 20 0 EIADHM Cc1cc(=O)[n-]c(C(C)(C)NCc2ccc(Cl)c(C)c2Cl)n1 ZINC000895542608 1044804866 /nfs/dbraw/zinc/80/48/66/1044804866.db2.gz IFVKZKXXHZHKID-UHFFFAOYSA-N -1 3 340.254 4.131 20 0 EIADHM Cc1ccc(C(=O)Nc2ccc3c(cnn3C(F)F)c2)c([O-])c1C ZINC000676626279 1044810868 /nfs/dbraw/zinc/81/08/68/1044810868.db2.gz IRUNOMIRDNSGMD-UHFFFAOYSA-N -1 3 331.322 4.006 20 0 EIADHM Cc1ccc(-c2noc(-c3ccccc3[O-])n2)c(Br)c1 ZINC000230998132 1044833393 /nfs/dbraw/zinc/83/33/93/1044833393.db2.gz KCBQKWSEAGBKED-UHFFFAOYSA-N -1 3 331.169 4.180 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)N[C@H](c1ccc(Cl)cc1)C1CC1 ZINC000155435845 1044897839 /nfs/dbraw/zinc/89/78/39/1044897839.db2.gz HYBDRQLUDKARLN-KRWDZBQOSA-N -1 3 348.805 4.135 20 0 EIADHM CC(C)c1ccc2cc(C(=O)NCc3ccc([O-])c(F)c3)[nH]c2c1 ZINC000738552581 1045066071 /nfs/dbraw/zinc/06/60/71/1045066071.db2.gz UJUKLSCPYJNBNG-UHFFFAOYSA-N -1 3 326.371 4.066 20 0 EIADHM CCc1oc2ccccc2c1CN[C@@H](CC(=O)[O-])c1cccs1 ZINC000319915948 1045109599 /nfs/dbraw/zinc/10/95/99/1045109599.db2.gz DPHKBDNESYHDAC-AWEZNQCLSA-N -1 3 329.421 4.362 20 0 EIADHM [O-]c1ccc(F)c(CNc2ccc(-n3cccn3)c(Cl)c2)c1F ZINC000509436890 1045169141 /nfs/dbraw/zinc/16/91/41/1045169141.db2.gz MVPFWDQXBHKHRQ-UHFFFAOYSA-N -1 3 335.741 4.122 20 0 EIADHM CCc1nc(C)c([C@H](C)OC(=O)c2cc(-c3ccc(C)o3)[n-]n2)s1 ZINC000741138114 1045275929 /nfs/dbraw/zinc/27/59/29/1045275929.db2.gz SFWBXYKBPPPYSU-NSHDSACASA-N -1 3 345.424 4.223 20 0 EIADHM CCc1nc(C)c([C@H](C)OC(=O)c2cc(-c3ccc(C)o3)n[n-]2)s1 ZINC000741138114 1045275938 /nfs/dbraw/zinc/27/59/38/1045275938.db2.gz SFWBXYKBPPPYSU-NSHDSACASA-N -1 3 345.424 4.223 20 0 EIADHM O=C(OCCOC(c1ccccc1)c1ccccc1)c1ccc([O-])cc1 ZINC000915734268 1045457408 /nfs/dbraw/zinc/45/74/08/1045457408.db2.gz BQUQLKHRSIODEM-UHFFFAOYSA-N -1 3 348.398 4.355 20 0 EIADHM Cc1cc(C(=O)O[C@H](C)c2nc(=O)c3c(C)c(C)sc3[n-]2)oc1C ZINC000768122975 1045722459 /nfs/dbraw/zinc/72/24/59/1045722459.db2.gz BWCPTRZLAUBVMI-SNVBAGLBSA-N -1 3 346.408 4.142 20 0 EIADHM O=C(NC1(c2cccc(F)c2)CC1)c1cc2sccc2c([O-])c1 ZINC000791368403 1045727215 /nfs/dbraw/zinc/72/72/15/1045727215.db2.gz XZTAMOVZHDNJEL-UHFFFAOYSA-N -1 3 327.380 4.165 20 0 EIADHM O=C(NC1(c2nccs2)CCCC1)c1cc2sccc2c([O-])c1 ZINC000791366049 1045732158 /nfs/dbraw/zinc/73/21/58/1045732158.db2.gz GAVNXQSCQKYIMU-UHFFFAOYSA-N -1 3 344.461 4.263 20 0 EIADHM CCCCCN(CCCCC)C(=O)c1cc(=O)c2ccccc2[n-]1 ZINC000056013010 1045764137 /nfs/dbraw/zinc/76/41/37/1045764137.db2.gz KGYAESQMTKNPCM-UHFFFAOYSA-N -1 3 328.456 4.351 20 0 EIADHM Cc1c2ccccc2oc1[C@@H](C)NC(=O)c1cc(=O)c2ccccc2[n-]1 ZINC000056077711 1045781267 /nfs/dbraw/zinc/78/12/67/1045781267.db2.gz PDRTXEVFOQBKLO-CYBMUJFWSA-N -1 3 346.386 4.074 20 0 EIADHM Cc1cccc(Oc2ccc(NC([O-])=NO[C@@H]3CCCCO3)cc2)c1 ZINC000763268516 1045804891 /nfs/dbraw/zinc/80/48/91/1045804891.db2.gz QGWCSNSBKVTGIP-GOSISDBHSA-N -1 3 342.395 4.367 20 0 EIADHM Cc1cccc(Oc2ccc(NC(=O)[N-]O[C@@H]3CCCCO3)cc2)c1 ZINC000763268516 1045804892 /nfs/dbraw/zinc/80/48/92/1045804892.db2.gz QGWCSNSBKVTGIP-GOSISDBHSA-N -1 3 342.395 4.367 20 0 EIADHM Clc1cc(-c2ccccc2-c2nnn[n-]2)cc(Cl)c1Cl ZINC001235910541 1045817961 /nfs/dbraw/zinc/81/79/61/1045817961.db2.gz VSUZVOIXCCFMMQ-UHFFFAOYSA-N -1 3 325.586 4.494 20 0 EIADHM Clc1cc(-c2ccccc2-c2nn[n-]n2)cc(Cl)c1Cl ZINC001235910541 1045817970 /nfs/dbraw/zinc/81/79/70/1045817970.db2.gz VSUZVOIXCCFMMQ-UHFFFAOYSA-N -1 3 325.586 4.494 20 0 EIADHM CCNc1ccc(C(=O)OCC)cc1Nc1ccc([O-])c(F)c1F ZINC001212008749 1045830403 /nfs/dbraw/zinc/83/04/03/1045830403.db2.gz BSYKPNJUTVANTL-UHFFFAOYSA-N -1 3 336.338 4.023 20 0 EIADHM [O-]c1ccc(Nc2cc(F)ccc2OC[C@@H]2CCCO2)c(F)c1F ZINC001212009491 1045832052 /nfs/dbraw/zinc/83/20/52/1045832052.db2.gz QXLZLDQPZWFHBJ-NSHDSACASA-N -1 3 339.313 4.111 20 0 EIADHM [O-]c1ccc(Nc2ccc(Br)c(F)c2F)c(F)c1F ZINC001212010971 1045832545 /nfs/dbraw/zinc/83/25/45/1045832545.db2.gz KNLMSWLWAFUYIN-UHFFFAOYSA-N -1 3 336.082 4.455 20 0 EIADHM COC(=O)c1ccc2cc(Nc3ccc([O-])c(F)c3F)ccc2c1 ZINC001212014107 1045834735 /nfs/dbraw/zinc/83/47/35/1045834735.db2.gz ZZMFOVKFARKNHR-UHFFFAOYSA-N -1 3 329.302 4.354 20 0 EIADHM COc1cc(Nc2ccc([O-])c(F)c2F)c(Br)cc1F ZINC001212016229 1045839565 /nfs/dbraw/zinc/83/95/65/1045839565.db2.gz FQGDKRROYHFGAI-UHFFFAOYSA-N -1 3 348.118 4.324 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N1CCCO[C@@H](c2ccccc2)C1 ZINC000792143319 1045864697 /nfs/dbraw/zinc/86/46/97/1045864697.db2.gz JWKZJRMJPOEWIH-OAQYLSRUSA-N -1 3 347.414 4.149 20 0 EIADHM O=C(NCc1c(F)c(F)cc(F)c1F)c1cc([O-])c2ccccc2c1 ZINC000792215985 1045881847 /nfs/dbraw/zinc/88/18/47/1045881847.db2.gz SJCBUBUZFKWKMH-UHFFFAOYSA-N -1 3 349.283 4.032 20 0 EIADHM O=C(Nc1nc(-c2ccccc2)c[nH]1)c1cc([O-])c2ccccc2c1 ZINC000792298996 1045887206 /nfs/dbraw/zinc/88/72/06/1045887206.db2.gz IZEIWCZODZAXQS-UHFFFAOYSA-N -1 3 329.359 4.188 20 0 EIADHM O=C([N-]Cc1c(Cl)cccc1Cl)C(F)(F)c1ccccc1 ZINC000916046589 1045887496 /nfs/dbraw/zinc/88/74/96/1045887496.db2.gz UUSNDJNERJLCCZ-UHFFFAOYSA-N -1 3 330.161 4.402 20 0 EIADHM C[C@@H]1CC[C@H](C(F)(F)F)CN1C(=O)c1cc([O-])c2ccccc2c1 ZINC000792308387 1045888090 /nfs/dbraw/zinc/88/80/90/1045888090.db2.gz XPCYPNLPXMAAKT-RISCZKNCSA-N -1 3 337.341 4.348 20 0 EIADHM CCC[C@H](NC(=O)c1cc([O-])c2ccccc2c1)[C@@H](O)c1ccccc1 ZINC000792560775 1045934539 /nfs/dbraw/zinc/93/45/39/1045934539.db2.gz MVBMTQIWFVWWQK-FPOVZHCZSA-N -1 3 349.430 4.178 20 0 EIADHM CCCN1Cc2cccc(NC(=O)c3c([O-])cccc3Cl)c2C1 ZINC000769757756 1046058035 /nfs/dbraw/zinc/05/80/35/1046058035.db2.gz DDYQBEUJINHWFA-UHFFFAOYSA-N -1 3 330.815 4.024 20 0 EIADHM CCc1nnc([N-]C(=O)c2occc2CSc2ccccc2)s1 ZINC000253607076 1046061710 /nfs/dbraw/zinc/06/17/10/1046061710.db2.gz QZYKPUMJINJZQW-UHFFFAOYSA-N -1 3 345.449 4.238 20 0 EIADHM O=C([N-]c1nnc(-c2ccsc2)s1)c1sccc1Cl ZINC000497004816 1046163633 /nfs/dbraw/zinc/16/36/33/1046163633.db2.gz WDHBGXMBJJUERX-UHFFFAOYSA-N -1 3 327.843 4.234 20 0 EIADHM O=[S@@](Cc1cc(Br)ccc1Cl)c1ccc([O-])cc1 ZINC000080140473 1046455983 /nfs/dbraw/zinc/45/59/83/1046455983.db2.gz USHIBJIWYDKNOW-GOSISDBHSA-N -1 3 345.645 4.116 20 0 EIADHM CC[C@](C)(NCc1cccc([O-])c1Br)c1nccs1 ZINC000459441176 1046671379 /nfs/dbraw/zinc/67/13/79/1046671379.db2.gz HDLLVUABQLGUAF-AWEZNQCLSA-N -1 3 341.274 4.026 20 0 EIADHM COc1cccc(SC)c1[N-]C(=O)c1cc(F)c(F)cc1F ZINC001129823969 1046742314 /nfs/dbraw/zinc/74/23/14/1046742314.db2.gz KRABTVASYYBNCW-UHFFFAOYSA-N -1 3 327.327 4.087 20 0 EIADHM Cc1scc(C(=O)Nc2ccc(Br)cc2[O-])c1C ZINC000536895852 1046853274 /nfs/dbraw/zinc/85/32/74/1046853274.db2.gz DTJBDEMHASPMBD-UHFFFAOYSA-N -1 3 326.215 4.085 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)Nc1ccc(N2CCCC2)cc1 ZINC000786725340 1046862352 /nfs/dbraw/zinc/86/23/52/1046862352.db2.gz TYBHGPOJUDNFEP-UHFFFAOYSA-N -1 3 342.414 4.093 20 0 EIADHM Cc1cccc([N-]S(=O)(=O)c2cc(C)c(F)cc2Cl)c1F ZINC000537194746 1047017648 /nfs/dbraw/zinc/01/76/48/1047017648.db2.gz FHQVCNCADZHQHE-UHFFFAOYSA-N -1 3 331.771 4.036 20 0 EIADHM CC1(C)CN(Cc2cc(=O)oc3cc([O-])ccc23)[C@@H]1c1cccs1 ZINC000805838441 1047027231 /nfs/dbraw/zinc/02/72/31/1047027231.db2.gz AVNREODEUSBRDS-GOSISDBHSA-N -1 3 341.432 4.143 20 0 EIADHM CC(C)(C)OC(=O)Nc1ccc(C(=O)Nc2cccc([O-])c2F)cc1 ZINC000128734432 1047046865 /nfs/dbraw/zinc/04/68/65/1047046865.db2.gz CLNGGNYYKAISHF-UHFFFAOYSA-N -1 3 346.358 4.131 20 0 EIADHM C[C@]1(CNC(=O)c2cc([O-])ccc2Cl)CCCc2ccccc21 ZINC000497766718 1047056150 /nfs/dbraw/zinc/05/61/50/1047056150.db2.gz NYMLNISFJCRZDX-LJQANCHMSA-N -1 3 329.827 4.070 20 0 EIADHM C[C@H](OC(=O)CCCc1ccc([O-])c(F)c1)c1ncc(C(C)(C)C)o1 ZINC000787829455 1047059206 /nfs/dbraw/zinc/05/92/06/1047059206.db2.gz NEJGRVXOADXXQF-LBPRGKRZSA-N -1 3 349.402 4.444 20 0 EIADHM O=C(N[C@@H]1CCCOc2ccccc21)c1cc2sccc2c([O-])c1 ZINC000788297282 1047150337 /nfs/dbraw/zinc/15/03/37/1047150337.db2.gz UQAWRNBUCOLNKT-OAHLLOKOSA-N -1 3 339.416 4.251 20 0 EIADHM O=C(N[C@@H]1CCc2cc(F)ccc21)c1cc2sccc2c([O-])c1 ZINC000788286504 1047156588 /nfs/dbraw/zinc/15/65/88/1047156588.db2.gz DPQDCPWFWURGLN-OAHLLOKOSA-N -1 3 327.380 4.163 20 0 EIADHM C[C@@H]1CCc2[nH]c3ccc(C(=O)Nc4cccc([O-])c4F)cc3c2C1 ZINC000129433759 1047390664 /nfs/dbraw/zinc/39/06/64/1047390664.db2.gz RWJJOIWKUJIBLB-LLVKDONJSA-N -1 3 338.382 4.390 20 0 EIADHM CCCn1c(=O)[n-]nc1SCSCc1ccc(Cl)cc1 ZINC000789749087 1047472236 /nfs/dbraw/zinc/47/22/36/1047472236.db2.gz AFXXZDZMUBCVLU-UHFFFAOYSA-N -1 3 329.878 4.030 20 0 EIADHM O=C(Nc1cccc([O-])c1F)C1(c2ccc(F)cc2F)CCCC1 ZINC000129780202 1047506698 /nfs/dbraw/zinc/50/66/98/1047506698.db2.gz BGGFBGPZZMGVRC-UHFFFAOYSA-N -1 3 335.325 4.260 20 0 EIADHM CCc1nnsc1C(=O)[N-]c1c(F)cccc1Oc1ccccc1 ZINC000107167438 1047714156 /nfs/dbraw/zinc/71/41/56/1047714156.db2.gz JVCTXAOJLUKMFN-UHFFFAOYSA-N -1 3 343.383 4.284 20 0 EIADHM Cc1sc(-c2ccco2)nc1C(=O)[N-]c1c(F)cc(F)cc1F ZINC000072506461 1047923051 /nfs/dbraw/zinc/92/30/51/1047923051.db2.gz ZAEPAYSXYVASDC-UHFFFAOYSA-N -1 3 338.310 4.381 20 0 EIADHM O=C([N-]c1c(F)cc(F)cc1F)c1csc(Cc2ccccc2)n1 ZINC000072506488 1047924458 /nfs/dbraw/zinc/92/44/58/1047924458.db2.gz LKVDIDDOIJTUDP-UHFFFAOYSA-N -1 3 348.349 4.404 20 0 EIADHM CCc1ccc(C(=O)N[C@@H](Cc2ccc(F)cc2)C(C)C)c([O-])c1 ZINC001136980657 1048022788 /nfs/dbraw/zinc/02/27/88/1048022788.db2.gz OMNJKQDAGLTUQO-SFHVURJKSA-N -1 3 329.415 4.091 20 0 EIADHM CCCCCC[C@H](CC)C(=O)NCc1cc(=O)[n-]c(C2CCC2)n1 ZINC000825304577 1048065202 /nfs/dbraw/zinc/06/52/02/1048065202.db2.gz CFZYGPDLMWTPKQ-AWEZNQCLSA-N -1 3 333.476 4.063 20 0 EIADHM CCc1ccc([C@@H]2C[C@@H](C)CCN2C(=O)c2ccc(OC)cc2[O-])o1 ZINC001137026846 1048079529 /nfs/dbraw/zinc/07/95/29/1048079529.db2.gz UWRJMUZVNKWSNP-GUYCJALGSA-N -1 3 343.423 4.170 20 0 EIADHM CC(=O)c1cccc(NC(=O)[C@@H](C)CSc2ccc(F)cc2)c1[O-] ZINC000556891518 1048134700 /nfs/dbraw/zinc/13/47/00/1048134700.db2.gz BOWVCHGJBHVRSK-NSHDSACASA-N -1 3 347.411 4.101 20 0 EIADHM COC(=O)c1cccc([C@H](C)Nc2[n-]c(=O)c(Cl)cc2Cl)c1 ZINC001171104520 1048195624 /nfs/dbraw/zinc/19/56/24/1048195624.db2.gz ZVDDPTFTOCBWPJ-QMMMGPOBSA-N -1 3 341.194 4.054 20 0 EIADHM C[C@H](NCc1cccc([O-])c1Cl)c1ccc(N2CCCC2=O)cc1 ZINC000815118100 1048331994 /nfs/dbraw/zinc/33/19/94/1048331994.db2.gz FPPZFODOKGNBMN-ZDUSSCGKSA-N -1 3 344.842 4.023 20 0 EIADHM Cc1cccc([O-])c1C(=O)Nc1ccc(N2CCCC2)c(Cl)c1 ZINC001144248647 1048528730 /nfs/dbraw/zinc/52/87/30/1048528730.db2.gz VXKVPZVBBHHTIC-UHFFFAOYSA-N -1 3 330.815 4.207 20 0 EIADHM Cc1csc(Nc2ccc(NC(=O)c3cc(C)ccc3[O-])cc2)n1 ZINC001144247837 1048528948 /nfs/dbraw/zinc/52/89/48/1048528948.db2.gz AAWLCOBSSRISHR-UHFFFAOYSA-N -1 3 339.420 4.461 20 0 EIADHM CC(C)c1ccc(C(=O)N2C[C@H](C)OC3(CCCCC3)C2)c([O-])c1 ZINC001144260721 1048540970 /nfs/dbraw/zinc/54/09/70/1048540970.db2.gz UZODGVUTQSOVDP-HNNXBMFYSA-N -1 3 331.456 4.079 20 0 EIADHM Cc1ccccc1CCC(=O)Nc1cc(Br)ccc1[O-] ZINC001144435721 1048672503 /nfs/dbraw/zinc/67/25/03/1048672503.db2.gz QRKBWDZMRSUETF-UHFFFAOYSA-N -1 3 334.213 4.034 20 0 EIADHM COc1ccccc1C(F)(F)C(=O)[N-][C@H](C)c1ccc(Cl)s1 ZINC001127545941 1048790118 /nfs/dbraw/zinc/79/01/18/1048790118.db2.gz YKKRTYPQAQSLCY-SECBINFHSA-N -1 3 345.798 4.379 20 0 EIADHM C[C@@H]([N-]C(=O)C(F)(F)c1ccc(F)cc1)c1cccc(Cl)c1 ZINC000920840961 1048800559 /nfs/dbraw/zinc/80/05/59/1048800559.db2.gz VFUIMMAHYHOBST-SNVBAGLBSA-N -1 3 327.733 4.448 20 0 EIADHM O=C([N-][C@@H]1CCc2c1cccc2Cl)C(F)(F)c1ccc(F)cc1 ZINC000920845359 1048802999 /nfs/dbraw/zinc/80/29/99/1048802999.db2.gz RNSSWLLNSXJEOY-OAHLLOKOSA-N -1 3 339.744 4.375 20 0 EIADHM C[C@H](OC(=O)c1cc2cc(Cl)sc2[n-]1)C(=O)Nc1ccccc1 ZINC000810626149 1048829795 /nfs/dbraw/zinc/82/97/95/1048829795.db2.gz VPLYJMROKCOLTM-VIFPVBQESA-N -1 3 348.811 4.067 20 0 EIADHM CCn1c2ccc(C(=O)[O-])cc2nc1CN(C)C1CCCCCCC1 ZINC000846243577 1048846750 /nfs/dbraw/zinc/84/67/50/1048846750.db2.gz MOLLJJOPVZRSGD-UHFFFAOYSA-N -1 3 343.471 4.299 20 0 EIADHM CC[C@H](C)CO[N-]C(=O)[C@@H]1CC=CC[C@H]1c1nc2ccccc2s1 ZINC000816976801 1048884170 /nfs/dbraw/zinc/88/41/70/1048884170.db2.gz KFQDPQMXXURSSI-RRFJBIMHSA-N -1 3 344.480 4.440 20 0 EIADHM O=C(COC(=O)c1cc2cc(Cl)sc2[n-]1)c1ccccc1F ZINC000811396729 1049051678 /nfs/dbraw/zinc/05/16/78/1049051678.db2.gz RRVDWJVUKYREID-UHFFFAOYSA-N -1 3 337.759 4.062 20 0 EIADHM CCc1ccc(C(=O)NCc2ccc3cc(OC)ccc3c2)c([O-])c1 ZINC001136116640 1049100556 /nfs/dbraw/zinc/10/05/56/1049100556.db2.gz STQXAGJUZVUEPF-UHFFFAOYSA-N -1 3 335.403 4.046 20 0 EIADHM CCC(CC)[C@H](NC(=O)c1nnc2ccccc2c1[O-])c1ccccc1 ZINC001147520190 1049178989 /nfs/dbraw/zinc/17/89/89/1049178989.db2.gz XBRWONCZLUVPLK-SFHVURJKSA-N -1 3 349.434 4.243 20 0 EIADHM CC(C)Nc1ccccc1NC(=O)c1cc([O-])cc(Br)c1 ZINC001147707453 1049201779 /nfs/dbraw/zinc/20/17/79/1049201779.db2.gz PBYDSUUGBPLFGR-UHFFFAOYSA-N -1 3 349.228 4.227 20 0 EIADHM Cc1ccc([C@@H]2CCC[C@H]2N(C)C(=O)Cc2ccc([O-])c(F)c2)cc1 ZINC001147971449 1049245645 /nfs/dbraw/zinc/24/56/45/1049245645.db2.gz XXNHCWFTIKNDJN-PKOBYXMFSA-N -1 3 341.426 4.177 20 0 EIADHM COc1ccc(-c2ccccc2NC(=O)c2cccc(OC)c2[O-])cc1 ZINC001148202993 1049287403 /nfs/dbraw/zinc/28/74/03/1049287403.db2.gz VOMUWBATLDDKAW-UHFFFAOYSA-N -1 3 349.386 4.329 20 0 EIADHM CCN(C(=O)c1ccc(C(C)C)cc1[O-])[C@@H](C)[C@@H](O)c1ccccc1 ZINC000820108201 1049433161 /nfs/dbraw/zinc/43/31/61/1049433161.db2.gz LWVGKEMPVLUZKE-MGPUTAFESA-N -1 3 341.451 4.100 20 0 EIADHM Cc1cc(C)cc(N(C)C(=O)c2c[n-]c3c(Cl)cccc3c2=O)c1 ZINC001136341057 1049510794 /nfs/dbraw/zinc/51/07/94/1049510794.db2.gz NLEXTNLBRATWGN-UHFFFAOYSA-N -1 3 340.810 4.075 20 0 EIADHM CCCCSCCC(=O)Nc1ccc(Br)cc1[O-] ZINC000610060472 1049518585 /nfs/dbraw/zinc/51/85/85/1049518585.db2.gz DTVYLFUXKKBCDO-UHFFFAOYSA-N -1 3 332.263 4.017 20 0 EIADHM COCc1ccc(SCc2cc(=O)oc3c(C)c([O-])ccc23)cc1 ZINC000747814473 1049563598 /nfs/dbraw/zinc/56/35/98/1049563598.db2.gz YKWWGGRGZFXJHK-UHFFFAOYSA-N -1 3 342.416 4.246 20 0 EIADHM CC(C)[C@H](CC1CCCCC1)C(=O)Nc1ccc(-c2nnn[n-]2)cc1 ZINC001136496892 1049695265 /nfs/dbraw/zinc/69/52/65/1049695265.db2.gz SGARXYJHBZIQFH-KRWDZBQOSA-N -1 3 341.459 4.048 20 0 EIADHM CC(C)[C@H](CC1CCCCC1)C(=O)Nc1ccc(-c2nn[n-]n2)cc1 ZINC001136496892 1049695269 /nfs/dbraw/zinc/69/52/69/1049695269.db2.gz SGARXYJHBZIQFH-KRWDZBQOSA-N -1 3 341.459 4.048 20 0 EIADHM COc1ccc(Cl)cc1C(F)(F)C(=O)[N-]C(C)(C)/C=C/Cl ZINC001133744619 1049763003 /nfs/dbraw/zinc/76/30/03/1049763003.db2.gz SAPCDUWPGOJXDT-VOTSOKGWSA-N -1 3 338.181 4.088 20 0 EIADHM Cc1ccccc1C(F)(F)C(=O)[N-][C@@H](C)c1c(F)cccc1F ZINC001133892837 1049809544 /nfs/dbraw/zinc/80/95/44/1049809544.db2.gz XVTGKBQNUQHFBK-NSHDSACASA-N -1 3 325.305 4.242 20 0 EIADHM O=C(OC[C@H]1CC[C@H](c2ccccc2)O1)c1cc(Cl)c(Cl)[n-]1 ZINC000814056477 1049866135 /nfs/dbraw/zinc/86/61/35/1049866135.db2.gz POGKPWQNSNMMNW-BXUZGUMPSA-N -1 3 340.206 4.399 20 0 EIADHM CCc1ccc(C(=O)N2CCS[C@H](C)[C@H]2c2ccccc2)c([O-])c1 ZINC001136790734 1049884385 /nfs/dbraw/zinc/88/43/85/1049884385.db2.gz DDWMMTPNLWTKMP-KUHUBIRLSA-N -1 3 341.476 4.273 20 0 EIADHM CC[C@@H](NCc1ccc(C(=O)[O-])cc1)c1ccccc1OC(F)F ZINC000263561743 1049976744 /nfs/dbraw/zinc/97/67/44/1049976744.db2.gz CIRHLADZXXJUFE-OAHLLOKOSA-N -1 3 335.350 4.227 20 0 EIADHM Cc1cc([N-]S(=O)(=O)c2cccc(F)c2C)c(F)cc1Cl ZINC001185836445 1050169098 /nfs/dbraw/zinc/16/90/98/1050169098.db2.gz MNJWFCPLBYNGFS-UHFFFAOYSA-N -1 3 331.771 4.036 20 0 EIADHM O=C(Nc1nc2c(cccc2[O-])s1)Nc1c(F)cc(F)cc1F ZINC001186003430 1050209343 /nfs/dbraw/zinc/20/93/43/1050209343.db2.gz DFIHTNBYCQVLGC-UHFFFAOYSA-N -1 3 339.298 4.063 20 0 EIADHM CN(C(=O)c1cc(=O)c2ccccc2[n-]1)C1CC(C)(C)CC(C)(C)C1 ZINC000618072103 1050232124 /nfs/dbraw/zinc/23/21/24/1050232124.db2.gz ZQJBURUFHBALRQ-UHFFFAOYSA-N -1 3 340.467 4.205 20 0 EIADHM CC[C@H]([N-]S(=O)(=O)c1c(F)cc(C)cc1F)c1ccc(C)cc1 ZINC001186340400 1050302679 /nfs/dbraw/zinc/30/26/79/1050302679.db2.gz IBZYBZPWDIVYIJ-INIZCTEOSA-N -1 3 339.407 4.011 20 0 EIADHM Cc1c2ccccc2oc1CNCc1cccc([O-])c1Br ZINC001177855413 1050316642 /nfs/dbraw/zinc/31/66/42/1050316642.db2.gz VHOCBKGYFFJYIP-UHFFFAOYSA-N -1 3 346.224 4.499 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-][C@@H]2CCC[C@H]2CCC(C)C)c(F)c1F ZINC001186523875 1050351127 /nfs/dbraw/zinc/35/11/27/1050351127.db2.gz DUQUSSZFXYSGRG-UONOGXRCSA-N -1 3 345.455 4.156 20 0 EIADHM Cc1cc(S(=O)(=O)[N-]C(CC(C)C)CC(C)C)c(F)cc1F ZINC001186666491 1050374942 /nfs/dbraw/zinc/37/49/42/1050374942.db2.gz LHYFQRYPRUWXSW-UHFFFAOYSA-N -1 3 333.444 4.012 20 0 EIADHM C[C@H]1C[C@H]([N-]S(=O)(=O)c2c(Cl)cccc2Cl)C[C@@H](C)C1 ZINC001187164036 1050498731 /nfs/dbraw/zinc/49/87/31/1050498731.db2.gz KEQSWPDFTXLIRV-URLYPYJESA-N -1 3 336.284 4.096 20 0 EIADHM CSc1ccc(NC(=O)[N-]c2cc(-c3ccccn3)no2)cc1 ZINC001188079699 1050693351 /nfs/dbraw/zinc/69/33/51/1050693351.db2.gz GJAALAHXARJYJI-UHFFFAOYSA-N -1 3 326.381 4.103 20 0 EIADHM CCc1ccc([O-])c(C(=O)Nc2c(C)nn(-c3ccccc3)c2C)c1 ZINC000093909825 1050721089 /nfs/dbraw/zinc/72/10/89/1050721089.db2.gz YEHFBQIDUJIVOW-UHFFFAOYSA-N -1 3 335.407 4.009 20 0 EIADHM Cc1ccc(Nc2ccc(C(=O)N3CCCC3)cc2)c(Cl)c1[O-] ZINC001174069300 1050741983 /nfs/dbraw/zinc/74/19/83/1050741983.db2.gz DSAWMLNSDMUPSQ-UHFFFAOYSA-N -1 3 330.815 4.334 20 0 EIADHM O=C(NC1CCCCC1)c1ccc(Nc2c(F)cc([O-])cc2F)cc1 ZINC001174082917 1050757010 /nfs/dbraw/zinc/75/70/10/1050757010.db2.gz UQBHMAGAVWQACM-UHFFFAOYSA-N -1 3 346.377 4.477 20 0 EIADHM CCN(Cc1ccccn1)C(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000152679896 1050826531 /nfs/dbraw/zinc/82/65/31/1050826531.db2.gz BIEYHWHBTJFDSX-UHFFFAOYSA-N -1 3 346.430 4.040 20 0 EIADHM COc1cccc([C@H](C)SCc2noc(-c3ccccc3[O-])n2)c1 ZINC001188952307 1050870664 /nfs/dbraw/zinc/87/06/64/1050870664.db2.gz JOKLDXODTBYAIF-LBPRGKRZSA-N -1 3 342.420 4.445 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-][C@H](C)c2sc3ccccc3c2C)o1 ZINC001188995988 1050882170 /nfs/dbraw/zinc/88/21/70/1050882170.db2.gz YZIAQXARBXGLJS-GFCCVEGCSA-N -1 3 335.450 4.151 20 0 EIADHM [O-]c1cc(NC2=CCCN(Cc3ccccc3)C2)c(F)cc1Cl ZINC001174397099 1050915636 /nfs/dbraw/zinc/91/56/36/1050915636.db2.gz NRPXMRUEAAWMKN-UHFFFAOYSA-N -1 3 332.806 4.386 20 0 EIADHM O=C([N-]c1cc(C2CCCC2)no1)c1cc(-c2cccs2)on1 ZINC001189182847 1050919762 /nfs/dbraw/zinc/91/97/62/1050919762.db2.gz FFNPVSZQADJKNE-UHFFFAOYSA-N -1 3 329.381 4.301 20 0 EIADHM CC(C)(CC1CCCCCC1)[N-]S(=O)(=O)c1cccnc1Cl ZINC001189287877 1050946098 /nfs/dbraw/zinc/94/60/98/1050946098.db2.gz GPPVFCJLGYDQJS-UHFFFAOYSA-N -1 3 344.908 4.152 20 0 EIADHM O=S(=O)([N-]c1cccc(F)c1F)c1ccc(F)c2ccccc21 ZINC001189349243 1050977976 /nfs/dbraw/zinc/97/79/76/1050977976.db2.gz VYGOACDBHLRMMB-UHFFFAOYSA-N -1 3 337.322 4.058 20 0 EIADHM Cc1cc([N-]S(=O)(=O)Cc2cccc(F)c2F)c(F)cc1Cl ZINC001189455936 1050996585 /nfs/dbraw/zinc/99/65/85/1050996585.db2.gz OQYUWXDCSZTBLS-UHFFFAOYSA-N -1 3 349.761 4.008 20 0 EIADHM O=S(=O)(Cc1cccc(F)c1F)[N-]c1cccc2ccccc21 ZINC001189453589 1050996827 /nfs/dbraw/zinc/99/68/27/1050996827.db2.gz TWNMYZNOMSKRQW-UHFFFAOYSA-N -1 3 333.359 4.060 20 0 EIADHM [O-]c1cccc(Nc2cccc(N3CCCC3)c2)c1Br ZINC001174489791 1050998774 /nfs/dbraw/zinc/99/87/74/1050998774.db2.gz NLFSEYIHSKEMOK-UHFFFAOYSA-N -1 3 333.229 4.499 20 0 EIADHM O=C(Nc1ccc(Cl)cc1[O-])c1ccc(F)cc1OC(F)F ZINC000153509933 1051062078 /nfs/dbraw/zinc/06/20/78/1051062078.db2.gz LMECDXUCRTYNPP-UHFFFAOYSA-N -1 3 331.677 4.038 20 0 EIADHM CCc1cccc(C)c1NC(=O)NCc1cc(Cl)c([O-])c(OC)c1 ZINC001190004932 1051101692 /nfs/dbraw/zinc/10/16/92/1051101692.db2.gz RIHPLBZBRHWMNK-UHFFFAOYSA-N -1 3 348.830 4.247 20 0 EIADHM O=C(Nc1cc(F)ccc1[O-])NC1c2ccccc2-c2ccccc21 ZINC001190037215 1051105909 /nfs/dbraw/zinc/10/59/09/1051105909.db2.gz AZVWKHKETDDMSC-UHFFFAOYSA-N -1 3 334.350 4.423 20 0 EIADHM COc1ccc(Nc2cc(Br)cc(F)c2[O-])cc1C ZINC001174835364 1051194723 /nfs/dbraw/zinc/19/47/23/1051194723.db2.gz QBPBDWMPMVRFHP-UHFFFAOYSA-N -1 3 326.165 4.354 20 0 EIADHM CCC[C@H]([N-]S(=O)(=O)c1cc(Cl)ccc1Cl)C(C)(C)C ZINC001190437185 1051186097 /nfs/dbraw/zinc/18/60/97/1051186097.db2.gz DHNBYKBDOFSXES-ZDUSSCGKSA-N -1 3 338.300 4.487 20 0 EIADHM O=C(Nc1ccc(Cl)cc1[O-])c1ccc(F)cc1Br ZINC000153540415 1051190638 /nfs/dbraw/zinc/19/06/38/1051190638.db2.gz HJVBKZYGYLRJMN-UHFFFAOYSA-N -1 3 344.567 4.200 20 0 EIADHM COc1ccc([N-]S(=O)(=O)c2ccc(C3CC3)cc2)cc1Cl ZINC001190501089 1051195737 /nfs/dbraw/zinc/19/57/37/1051195737.db2.gz WESBXHBKJCNXLI-UHFFFAOYSA-N -1 3 337.828 4.027 20 0 EIADHM CC(C)(C)OC(=O)N1CCC(=CNc2cccc(Cl)c2[O-])CC1 ZINC001174847832 1051210269 /nfs/dbraw/zinc/21/02/69/1051210269.db2.gz PCYFPKQINJJJGC-UHFFFAOYSA-N -1 3 338.835 4.372 20 0 EIADHM CN(C[C@@H]1CCc2ccccc21)C(=O)CCCc1ccc([O-])c(F)c1 ZINC000620688092 1051212375 /nfs/dbraw/zinc/21/23/75/1051212375.db2.gz WIKFQTXBHHXLIC-KRWDZBQOSA-N -1 3 341.426 4.042 20 0 EIADHM COc1ccc(S(=O)(=O)[N-]c2ccccc2C(C)(C)C)c(C)c1 ZINC000096659402 1051215096 /nfs/dbraw/zinc/21/50/96/1051215096.db2.gz VUMLATHPTUZELD-UHFFFAOYSA-N -1 3 333.453 4.102 20 0 EIADHM CCCCCc1ccc([N-]S(=O)(=O)c2ccc(C)c(N)c2)cc1 ZINC001175013795 1051297202 /nfs/dbraw/zinc/29/72/02/1051297202.db2.gz SSUOXZIIJNCIOP-UHFFFAOYSA-N -1 3 332.469 4.111 20 0 EIADHM COc1ccc(C(C)=O)c(Nc2c(F)cc([O-])cc2F)c1Cl ZINC001175099511 1051344817 /nfs/dbraw/zinc/34/48/17/1051344817.db2.gz KKKPWQSXNWXBBF-UHFFFAOYSA-N -1 3 327.714 4.279 20 0 EIADHM CNc1ccc(Br)cc1Nc1c(F)cc([O-])cc1F ZINC001175102343 1051350238 /nfs/dbraw/zinc/35/02/38/1051350238.db2.gz JPNRSRSBARWGLO-UHFFFAOYSA-N -1 3 329.144 4.218 20 0 EIADHM COc1ccc(Nc2cc(=O)n(-c3ccccc3)[n-]2)cc1C(F)(F)F ZINC001175071124 1051360978 /nfs/dbraw/zinc/36/09/78/1051360978.db2.gz HZKAMAILGAALIA-UHFFFAOYSA-N -1 3 349.312 4.349 20 0 EIADHM O=C(CCSc1cccc(Cl)c1)[N-]OCCCC(F)(F)F ZINC001175285162 1051484662 /nfs/dbraw/zinc/48/46/62/1051484662.db2.gz YPOYFTKOJBCDRM-UHFFFAOYSA-N -1 3 341.782 4.213 20 0 EIADHM COc1cc(Br)cc(C)c1Nc1c(F)ccc([O-])c1F ZINC001175268133 1051504609 /nfs/dbraw/zinc/50/46/09/1051504609.db2.gz INAVGTHRVZNZNF-UHFFFAOYSA-N -1 3 344.155 4.494 20 0 EIADHM COc1cc(Nc2c(F)ccc([O-])c2F)c(Br)cc1C ZINC001175268188 1051505092 /nfs/dbraw/zinc/50/50/92/1051505092.db2.gz JRIQQMLCQOFTMI-UHFFFAOYSA-N -1 3 344.155 4.494 20 0 EIADHM COc1cc(F)cc(Br)c1Nc1c(F)ccc([O-])c1F ZINC001175269779 1051507475 /nfs/dbraw/zinc/50/74/75/1051507475.db2.gz KZIOKIAANJMBOQ-UHFFFAOYSA-N -1 3 348.118 4.324 20 0 EIADHM [O-]c1ccc(F)c(Nc2c(F)cccc2OC[C@@H]2CCCO2)c1F ZINC001175270887 1051509017 /nfs/dbraw/zinc/50/90/17/1051509017.db2.gz NCNOFLHFISJNRO-JTQLQIEISA-N -1 3 339.313 4.111 20 0 EIADHM O=C(Nc1ccc(F)c([O-])c1)[C@@H]1C[C@@H]1c1ccccc1C(F)(F)F ZINC001182363105 1051525335 /nfs/dbraw/zinc/52/53/35/1051525335.db2.gz LKQPRKZMBFBFJY-VXGBXAGGSA-N -1 3 339.288 4.292 20 0 EIADHM Cc1noc(C2CC2)c1[N-]C(=O)c1csc(-c2ccccc2)n1 ZINC000156730919 1051559918 /nfs/dbraw/zinc/55/99/18/1051559918.db2.gz XDFBQQAOWQSSNW-UHFFFAOYSA-N -1 3 325.393 4.236 20 0 EIADHM COc1cc(Nc2cc(Br)cc(F)c2[O-])ccc1F ZINC001175399718 1051572522 /nfs/dbraw/zinc/57/25/22/1051572522.db2.gz NNYBZBARAYUXPE-UHFFFAOYSA-N -1 3 330.128 4.185 20 0 EIADHM O=C(Nc1ccc(OC(F)F)cc1)Nc1cc([O-])cc(Cl)c1 ZINC001192181664 1051659921 /nfs/dbraw/zinc/65/99/21/1051659921.db2.gz FLYCSMYCUFQHDC-UHFFFAOYSA-N -1 3 328.702 4.291 20 0 EIADHM [O-]c1cc(Br)cnc1CN1CCC2(CCCCC2)CC1 ZINC001182796636 1051699852 /nfs/dbraw/zinc/69/98/52/1051699852.db2.gz XHOLGIZEBRAWLI-UHFFFAOYSA-N -1 3 339.277 4.096 20 0 EIADHM Cc1cc(NC(=O)Nc2c([O-])cccc2Br)ccc1F ZINC001192391046 1051721299 /nfs/dbraw/zinc/72/12/99/1051721299.db2.gz AVMUHCKINTZJKG-UHFFFAOYSA-N -1 3 339.164 4.246 20 0 EIADHM CC(C)(C)Cc1cc([N-]C(=O)C(F)(F)c2ccc(F)cc2)on1 ZINC001182884832 1051731346 /nfs/dbraw/zinc/73/13/46/1051731346.db2.gz BXPJVYOQFNABQU-UHFFFAOYSA-N -1 3 326.318 4.133 20 0 EIADHM O=c1cc(Nc2ccc(-c3cccnc3)cc2)[n-]n1-c1ccccc1 ZINC001175888644 1051816454 /nfs/dbraw/zinc/81/64/54/1051816454.db2.gz YXJAKLJMYSMWNE-UHFFFAOYSA-N -1 3 328.375 4.384 20 0 EIADHM C[C@@H](CC1CCCC1)C(=O)Nc1n[n-]c(-c2cc3ccccc3o2)n1 ZINC001183367778 1051836013 /nfs/dbraw/zinc/83/60/13/1051836013.db2.gz KPBDWKUFBYSYQD-LBPRGKRZSA-N -1 3 338.411 4.373 20 0 EIADHM C[C@@H]1CCCN(Cc2nnc(-c3ccccc3[O-])o2)c2ccccc21 ZINC001193198680 1051885434 /nfs/dbraw/zinc/88/54/34/1051885434.db2.gz SRTQIALQHAAWAS-CQSZACIVSA-N -1 3 335.407 4.346 20 0 EIADHM CC(=O)c1cccc(NC(=O)c2ccc([O-])cc2C(F)(F)F)c1C ZINC001193748098 1051992837 /nfs/dbraw/zinc/99/28/37/1051992837.db2.gz PKKPIWWYPUZKTK-UHFFFAOYSA-N -1 3 337.297 4.174 20 0 EIADHM CCCCOc1ccc(C(=O)NCc2cc(Cl)ccc2C)c([O-])c1 ZINC001184406511 1052002607 /nfs/dbraw/zinc/00/26/07/1052002607.db2.gz SOZAHYRDYXTRDD-UHFFFAOYSA-N -1 3 347.842 4.463 20 0 EIADHM O=C(Nc1cccc(-c2nc3ccccc3o2)c1)c1c([O-])cccc1O ZINC001184450600 1052014879 /nfs/dbraw/zinc/01/48/79/1052014879.db2.gz LNSCYOVEIHFWIA-UHFFFAOYSA-N -1 3 346.342 4.158 20 0 EIADHM Cc1cc(O)cc([O-])c1C(=O)N(C)C(c1ccccc1)c1ccccc1 ZINC001193911146 1052027444 /nfs/dbraw/zinc/02/74/44/1052027444.db2.gz IEDPTJNTJNPMPL-UHFFFAOYSA-N -1 3 347.414 4.268 20 0 EIADHM Cc1cc(O)cc([O-])c1C(=O)NC1c2ccccc2Oc2ccccc21 ZINC001193945317 1052044549 /nfs/dbraw/zinc/04/45/49/1052044549.db2.gz BWKMTNJATQENOK-UHFFFAOYSA-N -1 3 347.370 4.031 20 0 EIADHM Cc1cc(O)cc([O-])c1C(=O)NCc1cccc(-c2cccs2)c1 ZINC001193945673 1052044966 /nfs/dbraw/zinc/04/49/66/1052044966.db2.gz HRURYXFUWCIFKT-UHFFFAOYSA-N -1 3 339.416 4.065 20 0 EIADHM Cc1cc2cc(CN[C@@H](CC(=O)[O-])c3cccs3)oc2cc1C ZINC000671162271 1052075060 /nfs/dbraw/zinc/07/50/60/1052075060.db2.gz SMLKWUGJWMFEME-HNNXBMFYSA-N -1 3 329.421 4.417 20 0 EIADHM O=C(c1cc([O-])cc(C(F)(F)F)c1)N1CCC(c2ccco2)CC1 ZINC000622136456 1052128047 /nfs/dbraw/zinc/12/80/47/1052128047.db2.gz DJTZFCHRUDDIQM-UHFFFAOYSA-N -1 3 339.313 4.024 20 0 EIADHM O=C([N-]c1n[nH]c(C2CCC2)n1)c1sc2ccccc2c1Cl ZINC000184646012 1052130080 /nfs/dbraw/zinc/13/00/80/1052130080.db2.gz VHCBPIMCZLKGLK-UHFFFAOYSA-N -1 3 332.816 4.193 20 0 EIADHM O=c1cc(Nc2ccc(OC(F)(F)F)cc2)[n-]n1-c1ccccc1 ZINC001176641047 1052150698 /nfs/dbraw/zinc/15/06/98/1052150698.db2.gz BOVCBGKPRAFFDV-UHFFFAOYSA-N -1 3 335.285 4.220 20 0 EIADHM O=C(Nc1ccc(F)c(F)c1)Nc1ccc(Br)cc1[O-] ZINC001185090266 1052164854 /nfs/dbraw/zinc/16/48/54/1052164854.db2.gz TUTZCLWBFYOHRH-UHFFFAOYSA-N -1 3 343.127 4.077 20 0 EIADHM COc1ccc(OC(=O)Nc2cc(C(F)(F)F)ccc2[O-])cc1 ZINC001194534429 1052165146 /nfs/dbraw/zinc/16/51/46/1052165146.db2.gz CKJSTKKXGSKKKX-UHFFFAOYSA-N -1 3 327.258 4.031 20 0 EIADHM COCOc1ccc(F)cc1Nc1cccc([O-])c1Br ZINC001176722951 1052173098 /nfs/dbraw/zinc/17/30/98/1052173098.db2.gz KGQWYTBMZBESLC-UHFFFAOYSA-N -1 3 342.164 4.020 20 0 EIADHM Cc1cccc(C)c1S(=O)(=O)[N-]c1ccc(Cl)c(F)c1F ZINC001194638061 1052184236 /nfs/dbraw/zinc/18/42/36/1052184236.db2.gz GHTGJGXBPRYANK-UHFFFAOYSA-N -1 3 331.771 4.036 20 0 EIADHM CC(C)(C)C[C@@H]1CCCN1C(=O)c1cc([O-])cc(C(F)(F)F)c1 ZINC000622337238 1052215046 /nfs/dbraw/zinc/21/50/46/1052215046.db2.gz QSFLQZAENKSIGM-ZDUSSCGKSA-N -1 3 329.362 4.452 20 0 EIADHM CCN(Cc1c(F)cccc1F)C(=O)c1ccc(C(C)C)cc1[O-] ZINC000622344542 1052219229 /nfs/dbraw/zinc/21/92/29/1052219229.db2.gz VVLPGWDVRGCELW-UHFFFAOYSA-N -1 3 333.378 4.456 20 0 EIADHM CCc1ccc([O-])c(C(=O)N(C)[C@H](C)Cc2ccc(Cl)cc2)c1 ZINC000622382265 1052238168 /nfs/dbraw/zinc/23/81/68/1052238168.db2.gz OZXXTANWDBHZGY-CYBMUJFWSA-N -1 3 331.843 4.311 20 0 EIADHM CC[C@H](Cc1ccc(C)cc1)N(C)C(=O)c1cc([O-])ccc1Cl ZINC000622396363 1052251874 /nfs/dbraw/zinc/25/18/74/1052251874.db2.gz IULIBGPBHUBTIH-OAHLLOKOSA-N -1 3 331.843 4.447 20 0 EIADHM Cc1cccc([C@H](NC(=O)Cc2ccc([O-])c(F)c2)C(C)(C)C)c1 ZINC000622415219 1052254952 /nfs/dbraw/zinc/25/49/52/1052254952.db2.gz XIPPPTQQCSJVFU-IBGZPJMESA-N -1 3 329.415 4.286 20 0 EIADHM Cc1c(NC(=O)Cc2ccc([O-])c(F)c2)cccc1C(F)(F)F ZINC000622436608 1052269710 /nfs/dbraw/zinc/26/97/10/1052269710.db2.gz AKOGHITYDFJRRU-UHFFFAOYSA-N -1 3 327.277 4.040 20 0 EIADHM Cc1ccc([O-])c(C(=O)Nc2cccc(Cl)c2OCC(F)F)c1 ZINC000622602211 1052344552 /nfs/dbraw/zinc/34/45/52/1052344552.db2.gz YAPWBDZNZKLVQA-UHFFFAOYSA-N -1 3 341.741 4.250 20 0 EIADHM CCc1cccc(C(=O)N2CCC[C@@H]2c2ccc(F)cc2C)c1[O-] ZINC000622667622 1052371816 /nfs/dbraw/zinc/37/18/16/1052371816.db2.gz MXAQYOLYVQQMQO-GOSISDBHSA-N -1 3 327.399 4.379 20 0 EIADHM Cc1ccc(CC(C)(C)NC(=O)CCCc2ccc([O-])c(F)c2)cc1 ZINC000622720836 1052394091 /nfs/dbraw/zinc/39/40/91/1052394091.db2.gz PYXFWZYMBZWVIB-UHFFFAOYSA-N -1 3 343.442 4.300 20 0 EIADHM COc1ccc2c(c1)C[C@H](C(C)C)CN2C(=O)c1ccc(C)cc1[O-] ZINC000622728566 1052396646 /nfs/dbraw/zinc/39/66/46/1052396646.db2.gz FNIPOVRSJFIZDY-INIZCTEOSA-N -1 3 339.435 4.184 20 0 EIADHM C[C@H](NC(=O)c1cc([O-])cc(C(F)(F)F)c1)C1CCC(F)CC1 ZINC000622752393 1052429194 /nfs/dbraw/zinc/42/91/94/1052429194.db2.gz BDDJWEWPQMSVCA-JBLZRFIASA-N -1 3 333.325 4.058 20 0 EIADHM CCCC[C@H](C(=O)Nc1ccc(-c2nc(C)cc(=O)[n-]2)cc1)C(C)C ZINC000622790686 1052447680 /nfs/dbraw/zinc/44/76/80/1052447680.db2.gz YGRXVQMDRMVONO-KRWDZBQOSA-N -1 3 341.455 4.146 20 0 EIADHM O=C(Nc1cc(F)ccc1[O-])c1ccc(Br)cc1Cl ZINC000174901487 1052577064 /nfs/dbraw/zinc/57/70/64/1052577064.db2.gz IONXJACZNWDMKH-UHFFFAOYSA-N -1 3 344.567 4.200 20 0 EIADHM CC[C@]1(C(=O)[O-])CCCN(Cc2ncc(-c3cccc(Cl)c3)o2)C1 ZINC000325066609 1052638606 /nfs/dbraw/zinc/63/86/06/1052638606.db2.gz ZFTLXOJRTLMFLM-SFHVURJKSA-N -1 3 348.830 4.072 20 0 EIADHM O=C(Cc1ccc(Br)s1)Nc1ccc(Cl)cc1[O-] ZINC000179641529 1052746076 /nfs/dbraw/zinc/74/60/76/1052746076.db2.gz BYAXBLMVDIXSRM-UHFFFAOYSA-N -1 3 346.633 4.051 20 0 EIADHM O=C(Nc1ccccc1Oc1ccccc1)c1cccc2n[n-]nc21 ZINC000183328898 1052971324 /nfs/dbraw/zinc/97/13/24/1052971324.db2.gz ZFFKZGMAKQRPSQ-UHFFFAOYSA-N -1 3 330.347 4.003 20 0 EIADHM CCN(CCOc1ccccc1C(=O)[O-])Cc1ccc(Cl)s1 ZINC000183911228 1052986744 /nfs/dbraw/zinc/98/67/44/1052986744.db2.gz LMOBWFGTHIDJIM-UHFFFAOYSA-N -1 3 339.844 4.001 20 0 EIADHM COc1ccccc1C[C@H](C)N(C)Cc1cccc(C(=O)[O-])c1Cl ZINC000381474695 1053077609 /nfs/dbraw/zinc/07/76/09/1053077609.db2.gz CZEHDMWMPASDFM-ZDUSSCGKSA-N -1 3 347.842 4.110 20 0 EIADHM COC(=O)c1ccc(NCc2c(F)ccc([O-])c2F)c2ccccc12 ZINC000864017674 1053146672 /nfs/dbraw/zinc/14/66/72/1053146672.db2.gz XEMRHAVZUMDTGD-UHFFFAOYSA-N -1 3 343.329 4.222 20 0 EIADHM O=C([O-])c1coc(CN2CCC(Cc3ccccc3Cl)CC2)c1 ZINC000864362152 1053253673 /nfs/dbraw/zinc/25/36/73/1053253673.db2.gz ZRDVOMRJTXJVKY-UHFFFAOYSA-N -1 3 333.815 4.086 20 0 EIADHM CC(C)c1cccc(S(=O)(=O)[N-]c2ccnc(C3CCC3)c2)c1 ZINC001195120376 1053279630 /nfs/dbraw/zinc/27/96/30/1053279630.db2.gz GVUXMDJLRFOYBI-UHFFFAOYSA-N -1 3 330.453 4.273 20 0 EIADHM CC(C)(C)Oc1cccc(CN[C@H](CC(=O)[O-])c2ccsc2)c1 ZINC000864504665 1053295593 /nfs/dbraw/zinc/29/55/93/1053295593.db2.gz XACGJHGTZSMCPR-MRXNPFEDSA-N -1 3 333.453 4.231 20 0 EIADHM O=C([N-]c1cc(Cl)nnc1Cl)c1sccc1C(F)(F)F ZINC001195206230 1053329291 /nfs/dbraw/zinc/32/92/91/1053329291.db2.gz JPELUXDEKFEVPZ-UHFFFAOYSA-N -1 3 342.129 4.116 20 0 EIADHM COc1ccccc1OC(=O)Nc1cc(C(F)(F)F)ccc1[O-] ZINC001195264747 1053350733 /nfs/dbraw/zinc/35/07/33/1053350733.db2.gz KAFREWGCQNSQRR-UHFFFAOYSA-N -1 3 327.258 4.031 20 0 EIADHM CCCc1cc(=O)[n-]c(C(=Cc2cccnc2Br)CC)n1 ZINC000865223239 1053445343 /nfs/dbraw/zinc/44/53/43/1053445343.db2.gz GDLJLVZGSLVTJT-LUAWRHEFSA-N -1 3 348.244 4.243 20 0 EIADHM [O-]c1ccc(NC(=S)Nc2ccccc2F)cc1Br ZINC001195773672 1053476877 /nfs/dbraw/zinc/47/68/77/1053476877.db2.gz XAGGONXIWDQSRO-UHFFFAOYSA-N -1 3 341.205 4.103 20 0 EIADHM [O-]c1cccc(Br)c1NC(=S)Nc1ccccc1F ZINC001195776310 1053483391 /nfs/dbraw/zinc/48/33/91/1053483391.db2.gz PFSFUKJYHGOEMX-UHFFFAOYSA-N -1 3 341.205 4.103 20 0 EIADHM CCC[C@@H](O)CCCSCc1nc2c3ccccc3oc2c(=O)[n-]1 ZINC000865382734 1053487428 /nfs/dbraw/zinc/48/74/28/1053487428.db2.gz WBFYCQFLEGJXKW-GFCCVEGCSA-N -1 3 346.452 4.256 20 0 EIADHM C[C@H](NCc1cc(=O)oc2cc([O-])ccc12)c1ccccc1Cl ZINC000008172828 1053543911 /nfs/dbraw/zinc/54/39/11/1053543911.db2.gz KTLZJBYCKIBNCZ-NSHDSACASA-N -1 3 329.783 4.003 20 0 EIADHM COc1ccc([O-])c(C(=O)Nc2cc(-c3ccncc3)ccc2C)c1 ZINC000101847758 1053598505 /nfs/dbraw/zinc/59/85/05/1053598505.db2.gz RWXVTALVYZWNHQ-UHFFFAOYSA-N -1 3 334.375 4.024 20 0 EIADHM O=C(NCCCOC1CCCCC1)c1cc([O-])c2ccccc2c1 ZINC000471628177 1053673182 /nfs/dbraw/zinc/67/31/82/1053673182.db2.gz YBEGTDZMASHNTH-UHFFFAOYSA-N -1 3 327.424 4.015 20 0 EIADHM O=c1nc(Cl)cc(Sc2nc(C3CCCCC3)cs2)[n-]1 ZINC000866295447 1053680777 /nfs/dbraw/zinc/68/07/77/1053680777.db2.gz BXCFSHMCNZBBDG-UHFFFAOYSA-N -1 3 327.862 4.491 20 0 EIADHM [O-]c1cccc(C(F)(F)F)c1NC(=S)NCc1ccc(F)cc1 ZINC001196494202 1053692861 /nfs/dbraw/zinc/69/28/61/1053692861.db2.gz NHQOSYMNXVXDIO-UHFFFAOYSA-N -1 3 344.333 4.037 20 0 EIADHM O=C([N-]c1nncs1)c1ccc(-c2nc3ccccc3s2)s1 ZINC000021214135 1053731694 /nfs/dbraw/zinc/73/16/94/1053731694.db2.gz OBQBPUNOXAXSLO-UHFFFAOYSA-N -1 3 344.446 4.129 20 0 EIADHM O=c1ccnc(C=Cc2ccc(Br)cc2C(F)(F)F)[n-]1 ZINC000794943351 1053816700 /nfs/dbraw/zinc/81/67/00/1053816700.db2.gz XTHVVBSLIGGOFH-RQOWECAXSA-N -1 3 345.118 4.134 20 0 EIADHM O=S(=O)(Cc1c(F)cccc1F)[N-]c1cccc2ccccc21 ZINC001197601236 1053955365 /nfs/dbraw/zinc/95/53/65/1053955365.db2.gz YIMIXSQZQVQUPY-UHFFFAOYSA-N -1 3 333.359 4.060 20 0 EIADHM Cc1cc(C)c(NC(=O)c2cc(OCc3ccccc3)ccc2[O-])cn1 ZINC001197707770 1053977974 /nfs/dbraw/zinc/97/79/74/1053977974.db2.gz PELHPPQINJTTBQ-UHFFFAOYSA-N -1 3 348.402 4.235 20 0 EIADHM Cc1ccc([N-]S(=O)(=O)c2ccc(OC(F)F)c(Cl)c2)cc1 ZINC000032585565 1054108066 /nfs/dbraw/zinc/10/80/66/1054108066.db2.gz RSPNVVMCYMVCBQ-UHFFFAOYSA-N -1 3 347.770 4.051 20 0 EIADHM O=C(NCc1cccc(COCc2ccccc2)c1)c1ccccc1[O-] ZINC000032739019 1054112701 /nfs/dbraw/zinc/11/27/01/1054112701.db2.gz WQOUEWZUNMLICA-UHFFFAOYSA-N -1 3 347.414 4.039 20 0 EIADHM C=CS(=O)(=O)[N-]c1csc(C(F)(F)F)c1-c1ccccc1 ZINC001198570005 1054186943 /nfs/dbraw/zinc/18/69/43/1054186943.db2.gz RIZZZPPNPCALHH-UHFFFAOYSA-N -1 3 333.356 4.319 20 0 EIADHM Cc1ccc(NC(=S)Nc2ccc(N(C)C)cc2)c(Cl)c1[O-] ZINC001198762268 1054254865 /nfs/dbraw/zinc/25/48/65/1054254865.db2.gz DCFRDOHRPPNYGT-UHFFFAOYSA-N -1 3 335.860 4.229 20 0 EIADHM CON(Cc1ccccc1Cl)C(=O)c1ccc(C(C)C)cc1[O-] ZINC000857514586 1054292821 /nfs/dbraw/zinc/29/28/21/1054292821.db2.gz RKNAJTDAQWBONL-UHFFFAOYSA-N -1 3 333.815 4.373 20 0 EIADHM O=C(OCc1cc(-c2cccs2)on1)c1cc(Cl)c(Cl)[n-]1 ZINC000011810484 1054320692 /nfs/dbraw/zinc/32/06/92/1054320692.db2.gz KXABXIPOSNBCED-UHFFFAOYSA-N -1 3 343.191 4.395 20 0 EIADHM C[C@@H]1CCN(C(=O)c2cc([O-])c3ccccc3c2)c2c(O)cccc21 ZINC000472499480 1054334065 /nfs/dbraw/zinc/33/40/65/1054334065.db2.gz MEVVIODPLKWOTD-CYBMUJFWSA-N -1 3 333.387 4.405 20 0 EIADHM C[C@@H](OC(=O)c1cccc(Cl)c1[O-])c1nc(-c2ccccc2)no1 ZINC000775934303 1054338280 /nfs/dbraw/zinc/33/82/80/1054338280.db2.gz MCLLVBUFUIDHNK-SNVBAGLBSA-N -1 3 344.754 4.014 20 0 EIADHM C[C@H](Nc1ccc(OC[C@H]2CCCO2)cc1)c1cccc([O-])c1F ZINC000872055817 1054366132 /nfs/dbraw/zinc/36/61/32/1054366132.db2.gz LHBTWPCLQUBBLG-XJKSGUPXSA-N -1 3 331.387 4.262 20 0 EIADHM C[C@@H](NCc1ccccc1N1CCCCC1)c1cccc([O-])c1F ZINC000872060592 1054370089 /nfs/dbraw/zinc/37/00/89/1054370089.db2.gz RQTLLLWAWKSDME-OAHLLOKOSA-N -1 3 328.431 4.372 20 0 EIADHM C[C@@H](NCc1c(F)cccc1N1CCCC1)c1cccc([O-])c1F ZINC000872070188 1054376320 /nfs/dbraw/zinc/37/63/20/1054376320.db2.gz SGEFYWDHOLJVKQ-CYBMUJFWSA-N -1 3 332.394 4.121 20 0 EIADHM Cc1ccc(C)c(OC2CCN(Cc3cc(C(=O)[O-])cs3)CC2)c1 ZINC000872158088 1054412933 /nfs/dbraw/zinc/41/29/33/1054412933.db2.gz ZVKMNSJTBIOBLA-UHFFFAOYSA-N -1 3 345.464 4.107 20 0 EIADHM Cc1cc([C@H](C)N2CCC(c3cccc(F)c3)CC2)oc1C(=O)[O-] ZINC000872165931 1054418189 /nfs/dbraw/zinc/41/81/89/1054418189.db2.gz OUJCMHQFLQSTBA-ZDUSSCGKSA-N -1 3 331.387 4.366 20 0 EIADHM O=C([O-])[C@]12CCC[C@H]1N(Cc1nc(C3CCCCC3)cs1)CC2 ZINC000872168081 1054421049 /nfs/dbraw/zinc/42/10/49/1054421049.db2.gz PDCJAOBSCUAPMV-QAPCUYQASA-N -1 3 334.485 4.020 20 0 EIADHM Cc1cc(C)c(S(=O)(=O)[N-]c2cccc(-c3cnco3)c2)c(C)c1 ZINC000057119322 1054501882 /nfs/dbraw/zinc/50/18/82/1054501882.db2.gz BZDQPDBCPGQNSI-UHFFFAOYSA-N -1 3 342.420 4.068 20 0 EIADHM Cc1sc2[n-]c([C@@H](C)OC(=O)C3CCC=CCC3)nc(=O)c2c1C ZINC000873428680 1054538381 /nfs/dbraw/zinc/53/83/81/1054538381.db2.gz JFYGYAKQASVPID-LLVKDONJSA-N -1 3 346.452 4.364 20 0 EIADHM CCCCCCNC(=S)Nc1c([O-])cccc1Br ZINC001200955016 1054605627 /nfs/dbraw/zinc/60/56/27/1054605627.db2.gz TVKKWVYWKXQZAE-UHFFFAOYSA-N -1 3 331.279 4.021 20 0 EIADHM CCCCc1nnc([N-]C(=O)c2c(C)occ2C(F)(F)F)s1 ZINC000874134767 1054629216 /nfs/dbraw/zinc/62/92/16/1054629216.db2.gz NBFUMESTPTYDCA-UHFFFAOYSA-N -1 3 333.335 4.053 20 0 EIADHM CN(Cc1ccc(C(C)(C)C)cc1)C(=O)c1cc(=O)c2ccccc2[n-]1 ZINC000061205541 1054747356 /nfs/dbraw/zinc/74/73/56/1054747356.db2.gz WGUMTFJGTZOCMW-UHFFFAOYSA-N -1 3 348.446 4.098 20 0 EIADHM COc1cc(OC(F)(F)F)ccc1Nc1c(F)cc([O-])cc1F ZINC001201362405 1054760880 /nfs/dbraw/zinc/76/08/80/1054760880.db2.gz JWQKXZBHAGMQBD-UHFFFAOYSA-N -1 3 335.228 4.321 20 0 EIADHM Cc1ccc(CCN(Cc2ccco2)C(=O)c2ccc(C)cc2[O-])cc1 ZINC001137092776 1054810779 /nfs/dbraw/zinc/81/07/79/1054810779.db2.gz GSVIIGWHVQGYEU-UHFFFAOYSA-N -1 3 349.430 4.487 20 0 EIADHM C[C@@H]1CCc2c(sc3[n-]c(CO[C@H]4CCCC[C@@H]4C)nc(=O)c23)C1 ZINC000063579551 1054816654 /nfs/dbraw/zinc/81/66/54/1054816654.db2.gz LTJMOYYHCORYSH-DYEKYZERSA-N -1 3 346.496 4.205 20 0 EIADHM Cc1nc(-c2ccc(NC(=O)Nc3cccc(C)c3C)cc2)cc(=O)[n-]1 ZINC000339032109 1055004080 /nfs/dbraw/zinc/00/40/80/1055004080.db2.gz WLEXDUILGGDPOV-UHFFFAOYSA-N -1 3 348.406 4.418 20 0 EIADHM O=C(Nc1ncc([O-])cc1Cl)Nc1c(Cl)cccc1Cl ZINC001202095550 1055031165 /nfs/dbraw/zinc/03/11/65/1055031165.db2.gz OFSHCSZWALOHGG-UHFFFAOYSA-N -1 3 332.574 4.391 20 0 EIADHM CC(C)(C)c1ncc(C(=O)[N-]c2nnc(-c3ccccc3)s2)s1 ZINC000067477519 1055038168 /nfs/dbraw/zinc/03/81/68/1055038168.db2.gz ZCUNHXGQGYUQID-UHFFFAOYSA-N -1 3 344.465 4.211 20 0 EIADHM CC1(C)[C@H](c2cccc(Cl)c2)CCN1C(=O)c1ccc(N)cc1[O-] ZINC000877427867 1055052196 /nfs/dbraw/zinc/05/21/96/1055052196.db2.gz QEFWZZLUUKENKS-INIZCTEOSA-N -1 3 344.842 4.036 20 0 EIADHM O=C(Nc1ccccc1C(F)(F)F)Nc1ncc([O-])cc1Cl ZINC001202160125 1055061942 /nfs/dbraw/zinc/06/19/42/1055061942.db2.gz XLKWSQIDRIURQQ-UHFFFAOYSA-N -1 3 331.681 4.103 20 0 EIADHM Cc1ccccc1NC(=O)Nc1cc(Br)c(C)cc1[O-] ZINC001202185394 1055073883 /nfs/dbraw/zinc/07/38/83/1055073883.db2.gz VZULQZPTUYQMJA-UHFFFAOYSA-N -1 3 335.201 4.416 20 0 EIADHM CC(=O)c1cccc(NC(=O)Nc2ccc(Br)cc2)c1[O-] ZINC001202332713 1055142468 /nfs/dbraw/zinc/14/24/68/1055142468.db2.gz CBOCTOOIFBKQGC-UHFFFAOYSA-N -1 3 349.184 4.001 20 0 EIADHM CCN(Cc1ccc(Cl)s1)Cc1nnc(-c2ccccc2[O-])o1 ZINC000877902689 1055147823 /nfs/dbraw/zinc/14/78/23/1055147823.db2.gz FAMWGJLFMDXOAP-UHFFFAOYSA-N -1 3 349.843 4.179 20 0 EIADHM O=C(Nc1ccc(Cl)cc1)Nc1ccc(Br)cc1[O-] ZINC001202374114 1055155461 /nfs/dbraw/zinc/15/54/61/1055155461.db2.gz APWUUESTQMDMQU-UHFFFAOYSA-N -1 3 341.592 4.452 20 0 EIADHM CC[C@H]1c2ccsc2CCN1Cc1nnc(-c2ccccc2[O-])o1 ZINC000877966515 1055163178 /nfs/dbraw/zinc/16/31/78/1055163178.db2.gz NGPVMKSXOIQTND-AWEZNQCLSA-N -1 3 341.436 4.013 20 0 EIADHM Cc1ccnc(N[C@H](C)c2cc(Br)cc(F)c2[O-])c1 ZINC000186242878 1055263861 /nfs/dbraw/zinc/26/38/61/1055263861.db2.gz BXPIDKIZVAIVFV-SECBINFHSA-N -1 3 325.181 4.170 20 0 EIADHM [O-]c1ccccc1-c1nnc(CN[C@H](CC2CC2)c2ccccc2)o1 ZINC000878363537 1055269199 /nfs/dbraw/zinc/26/91/99/1055269199.db2.gz CXEOYYPHGINSHO-QGZVFWFLSA-N -1 3 335.407 4.073 20 0 EIADHM CC[C@@H](NCc1nnc(-c2ccccc2[O-])o1)c1ccc(Cl)s1 ZINC000878410199 1055296676 /nfs/dbraw/zinc/29/66/76/1055296676.db2.gz SMNWIJKXIWGNHT-LLVKDONJSA-N -1 3 349.843 4.398 20 0 EIADHM CC1(C)CN(Cc2nnc(-c3ccccc3[O-])o2)[C@H]1c1cccs1 ZINC000878621323 1055360616 /nfs/dbraw/zinc/36/06/16/1055360616.db2.gz KGLLXXXRIRRRRA-INIZCTEOSA-N -1 3 341.436 4.087 20 0 EIADHM COc1ccc2c(c1)[C@@H](C(=O)Nc1c([O-])cccc1Cl)CCC2 ZINC000655110410 1055477770 /nfs/dbraw/zinc/47/77/70/1055477770.db2.gz QZOSEJAECRQLSU-ZDUSSCGKSA-N -1 3 331.799 4.113 20 0 EIADHM CCC(CC)c1cc(C(=O)[N-]c2csc(-c3ccccn3)n2)on1 ZINC000542781505 1055982915 /nfs/dbraw/zinc/98/29/15/1055982915.db2.gz JVWLIIAOWDVFEB-UHFFFAOYSA-N -1 3 342.424 4.349 20 0 EIADHM CC(C)C[C@@H]1CCN(Cc2ccc(C(=O)[O-])cc2Br)C1 ZINC000307820373 1056736427 /nfs/dbraw/zinc/73/64/27/1056736427.db2.gz POABZCIBEGQQLL-LBPRGKRZSA-N -1 3 340.261 4.015 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2ccc(OC(F)(F)F)cc2)cc1C ZINC000007055978 1056762005 /nfs/dbraw/zinc/76/20/05/1056762005.db2.gz OAYHRJZVECWDJB-UHFFFAOYSA-N -1 3 345.342 4.003 20 0 EIADHM O=C(Nc1cc(Br)ccc1[O-])c1ccc2[nH]ccc2c1F ZINC001155416876 1058873533 /nfs/dbraw/zinc/87/35/33/1058873533.db2.gz ZBGCFOZESWORBE-UHFFFAOYSA-N -1 3 349.159 4.027 20 0 EIADHM Cn1c(C(=O)Nc2cc(Cl)ccc2[O-])ccc1-c1ccccc1 ZINC000743316695 1058922698 /nfs/dbraw/zinc/92/26/98/1058922698.db2.gz GSTBHMLINKYQMG-UHFFFAOYSA-N -1 3 326.783 4.303 20 0 EIADHM CCc1ccc(C(=O)Oc2cccc(-c3nc(C)cc(=O)[n-]3)c2)s1 ZINC000744218440 1059334332 /nfs/dbraw/zinc/33/43/32/1059334332.db2.gz ZTAIIFBJDNXSAX-UHFFFAOYSA-N -1 3 340.404 4.001 20 0 EIADHM CSc1ccc(F)cc1C[N-]C(=O)C(F)(F)c1ccc(F)cc1 ZINC000744683050 1059610065 /nfs/dbraw/zinc/61/00/65/1059610065.db2.gz FRIONHGDYLLIEZ-UHFFFAOYSA-N -1 3 343.345 4.095 20 0 EIADHM Cc1sc2[n-]c([C@H](C)OC(=O)[C@@H](C)c3ccco3)nc(=O)c2c1C ZINC000745134099 1059740466 /nfs/dbraw/zinc/74/04/66/1059740466.db2.gz ZAYCZDSKALCJKV-UWVGGRQHSA-N -1 3 346.408 4.015 20 0 EIADHM CC(C)S(=O)(=O)c1ccccc1Nc1c(F)c([O-])ccc1Cl ZINC001214559666 1060230153 /nfs/dbraw/zinc/23/01/53/1060230153.db2.gz SDRFBXLNCUUFNL-UHFFFAOYSA-N -1 3 343.807 4.110 20 0 EIADHM CCc1ccc(O)c([N-]S(=O)(=O)/C=C/c2ccc(Cl)cc2)c1 ZINC000746368350 1060250908 /nfs/dbraw/zinc/25/09/08/1060250908.db2.gz VEVDGFAHMZXRRK-MDZDMXLPSA-N -1 3 337.828 4.021 20 0 EIADHM COc1ccc2ccccc2c1CN[C@H](CC(=O)[O-])c1cccs1 ZINC000392159528 1060307520 /nfs/dbraw/zinc/30/75/20/1060307520.db2.gz RATRCDNHGVARRY-MRXNPFEDSA-N -1 3 341.432 4.216 20 0 EIADHM CCOC(=O)c1sc(SC)nc1Nc1ccc(Cl)c([O-])c1 ZINC001212589288 1060772290 /nfs/dbraw/zinc/77/22/90/1060772290.db2.gz DOGYWDSKZNHOMV-UHFFFAOYSA-N -1 3 344.845 4.144 20 0 EIADHM CCOC(=O)c1cnc(Nc2ccc(Cl)c([O-])c2)c(Cl)c1 ZINC001212589410 1060775778 /nfs/dbraw/zinc/77/57/78/1060775778.db2.gz JZKBLVUGCKLAIN-UHFFFAOYSA-N -1 3 327.167 4.014 20 0 EIADHM Cc1ccc(CC(=O)[N-]OCc2nc(C3CCCCC3)cs2)cc1 ZINC000766709162 1060818260 /nfs/dbraw/zinc/81/82/60/1060818260.db2.gz BBFBNFIWGCIJAT-UHFFFAOYSA-N -1 3 344.480 4.290 20 0 EIADHM COCCn1nc(-c2ccccc2)cc1Nc1ccc(Cl)c([O-])c1 ZINC001212590518 1060831323 /nfs/dbraw/zinc/83/13/23/1060831323.db2.gz PZYNHPCTIAMUBG-UHFFFAOYSA-N -1 3 343.814 4.299 20 0 EIADHM [O-]c1cc(Nc2ccc(Br)cc2CO)ccc1Cl ZINC001212592296 1060875560 /nfs/dbraw/zinc/87/55/60/1060875560.db2.gz INOFADILJDVUSY-UHFFFAOYSA-N -1 3 328.593 4.044 20 0 EIADHM O=C(NC1CCCC1)c1ccc(Nc2ccc(Cl)c([O-])c2)cc1 ZINC001212592148 1060881257 /nfs/dbraw/zinc/88/12/57/1060881257.db2.gz AJAGSEHLKRWMIM-UHFFFAOYSA-N -1 3 330.815 4.462 20 0 EIADHM CC(=O)N1CC(C)(C)c2ccc(Nc3ccc(Cl)c([O-])c3)cc21 ZINC001212592636 1060891632 /nfs/dbraw/zinc/89/16/32/1060891632.db2.gz ZSUMCUXEMAOUKH-UHFFFAOYSA-N -1 3 330.815 4.433 20 0 EIADHM CCOC(=O)CCc1ccc(Nc2ccc(Cl)c([O-])c2)cc1F ZINC001212595511 1060992305 /nfs/dbraw/zinc/99/23/05/1060992305.db2.gz XKEXNJAGCNMQRL-UHFFFAOYSA-N -1 3 337.778 4.424 20 0 EIADHM Cc1ccc(C(=O)N2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)c([O-])c1 ZINC000767195466 1061140846 /nfs/dbraw/zinc/14/08/46/1061140846.db2.gz PJMSSDPSVYMJGP-CQSZACIVSA-N -1 3 349.352 4.349 20 0 EIADHM Cc1c(-c2ccccc2)sc2[nH]c(-c3ccc([O-])cc3)nc(=O)c12 ZINC000046703636 213806007 /nfs/dbraw/zinc/80/60/07/213806007.db2.gz XUTNJCIVXFRNCD-UHFFFAOYSA-N -1 3 334.400 4.333 20 0 EIADHM COc1cc(CNc2ccc(F)cc2C)cc(Br)c1[O-] ZINC000019960983 212090181 /nfs/dbraw/zinc/09/01/81/212090181.db2.gz NMTPGQMNCVBTFY-UHFFFAOYSA-N -1 3 340.192 4.223 20 0 EIADHM O=S(=O)([N-]c1ccc(F)cc1Cl)c1ccc2ccccc2c1 ZINC000007405277 210796873 /nfs/dbraw/zinc/79/68/73/210796873.db2.gz LFHPHDVMYPYSRI-UHFFFAOYSA-N -1 3 335.787 4.433 20 0 EIADHM Cc1ccc(C)c([C@@H]2CCCN2C(=O)Cc2ccc([O-])c(F)c2)c1 ZINC000450127904 1032305354 /nfs/dbraw/zinc/30/53/54/1032305354.db2.gz NBEGOCGJCGCYHX-SFHVURJKSA-N -1 3 327.399 4.054 20 0 EIADHM Cc1ccc2[nH]cc(CCC(=O)Nc3ccc(Cl)cc3[O-])c2c1 ZINC000532840230 1032344825 /nfs/dbraw/zinc/34/48/25/1032344825.db2.gz PBINVPQESSQZPV-UHFFFAOYSA-N -1 3 328.799 4.407 20 0 EIADHM CC(C)Cn1cc(C(=O)Nc2ccc(Cl)cc2[O-])c(C(F)F)n1 ZINC000450219650 1032356619 /nfs/dbraw/zinc/35/66/19/1032356619.db2.gz DLGCVLYAWSWGOJ-UHFFFAOYSA-N -1 3 343.761 4.088 20 0 EIADHM O=C(Nc1ccc(Cl)cc1[O-])c1c[nH]nc1-c1ccccc1Cl ZINC000533159195 1032514975 /nfs/dbraw/zinc/51/49/75/1032514975.db2.gz NEOWPLDFNLCULU-UHFFFAOYSA-N -1 3 348.189 4.341 20 0 EIADHM CN(C)c1c(Cl)cccc1NC(=O)c1cc([O-])ccc1Cl ZINC000432772207 1032747739 /nfs/dbraw/zinc/74/77/39/1032747739.db2.gz RKHXPWJVTDMSJR-UHFFFAOYSA-N -1 3 325.195 4.017 20 0 EIADHM CC(=O)c1c(C)[nH]c(C(=O)Nc2c([O-])cccc2Cl)c1C(C)C ZINC000579729294 1018826843 /nfs/dbraw/zinc/82/68/43/1018826843.db2.gz GMEZCHKOYZEVGT-UHFFFAOYSA-N -1 3 334.803 4.260 20 0 EIADHM Cc1cc(=O)[n-]c(CN2CCC[C@@H]2c2ccc(C(C)(C)C)cc2)n1 ZINC001167055985 1019010463 /nfs/dbraw/zinc/01/04/63/1019010463.db2.gz VEMKOHIPAXZLEJ-QGZVFWFLSA-N -1 3 325.456 4.125 20 0 EIADHM Cc1cccc(Oc2ccc(NC(=O)NCc3ncccc3[O-])cc2)c1 ZINC000471129917 1019050788 /nfs/dbraw/zinc/05/07/88/1019050788.db2.gz GADYQYHVOCLJCS-UHFFFAOYSA-N -1 3 349.390 4.210 20 0 EIADHM Cc1ccc(Oc2ccc(NC(=O)NCc3ncccc3[O-])cc2)cc1 ZINC000471132675 1019059325 /nfs/dbraw/zinc/05/93/25/1019059325.db2.gz JDSLFYYSOAMOSO-UHFFFAOYSA-N -1 3 349.390 4.210 20 0 EIADHM C[C@H](c1ccc(OC(F)(F)F)cc1)[S@](=O)c1ccc([O-])cc1 ZINC000108086552 1019340503 /nfs/dbraw/zinc/34/05/03/1019340503.db2.gz GGGXMFACHFINRG-ZQJOYCHOSA-N -1 3 330.327 4.160 20 0 EIADHM CC[C@H]1c2ccccc2CN1C(=O)CCCc1ccc([O-])c(F)c1 ZINC000890616193 1019643593 /nfs/dbraw/zinc/64/35/93/1019643593.db2.gz VANNUDLUYIEGHU-SFHVURJKSA-N -1 3 327.399 4.348 20 0 EIADHM O=C(N[C@H]1CC[C@H](c2ccc(F)cc2)C1)c1cc([O-])ccc1Cl ZINC000510154990 1020029919 /nfs/dbraw/zinc/02/99/19/1020029919.db2.gz SSQUHONJEKDJCA-JSGCOSHPSA-N -1 3 333.790 4.251 20 0 EIADHM Cc1nc(C(C)C)sc1C(=O)[N-]c1cc([N+](=O)[O-])c(F)cc1F ZINC000079008769 1020114463 /nfs/dbraw/zinc/11/44/63/1020114463.db2.gz HLYKLIFJFBSIKP-UHFFFAOYSA-N -1 3 341.339 4.014 20 0 EIADHM CCN(C(=O)c1cc(=O)c2ccccc2[n-]1)[C@H](C)Cc1ccsc1 ZINC000275247085 1020279182 /nfs/dbraw/zinc/27/91/82/1020279182.db2.gz UVCFKHDTNIBUHE-CYBMUJFWSA-N -1 3 340.448 4.095 20 0 EIADHM CC(=O)c1ccc(NC(=O)CCCc2ccc([O-])c(F)c2)cc1C ZINC000471297968 1020735481 /nfs/dbraw/zinc/73/54/81/1020735481.db2.gz VVNTWXALNYDFIN-UHFFFAOYSA-N -1 3 329.371 4.004 20 0 EIADHM Nc1cc2c(ccn2-c2cccc(Cl)c2[O-])cc1Br ZINC001210222919 1020958503 /nfs/dbraw/zinc/95/85/03/1020958503.db2.gz CXTDGKBHGOEAFD-UHFFFAOYSA-N -1 3 337.604 4.334 20 0 EIADHM CCOCc1nc(C)c(C(=O)[N-]c2c(F)cc(Cl)cc2F)s1 ZINC000410669722 1032944008 /nfs/dbraw/zinc/94/40/08/1032944008.db2.gz OUFLLGDRHUTXKI-UHFFFAOYSA-N -1 3 346.786 4.172 20 0 EIADHM CCc1onc(C)c1[N-]C(=O)c1ccc(-c2ccc(C(C)=O)cc2)o1 ZINC000340429334 1021010396 /nfs/dbraw/zinc/01/03/96/1021010396.db2.gz KBNRQHGENSWHTL-UHFFFAOYSA-N -1 3 338.363 4.260 20 0 EIADHM CC(C)c1ccc([C@H](NC(=O)NCc2ncccc2[O-])C(C)C)cc1 ZINC000471523302 1021509663 /nfs/dbraw/zinc/50/96/63/1021509663.db2.gz SCULFXZNCHOEAQ-LJQANCHMSA-N -1 3 341.455 4.107 20 0 EIADHM O=C(NCc1ccccc1OC1CCCC1)c1cc([O-])ccc1Cl ZINC000431765535 1021810697 /nfs/dbraw/zinc/81/06/97/1021810697.db2.gz MSKSILSKPVCERT-UHFFFAOYSA-N -1 3 345.826 4.297 20 0 EIADHM CSc1ccc([O-])c(C(=O)N2C[C@H](c3ccccc3)C[C@@H]2C)c1 ZINC000668808113 1021812840 /nfs/dbraw/zinc/81/28/40/1021812840.db2.gz NICUXXHMXMURGJ-DZGCQCFKSA-N -1 3 327.449 4.132 20 0 EIADHM CCc1nc(C)c([C@@H](C)N(C)C(=O)c2cc([O-])ccc2Cl)s1 ZINC000340653452 1021874831 /nfs/dbraw/zinc/87/48/31/1021874831.db2.gz IPLRNKIFPOXBHO-SNVBAGLBSA-N -1 3 338.860 4.206 20 0 EIADHM Cc1nc(-c2ccccc2)oc1C(=O)[N-]c1nnc(C(C)(C)C)s1 ZINC000155751288 1022057895 /nfs/dbraw/zinc/05/78/95/1022057895.db2.gz PGVKIGUMOMEGMH-UHFFFAOYSA-N -1 3 342.424 4.051 20 0 EIADHM Cc1ccc(Br)cc1-c1noc(-c2ccccc2[O-])n1 ZINC000312880225 1022097815 /nfs/dbraw/zinc/09/78/15/1022097815.db2.gz UTAQQVWPKGWWPO-UHFFFAOYSA-N -1 3 331.169 4.180 20 0 EIADHM C[C@H](NC(=O)c1cc([O-])c2ccccc2c1)c1ccc(F)cc1F ZINC000471588526 1022150026 /nfs/dbraw/zinc/15/00/26/1022150026.db2.gz CFTAMWCXUXBMKH-NSHDSACASA-N -1 3 327.330 4.315 20 0 EIADHM CCC[C@H]1[C@H](C)CCCN1Cc1nc2cc(C(=O)[O-])ccc2n1CC ZINC000580560852 1022214037 /nfs/dbraw/zinc/21/40/37/1022214037.db2.gz AJMDRTIRFOUMPS-PBHICJAKSA-N -1 3 343.471 4.155 20 0 EIADHM CCCC(CCC)[S@@](=O)Cc1cc(=O)[n-]c(-c2ccccc2)n1 ZINC000414236363 1022246932 /nfs/dbraw/zinc/24/69/32/1022246932.db2.gz IDVBSFQXCIZXTM-QHCPKHFHSA-N -1 3 332.469 4.067 20 0 EIADHM O=C(/C=C\c1csc(Br)c1)Nc1cccc([O-])c1F ZINC000255630083 1022300471 /nfs/dbraw/zinc/30/04/71/1022300471.db2.gz ODUMSTDXQWCBTI-PLNGDYQASA-N -1 3 342.189 4.007 20 0 EIADHM O=C([N-]c1nc(-c2cccs2)ns1)c1c(F)cccc1Cl ZINC000182161622 1022321125 /nfs/dbraw/zinc/32/11/25/1022321125.db2.gz KLWAQSFVSMXXPQ-UHFFFAOYSA-N -1 3 339.804 4.311 20 0 EIADHM CC(=O)c1ccccc1C(=O)Nc1cc(Cc2ccccc2)ccc1[O-] ZINC000536220571 1022389429 /nfs/dbraw/zinc/38/94/29/1022389429.db2.gz OOBPDOAHGBDMJY-UHFFFAOYSA-N -1 3 345.398 4.438 20 0 EIADHM Cc1ccc(-c2nc(-c3ccc(C)c(N4CCCC4)c3)no2)c([O-])c1 ZINC000580753655 1022471697 /nfs/dbraw/zinc/47/16/97/1022471697.db2.gz QHENOOUMIQQKSK-UHFFFAOYSA-N -1 3 335.407 4.326 20 0 EIADHM COc1cccc(SC)c1[N-]C(=O)c1oc(CC(C)C)nc1C ZINC000416124762 1022500336 /nfs/dbraw/zinc/50/03/36/1022500336.db2.gz UXRHEWHEUGUXIF-UHFFFAOYSA-N -1 3 334.441 4.164 20 0 EIADHM CCCc1cc(=O)[n-]c(C(=Cc2cccc(-c3cnn(C)c3)c2)CC)n1 ZINC000378409838 1022805932 /nfs/dbraw/zinc/80/59/32/1022805932.db2.gz NGFLQOADJPIVBZ-MHWRWJLKSA-N -1 3 348.450 4.486 20 0 EIADHM COc1ccc(SCCC(=O)Nc2ccc(Cl)cc2[O-])cc1 ZINC000536222413 1022862829 /nfs/dbraw/zinc/86/28/29/1022862829.db2.gz ZVZXBTZXQDAWNX-UHFFFAOYSA-N -1 3 337.828 4.175 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2cc(Cl)ccc2F)c(Cl)c1 ZINC000025181166 1022891347 /nfs/dbraw/zinc/89/13/47/1022891347.db2.gz CEJGELGCGDJPKH-UHFFFAOYSA-N -1 3 334.199 4.242 20 0 EIADHM C[C@@H]1C[C@@H]1c1ccc(CN2CCC(C(=O)c3ccc([O-])cc3)CC2)o1 ZINC000124038607 1023193179 /nfs/dbraw/zinc/19/31/79/1023193179.db2.gz ZQGNLVIWDMHNHY-KUHUBIRLSA-N -1 3 339.435 4.204 20 0 EIADHM [O-]C(=Cc1nc(-c2ccc3ccccc3n2)no1)c1ccccc1Cl ZINC001211646788 1023204608 /nfs/dbraw/zinc/20/46/08/1023204608.db2.gz AHEWCJVPUMDXIK-UHFFFAOYSA-N -1 3 349.777 4.364 20 0 EIADHM CC(C)c1ccccc1S(=O)(=O)[N-]c1ccc(F)c(F)c1F ZINC000468544032 1023222777 /nfs/dbraw/zinc/22/27/77/1023222777.db2.gz VBZAGXRMJQTASK-UHFFFAOYSA-N -1 3 329.343 4.028 20 0 EIADHM CCOc1ccc(CN[C@H](CC(=O)[O-])c2cccc(Cl)c2)c(C)c1 ZINC000656565084 1023225555 /nfs/dbraw/zinc/22/55/55/1023225555.db2.gz CXTVIDCLKUFNRE-GOSISDBHSA-N -1 3 347.842 4.353 20 0 EIADHM CC1(C)[C@H](CCC(=O)[O-])C[C@@H]1NCc1nc(-c2ccccc2)cs1 ZINC000656569098 1023235023 /nfs/dbraw/zinc/23/50/23/1023235023.db2.gz YCBRZMSTTYQXDM-ZBFHGGJFSA-N -1 3 344.480 4.179 20 0 EIADHM CCC(C)(C)[C@@H](NCc1csc(-c2ccc(C)cc2)n1)C(=O)[O-] ZINC000584720430 1023238075 /nfs/dbraw/zinc/23/80/75/1023238075.db2.gz IDPLPOVDIGGYTJ-HNNXBMFYSA-N -1 3 332.469 4.098 20 0 EIADHM Cc1ccc2c(c1C)OC[C@@H]2NC(=O)c1cc([O-])c2ccccc2c1 ZINC000684272988 1023276515 /nfs/dbraw/zinc/27/65/15/1023276515.db2.gz GTLPMRBVLXFDES-SFHVURJKSA-N -1 3 333.387 4.026 20 0 EIADHM CN(C[C@@H]1CCc2ccccc21)[C@@H](C(=O)[O-])c1c(F)cccc1Cl ZINC000659803515 1023285176 /nfs/dbraw/zinc/28/51/76/1023285176.db2.gz JQDJNYYMWDFUAE-SCLBCKFNSA-N -1 3 347.817 4.267 20 0 EIADHM CCOc1ccccc1C1=CCN(Cc2ccc(C(=O)[O-])cc2)CC1 ZINC000414640131 1023308824 /nfs/dbraw/zinc/30/88/24/1023308824.db2.gz RHBQKYOCSKTYAP-UHFFFAOYSA-N -1 3 337.419 4.073 20 0 EIADHM Cc1cc(F)c(CNC[C@H](Cc2ccccc2C)C(=O)[O-])c(Cl)c1 ZINC000417575499 1023365684 /nfs/dbraw/zinc/36/56/84/1023365684.db2.gz XZIPQOBXQNACGW-HNNXBMFYSA-N -1 3 349.833 4.129 20 0 EIADHM O=C([O-])c1c(F)cc(CNCc2ccc(C3CCC3)cc2)cc1F ZINC000417647933 1023388911 /nfs/dbraw/zinc/38/89/11/1023388911.db2.gz MWRITJQGKRVPBD-UHFFFAOYSA-N -1 3 331.362 4.220 20 0 EIADHM O=C([O-])[C@@H]1CCN(Cc2cc(Cl)cc(Cl)c2)[C@@H]2CCCC[C@@H]12 ZINC000656764253 1023505071 /nfs/dbraw/zinc/50/50/71/1023505071.db2.gz FUDSUUFENRKRKW-ARFHVFGLSA-N -1 3 342.266 4.459 20 0 EIADHM O=C([O-])[C@H](c1ccc(Cl)c(Cl)c1)N1CCC[C@@H](CCF)C1 ZINC000656763853 1023508192 /nfs/dbraw/zinc/50/81/92/1023508192.db2.gz RTUCXSTYZPZXDY-HZMBPMFUSA-N -1 3 334.218 4.191 20 0 EIADHM Cc1cc(CN2CC[C@H](C(=O)[O-])[C@H]3CCCC[C@@H]32)c2ccccc2n1 ZINC000656766102 1023510077 /nfs/dbraw/zinc/51/00/77/1023510077.db2.gz QCLKCVNRZJFVMK-HBFSDRIKSA-N -1 3 338.451 4.009 20 0 EIADHM C[C@H](C(=O)Nc1cccc([O-])c1F)c1ccc(Br)cc1 ZINC000129979808 1023624193 /nfs/dbraw/zinc/62/41/93/1023624193.db2.gz ZYJZCOWIKGBRCR-VIFPVBQESA-N -1 3 338.176 4.036 20 0 EIADHM Cc1cccnc1C(F)(F)C(=O)[N-][C@H](C)c1ccc(F)cc1Cl ZINC000192574021 1023630552 /nfs/dbraw/zinc/63/05/52/1023630552.db2.gz MWHAOHGJNBASLB-SNVBAGLBSA-N -1 3 342.748 4.152 20 0 EIADHM CCC(CC)CN(CC)Cc1coc(-c2ccc(C(=O)[O-])cc2)n1 ZINC000581731557 1023654903 /nfs/dbraw/zinc/65/49/03/1023654903.db2.gz GFIVCIHNYHESOT-UHFFFAOYSA-N -1 3 330.428 4.298 20 0 EIADHM Cc1ccccc1NC1CCN(C(=O)c2cc([O-])ccc2Cl)CC1 ZINC000377737080 1023734454 /nfs/dbraw/zinc/73/44/54/1023734454.db2.gz MIAOCHHQEHRHRH-UHFFFAOYSA-N -1 3 344.842 4.071 20 0 EIADHM CC[C@@H](C)Oc1ccc([N-]S(=O)(=O)c2ccc3c(c2)CCC3)cc1 ZINC000511680574 1023827729 /nfs/dbraw/zinc/82/77/29/1023827729.db2.gz JBUCLJSISLMKMF-CQSZACIVSA-N -1 3 345.464 4.153 20 0 EIADHM CC[C@H](C)Oc1ccc([N-]S(=O)(=O)c2ccc(C)c(F)c2)cc1 ZINC000511710309 1023835622 /nfs/dbraw/zinc/83/56/22/1023835622.db2.gz NCPQZGKDEDKMDB-ZDUSSCGKSA-N -1 3 337.416 4.112 20 0 EIADHM CC[C@@H](C)Oc1ccc([N-]S(=O)(=O)c2ccc(C)c(F)c2)cc1 ZINC000511710308 1023835852 /nfs/dbraw/zinc/83/58/52/1023835852.db2.gz NCPQZGKDEDKMDB-CYBMUJFWSA-N -1 3 337.416 4.112 20 0 EIADHM O=C(c1cc(Cc2ccccc2)ccc1[O-])N1CCCC(F)(F)CC1 ZINC000628633647 1023992517 /nfs/dbraw/zinc/99/25/17/1023992517.db2.gz GRVCSZKUYQWEJI-UHFFFAOYSA-N -1 3 345.389 4.244 20 0 EIADHM CSc1cccc(C)c1[N-]C(=O)c1csc(C(F)(F)F)n1 ZINC000341679997 1024304334 /nfs/dbraw/zinc/30/43/34/1024304334.db2.gz WSKDPYWEDKYUIG-UHFFFAOYSA-N -1 3 332.372 4.445 20 0 EIADHM CN(C)[C@H](C/N=C/c1cc(Cl)cc(Cl)c1[O-])c1ccccc1 ZINC000022728000 1024527147 /nfs/dbraw/zinc/52/71/47/1024527147.db2.gz JQZJQKIBMQZQKA-OVEPSTSESA-N -1 3 337.250 4.421 20 0 EIADHM O=S(=O)([N-]C1(c2ccc(Cl)cc2)CC1)c1ccc(Cl)s1 ZINC000041572470 1024726572 /nfs/dbraw/zinc/72/65/72/1024726572.db2.gz HQLAXXYWIJZPBE-UHFFFAOYSA-N -1 3 348.276 4.023 20 0 EIADHM O=C([O-])C[C@@H](NCc1ccc(C(F)(F)F)cc1)c1ccsc1 ZINC000276923563 1024777747 /nfs/dbraw/zinc/77/77/47/1024777747.db2.gz AJABQPXCNRLSHD-CYBMUJFWSA-N -1 3 329.343 4.073 20 0 EIADHM COc1ccc([O-])c(-c2nc(-c3c(Cl)cccc3Cl)no2)c1 ZINC000184837008 1024981437 /nfs/dbraw/zinc/98/14/37/1024981437.db2.gz WVAYTYMVHCTVCG-UHFFFAOYSA-N -1 3 337.162 4.425 20 0 EIADHM O=C([O-])C[C@H](NCc1ccc(SC(F)F)cc1)c1ccsc1 ZINC000277011271 1024993942 /nfs/dbraw/zinc/99/39/42/1024993942.db2.gz MTSCGBSQHVMTIK-ZDUSSCGKSA-N -1 3 343.420 4.368 20 0 EIADHM O=C([O-])C[C@H](NCc1cccc(C(F)(F)F)c1)c1ccsc1 ZINC000277053331 1025015675 /nfs/dbraw/zinc/01/56/75/1025015675.db2.gz SOTQKXGANMPLLN-ZDUSSCGKSA-N -1 3 329.343 4.073 20 0 EIADHM CCSc1cccc(CN[C@@H](CC(=O)[O-])c2cccc(OC)c2)c1 ZINC000277125629 1025077357 /nfs/dbraw/zinc/07/73/57/1025077357.db2.gz BGDPGIRWCSTQGE-SFHVURJKSA-N -1 3 345.464 4.113 20 0 EIADHM Cc1ccc(C)c([N-]S(=O)(=O)c2ccc(OCC(C)C)cc2)c1 ZINC000506798167 1025768519 /nfs/dbraw/zinc/76/85/19/1025768519.db2.gz RMCWWZIUBDRBQG-UHFFFAOYSA-N -1 3 333.453 4.139 20 0 EIADHM Cc1ccc([N-]S(=O)(=O)c2cc(C)c(F)cc2F)c(Cl)c1 ZINC000440290568 1025804822 /nfs/dbraw/zinc/80/48/22/1025804822.db2.gz IUORBBYBTDQAOP-UHFFFAOYSA-N -1 3 331.771 4.036 20 0 EIADHM O=C(Nc1ccccc1OC(F)(F)F)c1cc([O-])ccc1Cl ZINC000319749726 1025813796 /nfs/dbraw/zinc/81/37/96/1025813796.db2.gz ZMKRTPUFGXPSFU-UHFFFAOYSA-N -1 3 331.677 4.197 20 0 EIADHM O=C([O-])c1ccccc1CCNCc1ccc(Oc2ccccc2)o1 ZINC000426640637 1025838030 /nfs/dbraw/zinc/83/80/30/1025838030.db2.gz SXNLGMFOTHUVMO-UHFFFAOYSA-N -1 3 337.375 4.102 20 0 EIADHM O=S(=O)([N-]c1cccc(Cl)c1Cl)c1ccccc1Cl ZINC000007405328 1025845298 /nfs/dbraw/zinc/84/52/98/1025845298.db2.gz FFAZAFRQBURBJF-UHFFFAOYSA-N -1 3 336.627 4.448 20 0 EIADHM Cc1ccc(-c2nc(CNCCCC(C)(C)C(=O)[O-])cs2)cc1 ZINC000426648258 1025850140 /nfs/dbraw/zinc/85/01/40/1025850140.db2.gz QHQGINWKUDXWJP-UHFFFAOYSA-N -1 3 332.469 4.099 20 0 EIADHM Cc1ccc(-c2csc(C[S@@](=O)c3ccc([O-])cc3)n2)cc1 ZINC000349681312 1025865191 /nfs/dbraw/zinc/86/51/91/1025865191.db2.gz WHLPJIHMSMTIRN-JOCHJYFZSA-N -1 3 329.446 4.132 20 0 EIADHM Cc1oc(-c2ccccc2)nc1C(=O)Nc1cc(Cl)ccc1[O-] ZINC000111210268 1026099356 /nfs/dbraw/zinc/09/93/56/1026099356.db2.gz TVTLNVYGSLNQSV-UHFFFAOYSA-N -1 3 328.755 4.261 20 0 EIADHM C[C@H]1CCCCCN1Cc1csc(-c2ccc(C(=O)[O-])cc2)n1 ZINC000563276640 1026302321 /nfs/dbraw/zinc/30/23/21/1026302321.db2.gz AAOGJPYBSNDUHZ-ZDUSSCGKSA-N -1 3 330.453 4.273 20 0 EIADHM Cc1ccc(-c2nc(Cc3ccc(Br)cc3)no2)c([O-])c1 ZINC000111687577 1026318755 /nfs/dbraw/zinc/31/87/55/1026318755.db2.gz IKXLMEHTOAUYJO-UHFFFAOYSA-N -1 3 345.196 4.104 20 0 EIADHM O=C([N-][C@H]1C[C@@]1(F)c1ccccc1)C(F)(F)c1cccc(Cl)c1 ZINC001299750262 1026405133 /nfs/dbraw/zinc/40/51/33/1026405133.db2.gz PQPMHRLZYYKVBA-GOEBONIOSA-N -1 3 339.744 4.185 20 0 EIADHM O=C([N-][C@@H]1C[C@]1(F)c1ccccc1)C(F)(F)c1cccc(Cl)c1 ZINC001299750264 1026408241 /nfs/dbraw/zinc/40/82/41/1026408241.db2.gz PQPMHRLZYYKVBA-ZBFHGGJFSA-N -1 3 339.744 4.185 20 0 EIADHM Cc1ccc([C@@H](NCc2ccc(F)c(C(F)(F)F)c2)C(=O)[O-])cc1 ZINC000426698734 1026484592 /nfs/dbraw/zinc/48/45/92/1026484592.db2.gz AZMGYKDFKJZORQ-OAHLLOKOSA-N -1 3 341.304 4.068 20 0 EIADHM CCCCOc1ccc(CN[C@@H](CC(=O)[O-])c2ccsc2)cc1 ZINC000426713901 1026494599 /nfs/dbraw/zinc/49/45/99/1026494599.db2.gz KMROFAJGYQWQIF-KRWDZBQOSA-N -1 3 333.453 4.233 20 0 EIADHM C[C@@H](C(=O)[O-])[C@H](NCc1cc2cc(F)ccc2o1)c1ccccc1 ZINC000426714690 1026496818 /nfs/dbraw/zinc/49/68/18/1026496818.db2.gz DTWIMWTYOSRAAS-XIKOKIGWSA-N -1 3 327.355 4.124 20 0 EIADHM COc1ccc([C@H](CCC(=O)[O-])NCc2cc3ccccc3o2)cc1 ZINC000426717713 1026498840 /nfs/dbraw/zinc/49/88/40/1026498840.db2.gz RGRFKZMVHBKRTH-SFHVURJKSA-N -1 3 339.391 4.137 20 0 EIADHM O=C([O-])[C@H](NCc1ccc(F)c(Cl)c1)c1cccc(Cl)c1 ZINC000426751278 1026537251 /nfs/dbraw/zinc/53/72/51/1026537251.db2.gz USLAANZJBPSTEW-CQSZACIVSA-N -1 3 328.170 4.048 20 0 EIADHM O=C([O-])C[C@H](NCc1cc2c(cccc2F)[nH]1)c1ccc(Cl)cc1 ZINC000426767738 1026560300 /nfs/dbraw/zinc/56/03/00/1026560300.db2.gz QERXDGMCNSAJNM-KRWDZBQOSA-N -1 3 346.789 4.266 20 0 EIADHM O=C([O-])[C@H](NCc1cccc(OC2CCCC2)c1)c1cccc(F)c1 ZINC000426803044 1026571941 /nfs/dbraw/zinc/57/19/41/1026571941.db2.gz ZVVFOENXBRTMSP-LJQANCHMSA-N -1 3 343.398 4.063 20 0 EIADHM O=C([O-])[C@@H](NCc1cc(Cl)cc(Cl)c1)c1cccc(F)c1 ZINC000426809580 1026573062 /nfs/dbraw/zinc/57/30/62/1026573062.db2.gz VUNPSUGTZUSIOM-AWEZNQCLSA-N -1 3 328.170 4.048 20 0 EIADHM O=C([O-])C[C@@H](NCc1ccc(F)c(Cl)c1)c1cccc(Cl)c1 ZINC000426830123 1026585415 /nfs/dbraw/zinc/58/54/15/1026585415.db2.gz VJTLUCCULKIATF-OAHLLOKOSA-N -1 3 342.197 4.438 20 0 EIADHM COc1ccc([C@H]2CCCN2Cc2c(F)ccc([O-])c2F)c(OC)c1 ZINC000507025652 1026594360 /nfs/dbraw/zinc/59/43/60/1026594360.db2.gz JUUPPQVICVXLQQ-MRXNPFEDSA-N -1 3 349.377 4.025 20 0 EIADHM CC[C@H](NC(=O)CCCc1ccc([O-])c(F)c1)c1ccc(OC)cc1 ZINC000344784817 1026595165 /nfs/dbraw/zinc/59/51/65/1026595165.db2.gz ZJPQBGQRHNHLFW-SFHVURJKSA-N -1 3 345.414 4.130 20 0 EIADHM C[C@H]1[C@H](Cc2ccccc2)CCN1C(=O)c1cc([O-])ccc1Cl ZINC000560135814 1026725710 /nfs/dbraw/zinc/72/57/10/1026725710.db2.gz WDUDJXICVMKEAV-ZFWWWQNUSA-N -1 3 329.827 4.139 20 0 EIADHM [O-]c1ccc(F)c(CN2CCn3cccc3[C@@H]2c2ccccc2)c1F ZINC000507295950 1026732462 /nfs/dbraw/zinc/73/24/62/1026732462.db2.gz QUHVRTLRZLOGMS-FQEVSTJZSA-N -1 3 340.373 4.077 20 0 EIADHM O=c1ccnc(C(=Cc2ccc(Cl)cc2F)Cc2ccccc2)[n-]1 ZINC000432691943 1026766444 /nfs/dbraw/zinc/76/64/44/1026766444.db2.gz AEKONXINCMFPLF-RVDMUPIBSA-N -1 3 340.785 4.346 20 0 EIADHM O=c1ccnc(C(=Cc2ccsc2Cl)Cc2ccccc2)[n-]1 ZINC000432706869 1026805753 /nfs/dbraw/zinc/80/57/53/1026805753.db2.gz BYEGRPCMMFWQHE-KAMYIIQDSA-N -1 3 328.824 4.268 20 0 EIADHM Cc1cccc(C)c1NC(=O)c1c[n-]c(=NC(=O)OC(C)(C)C)s1 ZINC000224803394 1026830204 /nfs/dbraw/zinc/83/02/04/1026830204.db2.gz PFHBWTNIHRVVMK-UHFFFAOYSA-N -1 3 347.440 4.359 20 0 EIADHM COc1ccccc1CC1CCN([C@H](C)c2ccc(C(=O)[O-])o2)CC1 ZINC000582671675 1026924032 /nfs/dbraw/zinc/92/40/32/1026924032.db2.gz STDUTTYMJGSQJU-CQSZACIVSA-N -1 3 343.423 4.002 20 0 EIADHM Cc1ccccc1C[C@@H](C)N(C)Cc1cccc(C(=O)[O-])c1Cl ZINC000566361343 1027382332 /nfs/dbraw/zinc/38/23/32/1027382332.db2.gz JAOFRRAJMRFOMB-CQSZACIVSA-N -1 3 331.843 4.410 20 0 EIADHM COc1ccc([N-]S(=O)(=O)c2ccc(Cl)cc2C)cc1Cl ZINC000614737972 1027398237 /nfs/dbraw/zinc/39/82/37/1027398237.db2.gz YWGNQBMEGNXJND-UHFFFAOYSA-N -1 3 346.235 4.111 20 0 EIADHM CCc1ncsc1C(=O)[N-]c1nnc(-c2cc(C)cc(C)c2)s1 ZINC000121364999 1027739278 /nfs/dbraw/zinc/73/92/78/1027739278.db2.gz LHTQPNJNMWDXSN-UHFFFAOYSA-N -1 3 344.465 4.093 20 0 EIADHM COc1ccccc1[C@@H](C)SCc1noc(-c2ccccc2[O-])n1 ZINC000079008005 1027783735 /nfs/dbraw/zinc/78/37/35/1027783735.db2.gz UXGMIGLEDADEEG-GFCCVEGCSA-N -1 3 342.420 4.445 20 0 EIADHM COc1cccc([C@H]2CCCN2C(=O)c2cc([O-])ccc2Cl)c1 ZINC000431514140 1027839063 /nfs/dbraw/zinc/83/90/63/1027839063.db2.gz PAZGOZQMPJQUML-QGZVFWFLSA-N -1 3 331.799 4.032 20 0 EIADHM COc1cccc(C(=O)N2C[C@H](C(C)(C)C)c3ccccc32)c1[O-] ZINC000443869799 1028022717 /nfs/dbraw/zinc/02/27/17/1028022717.db2.gz QPKPGQDSNACCGX-HNNXBMFYSA-N -1 3 325.408 4.191 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)N[C@@H]1CCCC[C@@H]1c1ccccc1 ZINC000523462699 1028133286 /nfs/dbraw/zinc/13/32/86/1028133286.db2.gz JTJPPFUEUUAJNA-SJLPKXTDSA-N -1 3 342.414 4.057 20 0 EIADHM C[C@@H](C(=O)OC(C)(C)C)c1noc(-c2cc3ccccc3cc2[O-])n1 ZINC000280941552 1028286671 /nfs/dbraw/zinc/28/66/71/1028286671.db2.gz SNHFOYLJHLDYQS-LLVKDONJSA-N -1 3 340.379 4.041 20 0 EIADHM O=c1[n-]c(CN2CCCc3ccccc3C2)nc2c3ccccc3oc21 ZINC000346180503 1028308402 /nfs/dbraw/zinc/30/84/02/1028308402.db2.gz CBHMGZOPJNYTAA-UHFFFAOYSA-N -1 3 345.402 4.030 20 0 EIADHM CC(C)(C)Oc1ccc(-c2noc(/C=C/c3cncc([O-])c3)n2)cc1 ZINC000445204741 1028372599 /nfs/dbraw/zinc/37/25/99/1028372599.db2.gz BGHUYZOWZUXWMM-RUDMXATFSA-N -1 3 337.379 4.185 20 0 EIADHM Cc1ccc([O-])c(CN2CCC[C@]2(c2ccccc2)C(F)(F)F)n1 ZINC000428395935 1028428526 /nfs/dbraw/zinc/42/85/26/1028428526.db2.gz AYCSWZBVBYQLFQ-KRWDZBQOSA-N -1 3 336.357 4.149 20 0 EIADHM CCN(Cc1nc2c3ccccc3oc2c(=O)[n-]1)c1ccccc1OC ZINC000346786733 1028643974 /nfs/dbraw/zinc/64/39/74/1028643974.db2.gz CRVQRMXAAUDFMI-UHFFFAOYSA-N -1 3 349.390 4.117 20 0 EIADHM CCOC(=O)Cc1ccc(Nc2cc(F)c([O-])c(F)c2)c(Cl)c1 ZINC001213386825 1028787680 /nfs/dbraw/zinc/78/76/80/1028787680.db2.gz XKVTYOVBVLXLJX-UHFFFAOYSA-N -1 3 341.741 4.173 20 0 EIADHM CC(C)(CC(=O)Nc1cc(Br)ccc1[O-])C(F)(F)F ZINC000281611368 1028804346 /nfs/dbraw/zinc/80/43/46/1028804346.db2.gz ZDMPSJARTKEKKO-UHFFFAOYSA-N -1 3 340.139 4.072 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1ccnc(Oc2ccccc2)c1 ZINC000522838617 1028990335 /nfs/dbraw/zinc/99/03/35/1028990335.db2.gz LZRVFMIGPMYWRM-UHFFFAOYSA-N -1 3 340.766 4.485 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@H]3CCCC[C@@H]3CC)nc2)n1 ZINC000524685217 1029153906 /nfs/dbraw/zinc/15/39/06/1029153906.db2.gz MTPLIHZKUCVPKA-BBRMVZONSA-N -1 3 326.444 4.187 20 0 EIADHM COc1ccc(Cl)c(S(=O)(=O)[N-]c2cccc(C)c2Cl)c1 ZINC000524792977 1029223803 /nfs/dbraw/zinc/22/38/03/1029223803.db2.gz QWNRBNKRHMKVTP-UHFFFAOYSA-N -1 3 346.235 4.111 20 0 EIADHM Cc1cccc([N-]S(=O)(=O)c2ccccc2C(F)(F)F)c1Cl ZINC000524794058 1029226189 /nfs/dbraw/zinc/22/61/89/1029226189.db2.gz NRBXZMPRDKOZCS-UHFFFAOYSA-N -1 3 349.761 4.468 20 0 EIADHM C[C@H](Oc1cccc2ccccc21)C(=O)Nc1cc(F)ccc1[O-] ZINC000444330303 1029384058 /nfs/dbraw/zinc/38/40/58/1029384058.db2.gz RLWOQQHKZIIQFI-LBPRGKRZSA-N -1 3 325.339 4.091 20 0 EIADHM Cc1ccc(Cl)c([N-]S(=O)(=O)c2cccc3cccnc32)c1C ZINC000446947996 1029641276 /nfs/dbraw/zinc/64/12/76/1029641276.db2.gz KWUBTVLPRZZHDW-UHFFFAOYSA-N -1 3 346.839 4.306 20 0 EIADHM Cc1ccccc1C[C@H](C)N(C)C(=O)CCCc1ccc([O-])c(F)c1 ZINC000447067208 1029680917 /nfs/dbraw/zinc/68/09/17/1029680917.db2.gz HKPJNHCPPOYJQH-INIZCTEOSA-N -1 3 343.442 4.252 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@H]3CCC[C@H](CC)C3)nc2)n1 ZINC000301353763 1029715475 /nfs/dbraw/zinc/71/54/75/1029715475.db2.gz MIPRHZCLBWHJDO-BBRMVZONSA-N -1 3 326.444 4.187 20 0 EIADHM CCCn1c(=O)[n-]nc1S[C@@H](c1ccccc1)c1ccc(F)cc1 ZINC000525623114 1029722429 /nfs/dbraw/zinc/72/24/29/1029722429.db2.gz DQUANPDFRLRVFK-INIZCTEOSA-N -1 3 343.427 4.415 20 0 EIADHM CCC[C@H](Nc1ccc(-c2nc(CC)cc(=O)[n-]2)cn1)c1ccccc1 ZINC000080945190 1029765438 /nfs/dbraw/zinc/76/54/38/1029765438.db2.gz KCQBXVGJYZSCNP-SFHVURJKSA-N -1 3 348.450 4.348 20 0 EIADHM CCc1nc(C)c([C@@H](C)N(C)C(=O)c2cccc(CC)c2[O-])s1 ZINC000091735851 1029890595 /nfs/dbraw/zinc/89/05/95/1029890595.db2.gz DKSKLPSITIKLNZ-GFCCVEGCSA-N -1 3 332.469 4.115 20 0 EIADHM Cc1cc(=O)[n-]c([C@@H](C)Sc2nc(C(C)C)nc3ccccc32)n1 ZINC000447329128 1030011617 /nfs/dbraw/zinc/01/16/17/1030011617.db2.gz HMXWTTNWWSABOJ-GFCCVEGCSA-N -1 3 340.452 4.411 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@H](CC)C3CCCC3)nc2)n1 ZINC000450873962 1030067713 /nfs/dbraw/zinc/06/77/13/1030067713.db2.gz LHSICZHQQWRTMS-MRXNPFEDSA-N -1 3 326.444 4.187 20 0 EIADHM CC(C)(C)c1nc(CN[C@H](CCC(=O)[O-])Cc2ccccc2)cs1 ZINC000262690134 1030125310 /nfs/dbraw/zinc/12/53/10/1030125310.db2.gz FVHFOLOCIFEINL-OAHLLOKOSA-N -1 3 346.496 4.006 20 0 EIADHM C[C@@H]1CC(F)(F)CCN1Cc1c(C(=O)[O-])sc2cccc(F)c21 ZINC000530173866 1030191669 /nfs/dbraw/zinc/19/16/69/1030191669.db2.gz RIKOVQKPLABTMA-SECBINFHSA-N -1 3 343.370 4.358 20 0 EIADHM C[C@@H]1CCN(C(=O)CCCc2ccc([O-])c(F)c2)[C@H]2CCCC[C@@H]12 ZINC000530332005 1030305466 /nfs/dbraw/zinc/30/54/66/1030305466.db2.gz QQNWSGIAZAZXOB-HFTRVMKXSA-N -1 3 333.447 4.281 20 0 EIADHM O=C(N[C@@H]1C[C@H]1c1c(F)cccc1F)c1cc([O-])c2ccccc2c1 ZINC000526893950 1030325443 /nfs/dbraw/zinc/32/54/43/1030325443.db2.gz NSTPYEGRLQJECL-RHSMWYFYSA-N -1 3 339.341 4.110 20 0 EIADHM CCC(CC)c1nnc([N-]C(=O)c2oc(CC(C)C)nc2C)s1 ZINC000188296487 1030398036 /nfs/dbraw/zinc/39/80/36/1030398036.db2.gz OWSICILILGVDHT-UHFFFAOYSA-N -1 3 336.461 4.189 20 0 EIADHM C[C@@H]1c2c(F)cccc2CCN1C(=O)CCCc1ccc([O-])c(F)c1 ZINC000527045996 1030427378 /nfs/dbraw/zinc/42/73/78/1030427378.db2.gz NTJAEYJDIWWWFO-CYBMUJFWSA-N -1 3 345.389 4.139 20 0 EIADHM CC(C)c1ccc(-c2nc(CN3CC[C@](C)(C(=O)[O-])C3)cs2)cc1 ZINC000263113320 1030479219 /nfs/dbraw/zinc/47/92/19/1030479219.db2.gz JUZKDYFWRVTFRP-IBGZPJMESA-N -1 3 344.480 4.230 20 0 EIADHM Cc1ncccc1CSc1nnc([N-]c2ccccc2F)s1 ZINC000685565307 1030517057 /nfs/dbraw/zinc/51/70/57/1030517057.db2.gz BZSDGLYDEHZGIL-UHFFFAOYSA-N -1 3 332.429 4.417 20 0 EIADHM CN(C)c1cccc([C@H]2CCCN2Cc2c(F)ccc([O-])c2F)c1 ZINC000508646722 1030546454 /nfs/dbraw/zinc/54/64/54/1030546454.db2.gz UQPRUXGDNDCRJP-QGZVFWFLSA-N -1 3 332.394 4.074 20 0 EIADHM CCS[C@@H]1CCC[C@H](NC(=O)c2cc([O-])c3ccccc3c2)C1 ZINC000527467683 1030708110 /nfs/dbraw/zinc/70/81/10/1030708110.db2.gz PERNNFVJPBIELH-JKSUJKDBSA-N -1 3 329.465 4.340 20 0 EIADHM CCCCS[C@H](C)C(=O)Nc1cc(Br)ccc1[O-] ZINC000530917366 1030796031 /nfs/dbraw/zinc/79/60/31/1030796031.db2.gz VYEFFCVDENJURE-SECBINFHSA-N -1 3 332.263 4.015 20 0 EIADHM O=C([O-])[C@@H](NCc1ccc(SC(F)(F)F)cc1)c1ccccc1 ZINC000321459963 1030821097 /nfs/dbraw/zinc/82/10/97/1030821097.db2.gz OUQQKQONNJYVOE-AWEZNQCLSA-N -1 3 341.354 4.214 20 0 EIADHM O=C([O-])[C@@H]1CCN(Cc2c(Cl)cccc2Oc2ccccc2)C1 ZINC000263420580 1030862056 /nfs/dbraw/zinc/86/20/56/1030862056.db2.gz OTIPCAZQXUOBCE-CYBMUJFWSA-N -1 3 331.799 4.039 20 0 EIADHM O=C(Nc1cc(Br)ccc1[O-])[C@H]1CCCc2ccccc21 ZINC000531155895 1030905764 /nfs/dbraw/zinc/90/57/64/1030905764.db2.gz TXUMRYRQLLMSQC-AWEZNQCLSA-N -1 3 346.224 4.213 20 0 EIADHM Cc1noc(-c2ccccc2)c1[N-]C(=O)c1csc(C(C)C)n1 ZINC000122679925 1030936641 /nfs/dbraw/zinc/93/66/41/1030936641.db2.gz YLKPUNGDODSPFK-UHFFFAOYSA-N -1 3 327.409 4.482 20 0 EIADHM O=C(c1ccccc1[O-])N1CCC([C@H](F)c2ccccc2F)CC1 ZINC000375994428 1031033093 /nfs/dbraw/zinc/03/30/93/1031033093.db2.gz VIWRPKWDKNEKIH-SFHVURJKSA-N -1 3 331.362 4.094 20 0 EIADHM C[C@H](c1ccccc1Cl)N(C(=O)Cc1ccc([O-])c(F)c1)C1CC1 ZINC000448758223 1031047778 /nfs/dbraw/zinc/04/77/78/1031047778.db2.gz BWHRUKSPVKBCRM-GFCCVEGCSA-N -1 3 347.817 4.479 20 0 EIADHM Cc1cccc(CN2CCC(c3ccccc3C(=O)[O-])CC2)c1F ZINC000666585819 1031050444 /nfs/dbraw/zinc/05/04/44/1031050444.db2.gz IAEJOJLDTSQJJZ-UHFFFAOYSA-N -1 3 327.399 4.212 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1csc(-c2ccc(O)cc2)n1 ZINC000728607391 1031228661 /nfs/dbraw/zinc/22/86/61/1031228661.db2.gz PEJGGOHFQGPGAO-UHFFFAOYSA-N -1 3 346.795 4.127 20 0 EIADHM C[C@H](/N=C/c1cc(Cl)ccc1[O-])c1ccc(N2CCCC2=O)cc1 ZINC000065829854 1031296842 /nfs/dbraw/zinc/29/68/42/1031296842.db2.gz LINGFZBCZAAGDM-XMOVILSBSA-N -1 3 342.826 4.353 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2ccc(OC(F)F)cc2)cc1Cl ZINC000034261570 1031429845 /nfs/dbraw/zinc/42/98/45/1031429845.db2.gz OBYSWQJRCCYRTE-UHFFFAOYSA-N -1 3 347.770 4.051 20 0 EIADHM Cc1cnc(F)c([C@H](C)Oc2cccc([O-])c2Br)c1 ZINC001229141671 1031512237 /nfs/dbraw/zinc/51/22/37/1031512237.db2.gz LTTHHHWHRBPQGU-VIFPVBQESA-N -1 3 326.165 4.137 20 0 EIADHM CC(C)(Cc1ccccc1)c1noc(Cc2ccc([O-])c(F)c2)n1 ZINC000453163729 1031669995 /nfs/dbraw/zinc/66/99/95/1031669995.db2.gz JGTJQFXPANBQDN-UHFFFAOYSA-N -1 3 326.371 4.025 20 0 EIADHM CCOc1cc(-c2ccccc2)sc1C(=O)[N-]c1nnc(C)s1 ZINC000045593710 1031693028 /nfs/dbraw/zinc/69/30/28/1031693028.db2.gz RHYLVZWDJAOUCK-UHFFFAOYSA-N -1 3 345.449 4.226 20 0 EIADHM Cc1c(NCc2cccc([O-])c2Br)cccc1N(C)C ZINC000459368490 1031959616 /nfs/dbraw/zinc/95/96/16/1031959616.db2.gz YCMUPLIKIISORI-UHFFFAOYSA-N -1 3 335.245 4.141 20 0 EIADHM [O-]c1cccc(CNCc2ccc(OC(F)(F)F)cc2)c1Cl ZINC000645143956 1033837110 /nfs/dbraw/zinc/83/71/10/1033837110.db2.gz MNGBFQHEFMXKOB-UHFFFAOYSA-N -1 3 331.721 4.234 20 0 EIADHM Cc1ccc(OC(F)F)c(CNCc2cccc([O-])c2Cl)c1 ZINC000645161331 1033899997 /nfs/dbraw/zinc/89/99/97/1033899997.db2.gz IVXYCMSTNRLNKZ-UHFFFAOYSA-N -1 3 327.758 4.245 20 0 EIADHM O=C(c1cc([O-])ccc1Cl)N1CCCCC[C@@H]1[C@H]1CCCCC1=O ZINC000433367136 1034281165 /nfs/dbraw/zinc/28/11/65/1034281165.db2.gz PVLQGTNSFVLHLY-RHSMWYFYSA-N -1 3 349.858 4.190 20 0 EIADHM [O-]c1cccc(CN(CCCO)[C@@H]2CCCc3ccccc32)c1Cl ZINC000508821600 1034292083 /nfs/dbraw/zinc/29/20/83/1034292083.db2.gz HJMMHJDREGLALB-GOSISDBHSA-N -1 3 345.870 4.308 20 0 EIADHM O=C(OCc1nc(Cl)ccc1Cl)c1cc(Cl)c(Cl)[n-]1 ZINC000729204495 1034749612 /nfs/dbraw/zinc/74/96/12/1034749612.db2.gz WWISTHCABLXPPR-UHFFFAOYSA-N -1 3 339.993 4.380 20 0 EIADHM CCCn1nccc1C1CCN(Cc2cccc([O-])c2Cl)CC1 ZINC000513516369 1035000762 /nfs/dbraw/zinc/00/07/62/1035000762.db2.gz VMOKYZFLGNGMHN-UHFFFAOYSA-N -1 3 333.863 4.032 20 0 EIADHM O=C(Nc1ccc(Cl)cc1[O-])c1ccccc1Oc1ccncc1 ZINC000513622519 1035063634 /nfs/dbraw/zinc/06/36/34/1035063634.db2.gz TWZKTCFRRQEPEI-UHFFFAOYSA-N -1 3 340.766 4.485 20 0 EIADHM CCc1cc(C(=O)Nc2cc(F)ccc2[O-])c2c(n1)onc2C(C)C ZINC000513627187 1035076860 /nfs/dbraw/zinc/07/68/60/1035076860.db2.gz MFUINAKZDAPMCR-UHFFFAOYSA-N -1 3 343.358 4.006 20 0 EIADHM O=C(OCc1cccc(C(F)(F)F)c1)c1cc(-c2ccco2)[n-]n1 ZINC000913299276 1035632022 /nfs/dbraw/zinc/63/20/22/1035632022.db2.gz YDBFJFAHZDQENI-UHFFFAOYSA-N -1 3 336.269 4.046 20 0 EIADHM O=C(OCc1cccc(C(F)(F)F)c1)c1cc(-c2ccco2)n[n-]1 ZINC000913299276 1035632050 /nfs/dbraw/zinc/63/20/50/1035632050.db2.gz YDBFJFAHZDQENI-UHFFFAOYSA-N -1 3 336.269 4.046 20 0 EIADHM CC(C)(C)Oc1ccc(-c2nc3cc(Cl)ccc3c(=O)[n-]2)cc1 ZINC000485343140 1035837279 /nfs/dbraw/zinc/83/72/79/1035837279.db2.gz GPWCXBCJMCDFRW-UHFFFAOYSA-N -1 3 328.799 4.421 20 0 EIADHM COc1ccc([O-])c(C(=O)Nc2ccc(NC3CCCCC3)cc2)c1 ZINC000586758278 1035838523 /nfs/dbraw/zinc/83/85/23/1035838523.db2.gz CMLFZPHWLZXHPM-UHFFFAOYSA-N -1 3 340.423 4.398 20 0 EIADHM COc1cccc(C(=O)Nc2ccc(NC3CCCCC3)cc2)c1[O-] ZINC000586758319 1035839180 /nfs/dbraw/zinc/83/91/80/1035839180.db2.gz SRYHXTSFFYBFOY-UHFFFAOYSA-N -1 3 340.423 4.398 20 0 EIADHM Cc1ccc(C(=O)Nc2cccc(NC(=O)OCC(C)C)c2)c([O-])c1 ZINC000060046058 1035843658 /nfs/dbraw/zinc/84/36/58/1035843658.db2.gz KJRYRRDXSRGVKY-UHFFFAOYSA-N -1 3 342.395 4.157 20 0 EIADHM Cc1ccc(C(=O)Nc2ccc3oc(C(F)(F)F)nc3c2)c([O-])c1 ZINC000195748926 1035884838 /nfs/dbraw/zinc/88/48/38/1035884838.db2.gz WVKRLULTQFQCCM-UHFFFAOYSA-N -1 3 336.269 4.113 20 0 EIADHM COc1ccc(C)cc1S(=O)(=O)[N-]c1c(C)c(C)ccc1Cl ZINC000571682101 1036117399 /nfs/dbraw/zinc/11/73/99/1036117399.db2.gz TXWGYJIOOYJVGK-UHFFFAOYSA-N -1 3 339.844 4.075 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@H]3CCc4cc(C)ccc43)nc2)n1 ZINC000597924936 1036388228 /nfs/dbraw/zinc/38/82/28/1036388228.db2.gz AYVGSLGDNRZNKJ-SFHVURJKSA-N -1 3 346.434 4.214 20 0 EIADHM O=C([O-])c1ccc(-c2nc(CN3CCC[C@@H]4CCC[C@H]43)cs2)cc1 ZINC000572127674 1036439537 /nfs/dbraw/zinc/43/95/37/1036439537.db2.gz NOBKQSJUNJOHKM-SUMWQHHRSA-N -1 3 342.464 4.273 20 0 EIADHM [O-]c1ccc(Br)cc1/C=N/CCSc1ccccc1 ZINC000061002251 1036760995 /nfs/dbraw/zinc/76/09/95/1036760995.db2.gz BOVHYQUOGREWRY-GZTJUZNOSA-N -1 3 336.254 4.366 20 0 EIADHM Cc1ccc(CCC(=O)Nc2cc(Br)ccc2[O-])s1 ZINC000572534919 1036788884 /nfs/dbraw/zinc/78/88/84/1036788884.db2.gz YWQMLVOAKGKZOM-UHFFFAOYSA-N -1 3 340.242 4.096 20 0 EIADHM O=C(CCOc1ccccc1-c1ccccc1)[N-]OCc1ccccc1 ZINC000031616461 1036832301 /nfs/dbraw/zinc/83/23/01/1036832301.db2.gz DXNUDQQRFAJFEK-UHFFFAOYSA-N -1 3 347.414 4.371 20 0 EIADHM Cc1onc(OC(F)F)c1[N-]C(=O)c1coc2ccc(Cl)cc12 ZINC001269193416 1036873690 /nfs/dbraw/zinc/87/36/90/1036873690.db2.gz YFBNVGQFUWZENS-UHFFFAOYSA-N -1 3 342.685 4.236 20 0 EIADHM CN(C)Cc1ccccc1C(=O)Nc1cc(Cl)cc(Cl)c1[O-] ZINC000486894402 1036883926 /nfs/dbraw/zinc/88/39/26/1036883926.db2.gz FQHJGSHYOHNAGK-UHFFFAOYSA-N -1 3 339.222 4.013 20 0 EIADHM Cc1sc2[n-]c([C@@H](C)OC(=O)CCC3(C)CC3)nc(=O)c2c1C ZINC000910038399 1037277823 /nfs/dbraw/zinc/27/78/23/1037277823.db2.gz SHZJXSBSVJNZLS-SNVBAGLBSA-N -1 3 334.441 4.198 20 0 EIADHM CSc1ccc([O-])c(C(=O)N2C[C@@H](c3ccccc3)C[C@@H]2C)c1 ZINC000668808116 1037289262 /nfs/dbraw/zinc/28/92/62/1037289262.db2.gz NICUXXHMXMURGJ-ZFWWWQNUSA-N -1 3 327.449 4.132 20 0 EIADHM C[C@@H]1CCN([C@H](C(=O)[O-])c2ccc(Cl)c(Cl)c2)CC1(C)C ZINC000573616243 1037602347 /nfs/dbraw/zinc/60/23/47/1037602347.db2.gz ICXAPEKQDKFABR-YGRLFVJLSA-N -1 3 330.255 4.487 20 0 EIADHM O=C([N-]c1nc2ccsc2s1)c1cc(-c2cccc(F)c2)no1 ZINC000605116599 1037683834 /nfs/dbraw/zinc/68/38/34/1037683834.db2.gz OPAHXCRXYREOQN-UHFFFAOYSA-N -1 3 345.380 4.404 20 0 EIADHM Cc1ccccc1-c1cc(=NC(=O)CCc2cc(Cl)cs2)[nH][n-]1 ZINC000605885073 1037868452 /nfs/dbraw/zinc/86/84/52/1037868452.db2.gz ZTOVTCIJUMOSMK-UHFFFAOYSA-N -1 3 345.855 4.093 20 0 EIADHM CCc1cc2c(CSc3cccc(OC)c3)cc(=O)oc2cc1[O-] ZINC000058627368 1037891810 /nfs/dbraw/zinc/89/18/10/1037891810.db2.gz LOJYFDMFHUNQIR-UHFFFAOYSA-N -1 3 342.416 4.362 20 0 EIADHM S=c1[n-]nc(Cc2cccs2)n1CN1CCC2(C1)CCCCC2 ZINC000172938157 1038019383 /nfs/dbraw/zinc/01/93/83/1038019383.db2.gz JKYQCHSFCAQLTJ-UHFFFAOYSA-N -1 3 348.541 4.207 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)c1ccccc1CCc1ccccc1 ZINC000606537040 1038152268 /nfs/dbraw/zinc/15/22/68/1038152268.db2.gz YQAUTNICPRBBDU-UHFFFAOYSA-N -1 3 349.405 4.247 20 0 EIADHM Cc1oc([C@@H](C)N(C)CCCOc2ccccc2C)cc1C(=O)[O-] ZINC000574406919 1038211902 /nfs/dbraw/zinc/21/19/02/1038211902.db2.gz XYFPWVWFHSNDLP-CQSZACIVSA-N -1 3 331.412 4.057 20 0 EIADHM CC(C)OCc1c2ccccc2oc1C(=O)Nc1cc(F)ccc1[O-] ZINC000533964301 1038257021 /nfs/dbraw/zinc/25/70/21/1038257021.db2.gz OCBIINGGVQMFCT-UHFFFAOYSA-N -1 3 343.354 4.455 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(NC3C[C@@H](C)C[C@H](C)C3)nc2)n1 ZINC000606895484 1038287468 /nfs/dbraw/zinc/28/74/68/1038287468.db2.gz IQKGOBXPEKPMOW-STQMWFEESA-N -1 3 326.444 4.043 20 0 EIADHM C[C@H](N=c1ncnc2[nH][n-]cc1-2)c1ccccc1-c1ccc(Cl)cc1 ZINC000606896624 1038289175 /nfs/dbraw/zinc/28/91/75/1038289175.db2.gz NZDWKAXYRRKCEH-LBPRGKRZSA-N -1 3 349.825 4.220 20 0 EIADHM Cc1ccc(-c2csc(CN(CCC(=O)[O-])CC(C)C)n2)cc1 ZINC000574644336 1038307521 /nfs/dbraw/zinc/30/75/21/1038307521.db2.gz FVPXQIQSBBPHLU-UHFFFAOYSA-N -1 3 332.469 4.051 20 0 EIADHM Cc1cc(F)c(CNCCC2(CC(=O)[O-])CCCCC2)c(F)c1 ZINC000424628796 1038972451 /nfs/dbraw/zinc/97/24/51/1038972451.db2.gz XKSAQSFWJNFJFI-UHFFFAOYSA-N -1 3 325.399 4.178 20 0 EIADHM CC(=O)c1cccc(NC(=O)c2ccc(F)cc2C(F)(F)F)c1[O-] ZINC000552069477 1039094141 /nfs/dbraw/zinc/09/41/41/1039094141.db2.gz WAPAAQPRECTXKL-UHFFFAOYSA-N -1 3 341.260 4.005 20 0 EIADHM CC(=O)c1cccc(NC(=O)C[C@H](C)c2ccc(F)cc2F)c1[O-] ZINC000552286022 1039338549 /nfs/dbraw/zinc/33/85/49/1039338549.db2.gz JCVSXELFRSBWRE-JTQLQIEISA-N -1 3 333.334 4.005 20 0 EIADHM Cc1cc(C)cc(CN(C)C(=O)CCCc2ccc([O-])c(F)c2)c1 ZINC000434345144 1039367291 /nfs/dbraw/zinc/36/72/91/1039367291.db2.gz VICSGRQTUGTNFH-UHFFFAOYSA-N -1 3 329.415 4.129 20 0 EIADHM O=C(Nc1nc2cc(F)c(F)cc2s1)c1cc([O-])ccc1Cl ZINC000555673777 1039517759 /nfs/dbraw/zinc/51/77/59/1039517759.db2.gz VJRJGULBZIFFIS-UHFFFAOYSA-N -1 3 340.738 4.186 20 0 EIADHM O=C(Nc1ccc([O-])c(C(F)(F)F)c1)c1c[nH]c2cc(F)ccc12 ZINC000434494832 1039544095 /nfs/dbraw/zinc/54/40/95/1039544095.db2.gz ZDOUCXWDGULHKU-UHFFFAOYSA-N -1 3 338.260 4.284 20 0 EIADHM CN(C(=O)c1cc(Cc2ccccc2)ccc1[O-])c1ccc(F)cc1 ZINC000537640152 1039619334 /nfs/dbraw/zinc/61/93/34/1039619334.db2.gz DGRIMILKOUCGAP-UHFFFAOYSA-N -1 3 335.378 4.399 20 0 EIADHM CC(C)(c1ccccc1)C1(NC(=O)c2cc([O-])ccc2Cl)CC1 ZINC000456820140 1039624774 /nfs/dbraw/zinc/62/47/74/1039624774.db2.gz WQXLPIJOJMULOS-UHFFFAOYSA-N -1 3 329.827 4.286 20 0 EIADHM CCOc1ccc(F)c([N-]C(=O)c2csc(C(C)(C)C)n2)c1F ZINC000534771823 1039773658 /nfs/dbraw/zinc/77/36/58/1039773658.db2.gz KIDCITCGSOHMLW-UHFFFAOYSA-N -1 3 340.395 4.370 20 0 EIADHM CCc1cccc(C(=O)N2CCCc3cc(OC(F)F)ccc32)c1[O-] ZINC000537643144 1039783452 /nfs/dbraw/zinc/78/34/52/1039783452.db2.gz OJUPVSUZSQWXEF-UHFFFAOYSA-N -1 3 347.361 4.149 20 0 EIADHM O=C(Nc1ncc(-c2ccccn2)s1)c1cc([O-])c2ccccc2c1 ZINC000552768226 1039807188 /nfs/dbraw/zinc/80/71/88/1039807188.db2.gz IGEFCBPXJFISLR-UHFFFAOYSA-N -1 3 347.399 4.316 20 0 EIADHM C[C@H](c1cccc(Cl)c1)N(C)C(=O)c1c[n-]c2ccccc2c1=O ZINC000097106392 1039864247 /nfs/dbraw/zinc/86/42/47/1039864247.db2.gz XYZVXKWPKPUIBT-GFCCVEGCSA-N -1 3 340.810 4.015 20 0 EIADHM CCc1cccc(C(=O)Nc2cnn([C@@H](C)CC)c2C2CC2)c1[O-] ZINC000537663627 1039876605 /nfs/dbraw/zinc/87/66/05/1039876605.db2.gz NRKOJOCWPRGFOL-LBPRGKRZSA-N -1 3 327.428 4.252 20 0 EIADHM CC(C)c1ncsc1C(=O)[N-]c1c2nsnc2ccc1Cl ZINC001126429823 1039929852 /nfs/dbraw/zinc/92/98/52/1039929852.db2.gz BNOQBGBSMZOYRV-UHFFFAOYSA-N -1 3 338.845 4.177 20 0 EIADHM COc1ccc([C@@H](C)NCc2cccc([O-])c2Br)cc1 ZINC000315407241 1040323769 /nfs/dbraw/zinc/32/37/69/1040323769.db2.gz RACPHXOCVJWUBH-LLVKDONJSA-N -1 3 336.229 4.014 20 0 EIADHM COc1ccc(C)cc1[C@@H](C)NC(=O)CCCc1ccc([O-])c(F)c1 ZINC000457958015 1040389855 /nfs/dbraw/zinc/38/98/55/1040389855.db2.gz RCAFHFQIRHDYDM-CQSZACIVSA-N -1 3 345.414 4.048 20 0 EIADHM COc1ccc(C)cc1[C@H](C)NC(=O)CCCc1ccc([O-])c(F)c1 ZINC000457944801 1040394835 /nfs/dbraw/zinc/39/48/35/1040394835.db2.gz RCAFHFQIRHDYDM-AWEZNQCLSA-N -1 3 345.414 4.048 20 0 EIADHM C[C@@H]1CCCN(Cc2csc(-c3cccc(C(=O)[O-])c3)n2)CC1 ZINC000515066795 1040459919 /nfs/dbraw/zinc/45/99/19/1040459919.db2.gz VJWQCQODYKOHQP-CYBMUJFWSA-N -1 3 330.453 4.130 20 0 EIADHM CCc1cc(=O)[n-]c(CN[C@H](C)c2ccc(Cl)c3ccccc32)n1 ZINC000462466800 1040623747 /nfs/dbraw/zinc/62/37/47/1040623747.db2.gz XPYZMGHNYHXPTH-GFCCVEGCSA-N -1 3 341.842 4.402 20 0 EIADHM CCC(CC)[C@H](NC(=O)c1cc(=O)[n-]c(C2CC2)n1)c1cccs1 ZINC000515310103 1040635996 /nfs/dbraw/zinc/63/59/96/1040635996.db2.gz NDXFATNNEYSIDJ-INIZCTEOSA-N -1 3 345.468 4.028 20 0 EIADHM Cc1ccc(C(=O)Cc2nc(=O)c3c4ccccc4sc3[n-]2)cc1 ZINC000462511097 1040699695 /nfs/dbraw/zinc/69/96/95/1040699695.db2.gz FOOWBBWQPLOIAD-UHFFFAOYSA-N -1 3 334.400 4.284 20 0 EIADHM Cc1oc(-c2ccccc2)nc1C(=O)[N-]c1cc(F)cc(F)c1F ZINC000554072616 1040762253 /nfs/dbraw/zinc/76/22/53/1040762253.db2.gz VKARJOOPMOLSFL-UHFFFAOYSA-N -1 3 332.281 4.320 20 0 EIADHM C[C@H]([N-]S(=O)(=O)c1cc(Cl)sc1Cl)c1ccsc1 ZINC000669844545 1040789145 /nfs/dbraw/zinc/78/91/45/1040789145.db2.gz WWWYISQHEHUQPO-LURJTMIESA-N -1 3 342.294 4.156 20 0 EIADHM CC(C)(C)C1CCC(CNC(=O)c2cc(=O)c3ccccc3[n-]2)CC1 ZINC000483270062 1040801829 /nfs/dbraw/zinc/80/18/29/1040801829.db2.gz JLRLBICNYUZZKM-UHFFFAOYSA-N -1 3 340.467 4.110 20 0 EIADHM CCc1cccc(C)c1[N-]S(=O)(=O)c1ccc(OC(C)C)c(C)c1 ZINC000515618681 1040902503 /nfs/dbraw/zinc/90/25/03/1040902503.db2.gz ZVHZAFFQDKJYON-UHFFFAOYSA-N -1 3 347.480 4.454 20 0 EIADHM CCCc1ccc(S(=O)(=O)[N-]c2cncc(Cl)c2Cl)cc1 ZINC000480076375 1040904354 /nfs/dbraw/zinc/90/43/54/1040904354.db2.gz HFKLBJJHLYEKKJ-UHFFFAOYSA-N -1 3 345.251 4.142 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2ccc(OC3CCCC3)cc2)cc1F ZINC000515630326 1040912796 /nfs/dbraw/zinc/91/27/96/1040912796.db2.gz ZUZGCSNIEOPBJI-UHFFFAOYSA-N -1 3 349.427 4.256 20 0 EIADHM CC(C)[C@H](C(=O)Nc1cc(Cl)c([O-])c(Cl)c1)N1CCCCC1 ZINC000539963374 1040961976 /nfs/dbraw/zinc/96/19/76/1040961976.db2.gz URRBTZVVBHWEBA-CQSZACIVSA-N -1 3 345.270 4.148 20 0 EIADHM CCCOc1ccc([N-]S(=O)(=O)c2ccc3c(c2)CCC3)c(C)c1 ZINC000515696811 1041002219 /nfs/dbraw/zinc/00/22/19/1041002219.db2.gz BCCYMEXTDGATOF-UHFFFAOYSA-N -1 3 345.464 4.073 20 0 EIADHM Cc1cccc(F)c1[N-]S(=O)(=O)Cc1c(Cl)cccc1Cl ZINC000194675925 1041008341 /nfs/dbraw/zinc/00/83/41/1041008341.db2.gz ZWDPPLXAQQXVRI-UHFFFAOYSA-N -1 3 348.226 4.383 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)NC[C@H](c1ccccc1)C1CC1 ZINC000554389221 1041056518 /nfs/dbraw/zinc/05/65/18/1041056518.db2.gz LUYIEQXKZPUOKM-GOSISDBHSA-N -1 3 341.426 4.164 20 0 EIADHM C[C@@H]1[C@@H](C(=O)[N-][C@@H](c2ccc(F)c(Cl)c2)C(F)(F)F)C1(F)F ZINC000436445916 1041248537 /nfs/dbraw/zinc/24/85/37/1041248537.db2.gz CVJWZQKRELIQNZ-BDGWPESGSA-N -1 3 345.670 4.100 20 0 EIADHM C[C@H](C(=O)[O-])[C@@H](NCc1ccc(C(F)(F)F)s1)c1ccccc1 ZINC000904005166 1041266415 /nfs/dbraw/zinc/26/64/15/1041266415.db2.gz PVPJAXQITYOARD-IINYFYTJSA-N -1 3 343.370 4.319 20 0 EIADHM Cc1ccc(NC(=O)c2ccc3ccccc3c2[O-])c(CN(C)C)c1 ZINC000436546190 1041323592 /nfs/dbraw/zinc/32/35/92/1041323592.db2.gz UFAAGUAIJNGTJK-UHFFFAOYSA-N -1 3 334.419 4.168 20 0 EIADHM CC[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)c1ccc(OC)cc1[O-] ZINC000436540845 1041333323 /nfs/dbraw/zinc/33/33/23/1041333323.db2.gz ULRBATNQLAXEBW-PKOBYXMFSA-N -1 3 339.435 4.199 20 0 EIADHM [O-]c1ccc(Cc2ccccc2)cc1-c1nc(-c2ccc(F)cn2)no1 ZINC000436559951 1041341049 /nfs/dbraw/zinc/34/10/49/1041341049.db2.gz AZXJCSHVVCXCCS-UHFFFAOYSA-N -1 3 347.349 4.234 20 0 EIADHM CC(C)c1ccc(C(=O)N[C@@H](c2nccs2)C(F)(F)F)c([O-])c1 ZINC000436565122 1041345581 /nfs/dbraw/zinc/34/55/81/1041345581.db2.gz RRPJDTJKZQKIOD-LBPRGKRZSA-N -1 3 344.358 4.006 20 0 EIADHM Cc1ccc(C(=O)N(C)c2cccc(OC(F)(F)F)c2)c([O-])c1C ZINC000436569160 1041349182 /nfs/dbraw/zinc/34/91/82/1041349182.db2.gz APWKKWBFPVLRAP-UHFFFAOYSA-N -1 3 339.313 4.184 20 0 EIADHM CC(C)c1ccc(C(=O)N(C)Cc2nc(-c3ccccc3)c[nH]2)c([O-])c1 ZINC000436594419 1041353834 /nfs/dbraw/zinc/35/38/34/1041353834.db2.gz FBWRMALKEFYNQE-UHFFFAOYSA-N -1 3 349.434 4.178 20 0 EIADHM CC(C)c1ccc(C(=O)NC[C@@H]2CCO[C@H]2c2ccccc2)c([O-])c1 ZINC000436586192 1041364221 /nfs/dbraw/zinc/36/42/21/1041364221.db2.gz ATZJDGVCCLGLSS-PXNSSMCTSA-N -1 3 339.435 4.023 20 0 EIADHM CC[C@@H](C)n1ncc(NC(=O)c2ccc(C)c(C)c2[O-])c1C1CC1 ZINC000436605444 1041367382 /nfs/dbraw/zinc/36/73/82/1041367382.db2.gz PKOPGMQSKMYUHN-GFCCVEGCSA-N -1 3 327.428 4.306 20 0 EIADHM CC1(C)CCc2sc(NC(=O)c3cc4c(cc3[O-])CCCC4)nc21 ZINC001142601407 1041390524 /nfs/dbraw/zinc/39/05/24/1041390524.db2.gz FYZWUPQUVWVWFQ-UHFFFAOYSA-N -1 3 342.464 4.204 20 0 EIADHM CCCn1ccc2cc(NC(=O)c3ccc(C(C)=O)c([O-])c3)ccc21 ZINC000436622359 1041391106 /nfs/dbraw/zinc/39/11/06/1041391106.db2.gz FULJVKOJEMQFNH-UHFFFAOYSA-N -1 3 336.391 4.212 20 0 EIADHM Cc1nc(-c2ccccc2)sc1[C@@H](C)NC(=O)c1ccccc1[O-] ZINC000436666477 1041406255 /nfs/dbraw/zinc/40/62/55/1041406255.db2.gz UAQJUHCSEKAJTC-GFCCVEGCSA-N -1 3 338.432 4.315 20 0 EIADHM Cc1cccc(CO[N-]C(=O)CCCCCO[C@@H]2CCC[C@@H](C)C2)n1 ZINC000898933768 1041414701 /nfs/dbraw/zinc/41/47/01/1041414701.db2.gz GKADXCANTQBIIH-VQIMIIECSA-N -1 3 348.487 4.094 20 0 EIADHM O=C(c1cc(Oc2ccccc2)ccc1[O-])N1CCC[C@@H]1C(F)F ZINC000436698990 1041429342 /nfs/dbraw/zinc/42/93/42/1041429342.db2.gz RTCOQTWEWKBVKU-OAHLLOKOSA-N -1 3 333.334 4.054 20 0 EIADHM Cc1ccc(Cl)cc1N(C)C(=O)c1ccc2c(c1[O-])OC(C)(C)C2 ZINC000436702280 1041433923 /nfs/dbraw/zinc/43/39/23/1041433923.db2.gz CKRKDPWPOVQFBE-UHFFFAOYSA-N -1 3 345.826 4.344 20 0 EIADHM Cc1ccc(C(=O)N(Cc2ccc([C@@H]3C[C@H]3C)o2)C2CC2)c([O-])c1 ZINC000436759886 1041457318 /nfs/dbraw/zinc/45/73/18/1041457318.db2.gz HVOLVPMKXGAVRY-CXAGYDPISA-N -1 3 325.408 4.222 20 0 EIADHM O=C(c1ccc(O)cc1[O-])N(Cc1ccc(F)cc1)C1CCCCC1 ZINC000436762583 1041460018 /nfs/dbraw/zinc/46/00/18/1041460018.db2.gz COJNOFVVVIVEBC-UHFFFAOYSA-N -1 3 343.398 4.212 20 0 EIADHM C[C@H](C1CC1)N(C(=O)c1cc(Cc2ccccc2)ccc1[O-])C1CC1 ZINC000436756691 1041467389 /nfs/dbraw/zinc/46/73/89/1041467389.db2.gz SPKISUSJKNIMDV-OAHLLOKOSA-N -1 3 335.447 4.386 20 0 EIADHM COc1ccc([C@@H](C)N(C)C(=O)c2ccc(C(C)C)cc2[O-])cc1 ZINC000436757174 1041467457 /nfs/dbraw/zinc/46/74/57/1041467457.db2.gz HHBBBRWCHRDITO-CQSZACIVSA-N -1 3 327.424 4.357 20 0 EIADHM O=C(Nc1cccc(-c2cnco2)c1)c1cc2c(cc1[O-])CCCC2 ZINC000436782893 1041479007 /nfs/dbraw/zinc/47/90/07/1041479007.db2.gz DOLPJKPVVKLIQX-UHFFFAOYSA-N -1 3 334.375 4.178 20 0 EIADHM O=C(c1ccccc1[O-])N1CCC[C@@H]1c1ccc(Br)cc1 ZINC000436809057 1041491795 /nfs/dbraw/zinc/49/17/95/1041491795.db2.gz RKGSSOMXTGFMOD-OAHLLOKOSA-N -1 3 346.224 4.132 20 0 EIADHM CC[C@@H](CSC)N(C)C(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436812961 1041492589 /nfs/dbraw/zinc/49/25/89/1041492589.db2.gz GFKSBAIRZWUJHB-KRWDZBQOSA-N -1 3 343.492 4.197 20 0 EIADHM CCc1ccc(C(=O)N(CCCCOC)Cc2ccccc2)c([O-])c1 ZINC000436812938 1041493979 /nfs/dbraw/zinc/49/39/79/1041493979.db2.gz YSGBZRBJBJNAEO-UHFFFAOYSA-N -1 3 341.451 4.024 20 0 EIADHM O=C(c1cc(Cc2ccccc2)ccc1[O-])N1CC2(CCC2)[C@@H]1C1CC1 ZINC000436819885 1041494218 /nfs/dbraw/zinc/49/42/18/1041494218.db2.gz ZQCVOTFOGYJQIL-NRFANRHFSA-N -1 3 347.458 4.388 20 0 EIADHM CCc1nc2c(s1)[C@@H](N(C)C(=O)c1ccc(CC)cc1[O-])CCC2 ZINC000436836687 1041498408 /nfs/dbraw/zinc/49/84/08/1041498408.db2.gz MTIVTHZTBGKKOV-HNNXBMFYSA-N -1 3 344.480 4.123 20 0 EIADHM CCc1ccc(C(=O)N2CCCCC[C@H]2[C@H]2CCCCC2=O)c([O-])c1 ZINC000436832586 1041499592 /nfs/dbraw/zinc/49/95/92/1041499592.db2.gz SQFRJGOQACVWDA-AEFFLSMTSA-N -1 3 343.467 4.099 20 0 EIADHM CCc1ccc(-c2nc(Cc3c[nH]c4cc(F)ccc34)no2)c([O-])c1 ZINC000436852619 1041518390 /nfs/dbraw/zinc/51/83/90/1041518390.db2.gz PCSARNYRMWDTKB-UHFFFAOYSA-N -1 3 337.354 4.216 20 0 EIADHM CCc1ccc(-c2nc(-c3ccc(Br)o3)no2)c([O-])c1 ZINC000436879897 1041537729 /nfs/dbraw/zinc/53/77/29/1041537729.db2.gz LSNMABUYJIGWDN-UHFFFAOYSA-N -1 3 335.157 4.027 20 0 EIADHM Cc1ncccc1-c1noc(-c2cc(Cc3ccccc3)ccc2[O-])n1 ZINC000436883291 1041539545 /nfs/dbraw/zinc/53/95/45/1041539545.db2.gz CYFBMBYZLCBRCY-UHFFFAOYSA-N -1 3 343.386 4.403 20 0 EIADHM CC(C)c1ccc(-c2nc([C@@H]3CCOc4ccccc43)no2)c([O-])c1 ZINC000436934396 1041564253 /nfs/dbraw/zinc/56/42/53/1041564253.db2.gz SMRJUSJYIQTXGO-OAHLLOKOSA-N -1 3 336.391 4.480 20 0 EIADHM [O-]c1cc2ccccc2cc1-c1nc(-c2ccc3nc[nH]c3c2)no1 ZINC000436937924 1041567569 /nfs/dbraw/zinc/56/75/69/1041567569.db2.gz HMSCRWGMVMKAGF-UHFFFAOYSA-N -1 3 328.331 4.139 20 0 EIADHM CSc1ccc(N(C)C(=O)c2ccc3c(c2[O-])CCCC3)cc1 ZINC000436965811 1041571255 /nfs/dbraw/zinc/57/12/55/1041571255.db2.gz OPAQEZKDABKSIZ-UHFFFAOYSA-N -1 3 327.449 4.270 20 0 EIADHM CN(CC1CCCC1)C(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436951580 1041572805 /nfs/dbraw/zinc/57/28/05/1041572805.db2.gz GILDKUARLSOCCG-UHFFFAOYSA-N -1 3 325.408 4.447 20 0 EIADHM O=c1[n-]c(CN(CC2CC2)c2ccccc2)nc2c3ccccc3oc21 ZINC000437526891 1041830649 /nfs/dbraw/zinc/83/06/49/1041830649.db2.gz JXCAXOUJTUEQCW-UHFFFAOYSA-N -1 3 345.402 4.498 20 0 EIADHM O=S(=O)([N-]Cc1ccc2ccccc2c1)c1cc(F)ccc1Cl ZINC000303222034 1042370061 /nfs/dbraw/zinc/37/00/61/1042370061.db2.gz VLXAKIKBGCSHOE-UHFFFAOYSA-N -1 3 349.814 4.111 20 0 EIADHM O=C(COc1cc(Cl)cc(Cl)c1)Nc1cc(Cl)ccc1[O-] ZINC000439097160 1042497854 /nfs/dbraw/zinc/49/78/54/1042497854.db2.gz LSNHXYADGLKVPY-UHFFFAOYSA-N -1 3 346.597 4.370 20 0 EIADHM Cc1ccc(CCC(=O)Nc2ccc(Br)cc2[O-])s1 ZINC000519036793 1042799532 /nfs/dbraw/zinc/79/95/32/1042799532.db2.gz HUXGIJXVYGXNNG-UHFFFAOYSA-N -1 3 340.242 4.096 20 0 EIADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)CC[C@@H](C)CC)c2)n1 ZINC000506718602 1042807069 /nfs/dbraw/zinc/80/70/69/1042807069.db2.gz JANAQRXTNOILEP-ZDUSSCGKSA-N -1 3 327.428 4.176 20 0 EIADHM CCc1ccc(C(=O)Nc2ccc(Oc3ncccn3)cc2C)c([O-])c1 ZINC000190399155 1042828892 /nfs/dbraw/zinc/82/88/92/1042828892.db2.gz FISBSFBKJBVELZ-UHFFFAOYSA-N -1 3 349.390 4.098 20 0 EIADHM CC(C)(C)c1nnc([N-]C(=O)c2ccc(F)c(Cl)c2F)s1 ZINC000181165419 1042866970 /nfs/dbraw/zinc/86/69/70/1042866970.db2.gz RJSVRLNLTHNGTA-UHFFFAOYSA-N -1 3 331.775 4.020 20 0 EIADHM CC[C@H]1CC[C@@H](C)N1Cc1csc(-c2ccc(C(=O)[O-])cc2)n1 ZINC000520594940 1042917885 /nfs/dbraw/zinc/91/78/85/1042917885.db2.gz YHACEVPGKUKKBP-WBMJQRKESA-N -1 3 330.453 4.271 20 0 EIADHM CCSc1nnc([N-]C(=O)c2cc3cc(Cl)ccc3o2)s1 ZINC000007807567 1042959483 /nfs/dbraw/zinc/95/94/83/1042959483.db2.gz JBGGPCGOZZIZNE-UHFFFAOYSA-N -1 3 339.829 4.302 20 0 EIADHM Cc1cc(=O)[n-]c([C@H](C)N2CC[C@H](Sc3cccc(Cl)c3)C2)n1 ZINC000429140705 1043078400 /nfs/dbraw/zinc/07/84/00/1043078400.db2.gz ZWECZSGEEWUALB-WFASDCNBSA-N -1 3 349.887 4.072 20 0 EIADHM O=C(c1cc(Oc2ccccc2)ccc1[O-])N1CC[C@@H](c2ccco2)C1 ZINC000673809706 1043080123 /nfs/dbraw/zinc/08/01/23/1043080123.db2.gz PVWGFCQDYJUMNB-OAHLLOKOSA-N -1 3 349.386 4.407 20 0 EIADHM O=C(Nc1csc(-c2ccncc2)n1)c1cc([O-])c2ccccc2c1 ZINC000355815190 1043125482 /nfs/dbraw/zinc/12/54/82/1043125482.db2.gz WEOOXOIIGUZQJF-UHFFFAOYSA-N -1 3 347.399 4.316 20 0 EIADHM Cc1ccc([N-]S(=O)(=O)c2c[nH]c3cccc(F)c32)c(Cl)c1 ZINC000185164243 1043160876 /nfs/dbraw/zinc/16/08/76/1043160876.db2.gz LXPPOLNVZKQKEO-UHFFFAOYSA-N -1 3 338.791 4.070 20 0 EIADHM CC[C@@H]1c2ccsc2CCN1Cc1cc(=O)oc2cc([O-])ccc12 ZINC000727366672 1043209692 /nfs/dbraw/zinc/20/96/92/1043209692.db2.gz PZEJKNIWGXZXNB-MRXNPFEDSA-N -1 3 341.432 4.070 20 0 EIADHM Cc1ccccc1C(C)(C)NC(=O)CCCc1ccc([O-])c(F)c1 ZINC000508006025 1043226501 /nfs/dbraw/zinc/22/65/01/1043226501.db2.gz OBAXXBCZXFPJLV-UHFFFAOYSA-N -1 3 329.415 4.214 20 0 EIADHM O=C(Nc1ccc(-c2cc[nH]n2)cc1)c1cc([O-])c2ccccc2c1 ZINC000525919448 1043234190 /nfs/dbraw/zinc/23/41/90/1043234190.db2.gz OYGACQBNTJACHK-UHFFFAOYSA-N -1 3 329.359 4.188 20 0 EIADHM Cc1cccc2c(CCNC(=O)c3cc([O-])c4ccccc4c3)c[nH]c21 ZINC000525934789 1043236258 /nfs/dbraw/zinc/23/62/58/1043236258.db2.gz ZDXMPWKEWQVKGQ-UHFFFAOYSA-N -1 3 344.414 4.308 20 0 EIADHM C[C@@H](CNC(=O)c1cc([O-])c2ccccc2c1)Cc1cccs1 ZINC000525934667 1043236733 /nfs/dbraw/zinc/23/67/33/1043236733.db2.gz HPNZBAAETOYEHT-CYBMUJFWSA-N -1 3 325.433 4.216 20 0 EIADHM CC(C)Oc1ccc(CNC(=O)c2cc([O-])c3ccccc3c2)cc1 ZINC000526901532 1043243621 /nfs/dbraw/zinc/24/36/21/1043243621.db2.gz DQTKIANZHADBKK-UHFFFAOYSA-N -1 3 335.403 4.263 20 0 EIADHM CC(C)n1ncc2cc(NC(=O)c3cc([O-])c4ccccc4c3)cnc21 ZINC000526908983 1043245850 /nfs/dbraw/zinc/24/58/50/1043245850.db2.gz VEHWMNNMBXIHRK-UHFFFAOYSA-N -1 3 346.390 4.123 20 0 EIADHM CCOc1cccc([C@H]2C[C@@H]2NC(=O)c2cc([O-])c3ccccc3c2)c1 ZINC000526921004 1043246231 /nfs/dbraw/zinc/24/62/31/1043246231.db2.gz FBLWHMWYOLGJOH-UXHICEINSA-N -1 3 347.414 4.230 20 0 EIADHM O=C(NCCc1ccc2ccccc2n1)c1cc([O-])c2ccccc2c1 ZINC000527162511 1043251340 /nfs/dbraw/zinc/25/13/40/1043251340.db2.gz OLFMNTUOXQULPH-UHFFFAOYSA-N -1 3 342.398 4.066 20 0 EIADHM C[C@H](c1cc2ccccc2o1)N(C)C(=O)NCc1ccc([O-])c(F)c1 ZINC000163690645 1043258267 /nfs/dbraw/zinc/25/82/67/1043258267.db2.gz ADNAMIGEBWWWHF-GFCCVEGCSA-N -1 3 342.370 4.180 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N1CCc2cc(F)c(F)cc21 ZINC000527448378 1043261177 /nfs/dbraw/zinc/26/11/77/1043261177.db2.gz UMJBMMBUTCNQLA-UHFFFAOYSA-N -1 3 325.314 4.027 20 0 EIADHM Cc1c(N[C@H](C)C(C)C)cccc1C(=O)NCc1ccc([O-])c(F)c1 ZINC000427944120 1043270731 /nfs/dbraw/zinc/27/07/31/1043270731.db2.gz CWKRJWHYGLAOGI-CQSZACIVSA-N -1 3 344.430 4.226 20 0 EIADHM O=C(N[C@H](c1cc(F)ccc1F)C(F)F)c1cc([O-])ccc1Cl ZINC000509196709 1043280647 /nfs/dbraw/zinc/28/06/47/1043280647.db2.gz PDZXOHOYTPAQCX-CYBMUJFWSA-N -1 3 347.695 4.060 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1cc(O)ccc1C(F)(F)F ZINC000189208906 1043479635 /nfs/dbraw/zinc/47/96/35/1043479635.db2.gz CWTLDVUFLOTJOB-UHFFFAOYSA-N -1 3 331.677 4.022 20 0 EIADHM Cc1ccc([O-])c(C(=O)Nc2ccccc2NC(=O)OC(C)(C)C)c1 ZINC000730965439 1043670006 /nfs/dbraw/zinc/67/00/06/1043670006.db2.gz WSFQGABMKQMICV-UHFFFAOYSA-N -1 3 342.395 4.300 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1cccnc1SC(F)F ZINC000731457599 1043759349 /nfs/dbraw/zinc/75/93/49/1043759349.db2.gz ZZKNUMJUVPDFHI-UHFFFAOYSA-N -1 3 330.743 4.008 20 0 EIADHM CC(C)(CCNC(=O)CCCc1ccc([O-])c(F)c1)c1ccccc1 ZINC000682475324 1043820163 /nfs/dbraw/zinc/82/01/63/1043820163.db2.gz ZHGURHFSERNFCX-UHFFFAOYSA-N -1 3 343.442 4.338 20 0 EIADHM CC(C)CCOC(=O)c1n[n-]c(-c2ccccc2)c1Br ZINC000731767778 1043821592 /nfs/dbraw/zinc/82/15/92/1043821592.db2.gz KHMASCADUSOUKL-UHFFFAOYSA-N -1 3 337.217 4.042 20 0 EIADHM COc1c(F)ccc(Nc2cc(Br)cc(F)c2[O-])c1F ZINC001212505723 1043823943 /nfs/dbraw/zinc/82/39/43/1043823943.db2.gz ZOVBRDZQZRAXDG-UHFFFAOYSA-N -1 3 348.118 4.324 20 0 EIADHM CC(C)Oc1cccc(CO[N-]C(=O)CCCc2ccccc2)c1 ZINC000732804288 1044007611 /nfs/dbraw/zinc/00/76/11/1044007611.db2.gz GQYSXJUYQZISKX-UHFFFAOYSA-N -1 3 327.424 4.045 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2cccc(F)c2Cl)c(Cl)c1 ZINC000675296325 1044134904 /nfs/dbraw/zinc/13/49/04/1044134904.db2.gz VEAWESRAJDRCID-UHFFFAOYSA-N -1 3 334.199 4.242 20 0 EIADHM [O-]c1ccc(-c2nc(-c3ccc(C(F)(F)F)c(Cl)c3)no2)nc1 ZINC001212557930 1044305564 /nfs/dbraw/zinc/30/55/64/1044305564.db2.gz IQIDNRIXMUZFCM-UHFFFAOYSA-N -1 3 341.676 4.176 20 0 EIADHM Cc1ccc(-c2ccccc2-c2noc(-c3ccc([O-])cn3)n2)cc1 ZINC001212558074 1044305965 /nfs/dbraw/zinc/30/59/65/1044305965.db2.gz QHHWMZHAIUGYOA-UHFFFAOYSA-N -1 3 329.359 4.480 20 0 EIADHM Cc1ccc(-c2ccccc2)c(-c2noc(-c3ccc([O-])cn3)n2)c1 ZINC001212558235 1044308754 /nfs/dbraw/zinc/30/87/54/1044308754.db2.gz XVELDLJURYULSW-UHFFFAOYSA-N -1 3 329.359 4.480 20 0 EIADHM Cc1cccc(C2=CCN(Cc3nnc(-c4ccccc4[O-])o3)CC2)c1 ZINC001168476012 1044618842 /nfs/dbraw/zinc/61/88/42/1044618842.db2.gz QJNZWRYRFIUAFL-UHFFFAOYSA-N -1 3 347.418 4.040 20 0 EIADHM S=c1nc(-c2ccccn2)[n-]n1CN1CCCC2(CCCCC2)C1 ZINC000735297613 1044786132 /nfs/dbraw/zinc/78/61/32/1044786132.db2.gz HSFIRBHBUAVVAZ-UHFFFAOYSA-N -1 3 343.500 4.006 20 0 EIADHM S=c1nc(-c2ccccn2)[n-]n1CN1CCC[C@H]1C1CCCCC1 ZINC000735296395 1044786967 /nfs/dbraw/zinc/78/69/67/1044786967.db2.gz TWIRWIARNADDHR-INIZCTEOSA-N -1 3 343.500 4.005 20 0 EIADHM Cc1ccc(NC(=O)[C@@H](C)OC(=O)c2cc3ccsc3[n-]2)c(C)c1 ZINC000914889377 1044852934 /nfs/dbraw/zinc/85/29/34/1044852934.db2.gz HVVSFCITSXXNRM-GFCCVEGCSA-N -1 3 342.420 4.030 20 0 EIADHM CCc1ccsc1C(=O)Nc1ccc(Br)cc1[O-] ZINC000097069347 1044988529 /nfs/dbraw/zinc/98/85/29/1044988529.db2.gz KNHOZTMBAUYFAC-UHFFFAOYSA-N -1 3 326.215 4.031 20 0 EIADHM O=C(Nc1cccc([O-])c1F)c1ccccc1SC(F)(F)F ZINC000762319948 1045181681 /nfs/dbraw/zinc/18/16/81/1045181681.db2.gz DRHXOKVBXVEAIF-UHFFFAOYSA-N -1 3 331.290 4.396 20 0 EIADHM COc1ccc2cc(/C=C\C(=O)Nc3cccc([O-])c3F)ccc2c1 ZINC000762321218 1045184346 /nfs/dbraw/zinc/18/43/46/1045184346.db2.gz ZIACQRCEYGEKNR-POHAHGRESA-N -1 3 337.350 4.345 20 0 EIADHM Cc1noc(C(F)F)c1C(=O)[N-]c1sccc1C(=O)C(C)(C)C ZINC000673699766 1045211726 /nfs/dbraw/zinc/21/17/26/1045211726.db2.gz QNALFTPUNHEWGM-UHFFFAOYSA-N -1 3 342.367 4.463 20 0 EIADHM CC[C@@H]([N-]C(=O)C(F)(F)c1ccccc1)c1cc(F)ccc1F ZINC000740798495 1045223587 /nfs/dbraw/zinc/22/35/87/1045223587.db2.gz AGDFQFIYDWKWCW-OAHLLOKOSA-N -1 3 325.305 4.324 20 0 EIADHM CC(C)(C)[C@@H]1CN(C(=O)c2nnc3ccccc3c2[O-])c2ccccc21 ZINC000768108544 1045717911 /nfs/dbraw/zinc/71/79/11/1045717911.db2.gz QLGRLGAZWFYAOQ-OAHLLOKOSA-N -1 3 347.418 4.126 20 0 EIADHM C[C@H](CC(=O)c1cccs1)NC(=O)c1cc2sccc2c([O-])c1 ZINC000791385834 1045729313 /nfs/dbraw/zinc/72/93/13/1045729313.db2.gz ADPZPSFZALZGLA-SNVBAGLBSA-N -1 3 345.445 4.060 20 0 EIADHM CCCO[C@H]1CCCN(C(=O)c2cc3sccc3c([O-])c2)CC1 ZINC000791361894 1045731165 /nfs/dbraw/zinc/73/11/65/1045731165.db2.gz XKIUVAUVYNNAGB-AWEZNQCLSA-N -1 3 333.453 4.028 20 0 EIADHM CCC(CC)[C@H]1C[C@@H](NC(=O)c2cc3sccc3c([O-])c2)CCO1 ZINC000791398025 1045736376 /nfs/dbraw/zinc/73/63/76/1045736376.db2.gz FPVYGPDTFREPEF-WMLDXEAASA-N -1 3 347.480 4.321 20 0 EIADHM Cc1cc(=O)[n-]c(CS[C@@H](C)c2ccccc2Br)n1 ZINC000763209319 1045750955 /nfs/dbraw/zinc/75/09/55/1045750955.db2.gz FKEHQCRKMYEWCF-JTQLQIEISA-N -1 3 339.258 4.248 20 0 EIADHM [O-]c1ccc(Nc2c(F)ccc(Br)c2F)c(F)c1F ZINC001212016146 1045839456 /nfs/dbraw/zinc/83/94/56/1045839456.db2.gz AEQJTETZJLVFDK-UHFFFAOYSA-N -1 3 336.082 4.455 20 0 EIADHM [O-]c1ccc(Nc2nc(Cl)c(Cl)nc2Cl)c(F)c1F ZINC001212005556 1045825746 /nfs/dbraw/zinc/82/57/46/1045825746.db2.gz NIAQMMUJZHAXAN-UHFFFAOYSA-N -1 3 326.517 4.164 20 0 EIADHM [O-]c1ccc(Nc2cc(F)c(Br)c(F)c2)c(F)c1F ZINC001212007706 1045829282 /nfs/dbraw/zinc/82/92/82/1045829282.db2.gz YUPBJUNIMCWWNP-UHFFFAOYSA-N -1 3 336.082 4.455 20 0 EIADHM [O-]c1ccc(Nc2c(Br)ccc(F)c2F)c(F)c1F ZINC001212016513 1045840005 /nfs/dbraw/zinc/84/00/05/1045840005.db2.gz UCPNKOVQVSOVGK-UHFFFAOYSA-N -1 3 336.082 4.455 20 0 EIADHM CCCOc1ccc([N-]S(=O)(=O)c2cc(C)ccc2C)c(C)c1 ZINC000614884943 1045921136 /nfs/dbraw/zinc/92/11/36/1045921136.db2.gz MNQVYCUUAGGLOX-UHFFFAOYSA-N -1 3 333.453 4.201 20 0 EIADHM C[C@@H]1CCN(Cc2nc(=O)c3c(-c4ccco4)csc3[n-]2)C[C@H]1C ZINC000253556523 1046059884 /nfs/dbraw/zinc/05/98/84/1046059884.db2.gz ICKFEMJZTWCHJX-VXGBXAGGSA-N -1 3 343.452 4.135 20 0 EIADHM CC1CCC(C)(CNC(=O)c2cc([O-])cc(Br)c2)CC1 ZINC001156777127 1046112889 /nfs/dbraw/zinc/11/28/89/1046112889.db2.gz DOKVSNKFSITVHC-UHFFFAOYSA-N -1 3 340.261 4.101 20 0 EIADHM Cc1sc2[n-]c([C@H](C)OC(=O)C3=C(C)CCC3)nc(=O)c2c1C ZINC000747166964 1046363217 /nfs/dbraw/zinc/36/32/17/1046363217.db2.gz HXWUHWXNAXTYNU-JTQLQIEISA-N -1 3 332.425 4.118 20 0 EIADHM CCc1ccc(N(CC(C)C)C(=O)c2nnc3ccccc3c2[O-])cc1 ZINC000794128251 1046373071 /nfs/dbraw/zinc/37/30/71/1046373071.db2.gz SIQOMZYIFKPKCI-UHFFFAOYSA-N -1 3 349.434 4.201 20 0 EIADHM Cc1nc([C@H](C)N(C)CCCC(=O)[O-])oc1-c1ccc(Cl)cc1 ZINC000455646418 1046381667 /nfs/dbraw/zinc/38/16/67/1046381667.db2.gz PVXCBWQCKJWRII-LBPRGKRZSA-N -1 3 336.819 4.161 20 0 EIADHM CCc1ncc(C(=O)[N-]c2nnc(-c3ccc(C)cc3C)s2)s1 ZINC000065086068 1046382200 /nfs/dbraw/zinc/38/22/00/1046382200.db2.gz REXUQKDCJKKFJI-UHFFFAOYSA-N -1 3 344.465 4.093 20 0 EIADHM O=C(C[C@@H]1CCCN1Cc1cccc([O-])c1Cl)c1ccccc1 ZINC000508757709 1046530196 /nfs/dbraw/zinc/53/01/96/1046530196.db2.gz DXOFAFDZHCAYLN-INIZCTEOSA-N -1 3 329.827 4.283 20 0 EIADHM [O-]c1cccc(CN[C@@H](c2cccs2)C2CC2)c1Br ZINC000459396932 1046596276 /nfs/dbraw/zinc/59/62/76/1046596276.db2.gz WYEJFBQLLXULIL-OAHLLOKOSA-N -1 3 338.270 4.457 20 0 EIADHM [O-]c1cccc(CN[C@@H]2CCc3cc(F)ccc32)c1Br ZINC000459392091 1046609771 /nfs/dbraw/zinc/60/97/71/1046609771.db2.gz KZTYBSGURBPVIY-CQSZACIVSA-N -1 3 336.204 4.071 20 0 EIADHM CCc1onc(-c2ccccc2)c1C(=O)[N-]c1ccnc(Cl)c1F ZINC001129745618 1046711571 /nfs/dbraw/zinc/71/15/71/1046711571.db2.gz MEWLWIZKFWMPFM-UHFFFAOYSA-N -1 3 345.761 4.344 20 0 EIADHM Cc1cccc2c1OCC[C@H]2NCc1cccc([O-])c1Br ZINC000459489427 1046733710 /nfs/dbraw/zinc/73/37/10/1046733710.db2.gz APXGTQARGVEKMH-CQSZACIVSA-N -1 3 348.240 4.077 20 0 EIADHM C[C@@H](Sc1ccccc1Cl)C(=O)Nc1cccc([O-])c1F ZINC000128201126 1046779919 /nfs/dbraw/zinc/77/99/19/1046779919.db2.gz DOWBURWOGOJAIK-SECBINFHSA-N -1 3 325.792 4.304 20 0 EIADHM O=C(OCc1ccc(OCc2ccncc2)cc1)c1cc2occc2[n-]1 ZINC000786032992 1046803810 /nfs/dbraw/zinc/80/38/10/1046803810.db2.gz HDOFWWKOINICGC-UHFFFAOYSA-N -1 3 348.358 4.092 20 0 EIADHM O=C(OCc1ccccc1OCC(F)(F)F)c1cc2occc2[n-]1 ZINC000786029011 1046804342 /nfs/dbraw/zinc/80/43/42/1046804342.db2.gz BTCHQSIUPVYQCY-UHFFFAOYSA-N -1 3 339.269 4.059 20 0 EIADHM CC1(C)CN(Cc2cccc([O-])c2Br)[C@H]1c1ccncc1 ZINC000459600195 1046804910 /nfs/dbraw/zinc/80/49/10/1046804910.db2.gz ZKFRQMAJWBLAIA-INIZCTEOSA-N -1 3 347.256 4.133 20 0 EIADHM C[C@@H](O)c1cc(NC(=O)c2cc3sccc3c([O-])c2)ccc1F ZINC000804802353 1046807178 /nfs/dbraw/zinc/80/71/78/1046807178.db2.gz HRIIIDMNALBPBZ-SECBINFHSA-N -1 3 331.368 4.052 20 0 EIADHM O=C(OCc1ncc(Cl)s1)c1cc2sccc2c([O-])c1 ZINC000786142200 1046812531 /nfs/dbraw/zinc/81/25/31/1046812531.db2.gz UIAZWFRNVOKBDV-UHFFFAOYSA-N -1 3 325.798 4.074 20 0 EIADHM CC[C@H](NC(=O)CCCc1ccc([O-])c(F)c1)c1ccccc1OC ZINC000786762647 1046866386 /nfs/dbraw/zinc/86/63/86/1046866386.db2.gz MUFAMFDJHCBSRB-KRWDZBQOSA-N -1 3 345.414 4.130 20 0 EIADHM O=C(Nc1cccc([O-])c1F)c1ccc(OC2CCC2)cc1Cl ZINC000128454587 1046875899 /nfs/dbraw/zinc/87/58/99/1046875899.db2.gz AIPQUDXPRKHSFK-UHFFFAOYSA-N -1 3 335.762 4.368 20 0 EIADHM O=C(Nc1cccc([O-])c1F)c1ccc(COc2ccc(F)cc2)o1 ZINC000128528560 1046916547 /nfs/dbraw/zinc/91/65/47/1046916547.db2.gz DBCPIUWBMYQULJ-UHFFFAOYSA-N -1 3 345.301 4.095 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)OCc1ccc(Cl)s1 ZINC000787847934 1047061145 /nfs/dbraw/zinc/06/11/45/1047061145.db2.gz JZNHIPRZTZOCHG-UHFFFAOYSA-N -1 3 328.792 4.312 20 0 EIADHM CN(C(=O)c1cc2sccc2c([O-])c1)[C@H]1CCc2ccccc2C1 ZINC000788299327 1047154023 /nfs/dbraw/zinc/15/40/23/1047154023.db2.gz RTYQTWQKNNYBIH-INIZCTEOSA-N -1 3 337.444 4.236 20 0 EIADHM CCN(CCc1ccccc1)C(=O)c1cc2sccc2c([O-])c1 ZINC000788288409 1047158900 /nfs/dbraw/zinc/15/89/00/1047158900.db2.gz QMXXZKHBGHYVJQ-UHFFFAOYSA-N -1 3 325.433 4.312 20 0 EIADHM Cc1csc(-c2cccc(C(=O)Nc3cccc([O-])c3F)c2)n1 ZINC000129155458 1047319852 /nfs/dbraw/zinc/31/98/52/1047319852.db2.gz HJLHMZLSCVEFMU-UHFFFAOYSA-N -1 3 328.368 4.216 20 0 EIADHM O=C(Nc1cccc([O-])c1F)c1ccccc1C(=O)c1ccccc1 ZINC000129246771 1047338193 /nfs/dbraw/zinc/33/81/93/1047338193.db2.gz VHXYWIQLYXXZRN-UHFFFAOYSA-N -1 3 335.334 4.015 20 0 EIADHM O=C(Nc1cc(Br)ccc1[O-])c1cc(Cl)cs1 ZINC000760474225 1047382016 /nfs/dbraw/zinc/38/20/16/1047382016.db2.gz YRFIMZCAXZZJMV-UHFFFAOYSA-N -1 3 332.606 4.122 20 0 EIADHM O=C(Nc1ccc([O-])c(-c2nc3ccccc3s2)c1)c1ccccn1 ZINC000129479944 1047401858 /nfs/dbraw/zinc/40/18/58/1047401858.db2.gz UESAAPUPPUKXHD-UHFFFAOYSA-N -1 3 347.399 4.316 20 0 EIADHM CC(C)CCc1nnc([N-]C(=O)c2ccc(F)c(Cl)c2F)s1 ZINC001130914377 1047448186 /nfs/dbraw/zinc/44/81/86/1047448186.db2.gz CVFPHZUZJPQQLK-UHFFFAOYSA-N -1 3 345.802 4.311 20 0 EIADHM COc1ccc(C(=O)Nc2cc(Cl)ccc2[O-])c(OC(C)C)c1 ZINC000476311462 1047456599 /nfs/dbraw/zinc/45/65/99/1047456599.db2.gz DWCDSFULUWLHBS-UHFFFAOYSA-N -1 3 335.787 4.094 20 0 EIADHM CC(=O)c1cccc(NC(=O)c2ccnc(SC(C)(C)C)c2)c1[O-] ZINC000808188846 1047622566 /nfs/dbraw/zinc/62/25/66/1047622566.db2.gz DZLOXFAXDSPOBZ-UHFFFAOYSA-N -1 3 344.436 4.133 20 0 EIADHM O=C(CCc1ccnc2ccccc12)Nc1ccc(Cl)cc1[O-] ZINC000533159566 1047759840 /nfs/dbraw/zinc/75/98/40/1047759840.db2.gz JGDKNHLFVVUZET-UHFFFAOYSA-N -1 3 326.783 4.165 20 0 EIADHM CC(C)c1cccc(S(=O)(=O)[N-]c2ccc(Cl)cc2F)c1 ZINC000460425517 1047783197 /nfs/dbraw/zinc/78/31/97/1047783197.db2.gz MFQYKRBVLDBEHF-UHFFFAOYSA-N -1 3 327.808 4.403 20 0 EIADHM Cc1noc(-c2ccccc2)c1[N-]C(=O)c1ncccc1C(F)(F)F ZINC000130906681 1047813569 /nfs/dbraw/zinc/81/35/69/1047813569.db2.gz MFTFGSZHNWCAAO-UHFFFAOYSA-N -1 3 347.296 4.316 20 0 EIADHM Cc1ccc(-c2cc(C(=O)OCc3csc(C(C)(C)C)n3)n[n-]2)o1 ZINC000919329816 1047813911 /nfs/dbraw/zinc/81/39/11/1047813911.db2.gz VPEYSKXJJNCBPC-UHFFFAOYSA-N -1 3 345.424 4.089 20 0 EIADHM Cc1ccc(-c2cc(C(=O)OCc3csc(C(C)(C)C)n3)[n-]n2)o1 ZINC000919329816 1047813912 /nfs/dbraw/zinc/81/39/12/1047813912.db2.gz VPEYSKXJJNCBPC-UHFFFAOYSA-N -1 3 345.424 4.089 20 0 EIADHM CC(C)c1cccc(S(=O)(=O)[N-]c2cc(Cl)ccc2F)c1 ZINC000460431549 1047814503 /nfs/dbraw/zinc/81/45/03/1047814503.db2.gz WCRUVRROMQNCMB-UHFFFAOYSA-N -1 3 327.808 4.403 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N1CCc2c(Cl)cccc2C1 ZINC001136877009 1047869537 /nfs/dbraw/zinc/86/95/37/1047869537.db2.gz JFTXTXGPSQDBMP-UHFFFAOYSA-N -1 3 337.806 4.397 20 0 EIADHM COC(C)(C)[C@H](C)[N-]C(=O)C(F)(F)c1cccc(Cl)c1Cl ZINC001134162454 1047889077 /nfs/dbraw/zinc/88/90/77/1047889077.db2.gz DBDLWVNMWRPTEI-QMMMGPOBSA-N -1 3 340.197 4.015 20 0 EIADHM CCSCC[C@H](C)NC(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC001137012769 1048063659 /nfs/dbraw/zinc/06/36/59/1048063659.db2.gz KDEKZGXPZXPBHK-HNNXBMFYSA-N -1 3 343.492 4.245 20 0 EIADHM CCCOc1ccc(Cl)cc1C(=O)Nc1cccc(C(C)=O)c1[O-] ZINC000556893702 1048135738 /nfs/dbraw/zinc/13/57/38/1048135738.db2.gz YQHOMTDRGPPWDI-UHFFFAOYSA-N -1 3 347.798 4.289 20 0 EIADHM O=C(Nc1cc(F)ccc1[O-])c1c[nH]c2cccc(Br)c21 ZINC000132128421 1048208904 /nfs/dbraw/zinc/20/89/04/1048208904.db2.gz MFJJKGXUQXTVHW-UHFFFAOYSA-N -1 3 349.159 4.027 20 0 EIADHM O=C(NCC=C(Cl)Cl)c1cc(Cc2ccccc2)ccc1[O-] ZINC001143857721 1048252215 /nfs/dbraw/zinc/25/22/15/1048252215.db2.gz MWQRLMYSQXBELA-UHFFFAOYSA-N -1 3 336.218 4.032 20 0 EIADHM Cc1cccc(N(C)C(=O)c2cc(CCc3ccccc3)ccc2[O-])n1 ZINC000556949694 1048310469 /nfs/dbraw/zinc/31/04/69/1048310469.db2.gz DIODOSUXOWSFGX-UHFFFAOYSA-N -1 3 346.430 4.157 20 0 EIADHM C[C@@H](NCc1cccc([O-])c1Cl)[C@@H](O)c1c(F)cccc1Cl ZINC000815128263 1048341769 /nfs/dbraw/zinc/34/17/69/1048341769.db2.gz UIMTXNVCWIRFGH-JDNHERCYSA-N -1 3 344.213 4.050 20 0 EIADHM Cc1ccc(C(=O)Nc2nc(-c3cccs3)cs2)c([O-])c1C ZINC001144063336 1048391061 /nfs/dbraw/zinc/39/10/61/1048391061.db2.gz ZRRPEEYXPZLXOC-UHFFFAOYSA-N -1 3 330.434 4.446 20 0 EIADHM CC(C)(C)[C@H]1CCCC[C@@H]1CNC(=O)c1cc(=O)c2ccccc2[n-]1 ZINC000920043554 1048394479 /nfs/dbraw/zinc/39/44/79/1048394479.db2.gz RZACEXPFRIMYJZ-ZBFHGGJFSA-N -1 3 340.467 4.110 20 0 EIADHM Cc1c2cc(Cl)ccc2oc1C(=O)NCc1ccc([O-])c(F)c1 ZINC000132934341 1048539698 /nfs/dbraw/zinc/53/96/98/1048539698.db2.gz ASQZRNPCUGDIGO-UHFFFAOYSA-N -1 3 333.746 4.169 20 0 EIADHM O=C(Nc1nnc(C2CCCCC2)s1)c1cc([O-])ccc1Cl ZINC000810031127 1048614239 /nfs/dbraw/zinc/61/42/39/1048614239.db2.gz JTGJYGWLWFMUFP-UHFFFAOYSA-N -1 3 337.832 4.197 20 0 EIADHM CC[C@H]1CCCCN1Cc1nc(=O)c2c(-c3ccco3)csc2[n-]1 ZINC000195333859 1048665816 /nfs/dbraw/zinc/66/58/16/1048665816.db2.gz ZFSUMMXARJAGDL-LBPRGKRZSA-N -1 3 343.452 4.009 20 0 EIADHM CCC/C(C)=C/C(=O)O[C@@H](C)c1nc(=O)c2c(C)c(C)sc2[n-]1 ZINC000920694117 1048749149 /nfs/dbraw/zinc/74/91/49/1048749149.db2.gz UTCMBFHLMPVUCV-FBOQAHMBSA-N -1 3 334.441 4.364 20 0 EIADHM Cc1nc(-c2cccc(NC(=O)Cc3ccc([O-])c(F)c3)c2)cs1 ZINC001144617922 1048759864 /nfs/dbraw/zinc/75/98/64/1048759864.db2.gz YWAVTFJZQDLNFM-UHFFFAOYSA-N -1 3 342.395 4.144 20 0 EIADHM [O-]c1cc(F)c(CN(Cc2ccccn2)C2CCCCC2)cc1F ZINC001144657969 1048768908 /nfs/dbraw/zinc/76/89/08/1048768908.db2.gz PBBNTEXYPSMEMF-UHFFFAOYSA-N -1 3 332.394 4.400 20 0 EIADHM COc1cccc([C@H]2CCCN(Cc3cc(F)c([O-])cc3F)C2)c1 ZINC001144663556 1048782865 /nfs/dbraw/zinc/78/28/65/1048782865.db2.gz GKJBQHLXEMIVDN-AWEZNQCLSA-N -1 3 333.378 4.059 20 0 EIADHM COc1ccc(C[C@@H]2CCCN(Cc3cc(F)c([O-])cc3F)C2)cc1 ZINC001144659270 1048793243 /nfs/dbraw/zinc/79/32/43/1048793243.db2.gz BAXFVSWFCOAWBT-HNNXBMFYSA-N -1 3 347.405 4.134 20 0 EIADHM CC(C)Oc1ccccc1[N-]S(=O)(=O)/C=C\c1ccc(F)cc1 ZINC000747606000 1048797146 /nfs/dbraw/zinc/79/71/46/1048797146.db2.gz NDUXYEWNGNDGJZ-QXMHVHEDSA-N -1 3 335.400 4.026 20 0 EIADHM O=C([N-][C@H]1CCc2c1cccc2Cl)C(F)(F)c1ccc(F)cc1 ZINC000920845357 1048802973 /nfs/dbraw/zinc/80/29/73/1048802973.db2.gz RNSSWLLNSXJEOY-HNNXBMFYSA-N -1 3 339.744 4.375 20 0 EIADHM O=C(c1cc([O-])ccc1Cl)N1CCC(c2ccc(F)cc2)CC1 ZINC000810488384 1048803900 /nfs/dbraw/zinc/80/39/00/1048803900.db2.gz QMKHPQKICZAXQS-UHFFFAOYSA-N -1 3 333.790 4.205 20 0 EIADHM [O-]c1ccc(F)c(CN2CCC[C@H](c3nc4ccccc4o3)C2)c1F ZINC000816484951 1048813117 /nfs/dbraw/zinc/81/31/17/1048813117.db2.gz ULMOUWISMVCANL-LBPRGKRZSA-N -1 3 344.361 4.191 20 0 EIADHM Cc1ccc2[nH]c3c(c2c1)CN(Cc1c(F)ccc([O-])c1F)CC3 ZINC000816491656 1048813764 /nfs/dbraw/zinc/81/37/64/1048813764.db2.gz UPXYIZUVJNVJEM-UHFFFAOYSA-N -1 3 328.362 4.018 20 0 EIADHM [O-]c1cccc(CN2CCC([C@H](O)c3ccc(F)cc3)CC2)c1Cl ZINC000816507255 1048821266 /nfs/dbraw/zinc/82/12/66/1048821266.db2.gz BJECFXLNQWCDJB-LJQANCHMSA-N -1 3 349.833 4.130 20 0 EIADHM O=C([N-][C@H]1CCCc2occc21)C(F)(F)c1cccc(Cl)c1 ZINC000921025508 1048834137 /nfs/dbraw/zinc/83/41/37/1048834137.db2.gz UWAZRKHQKJAXMQ-ZDUSSCGKSA-N -1 3 325.742 4.219 20 0 EIADHM [O-]c1ccc(F)c(CNc2ccc3c(c2)OC2(CCCC2)O3)c1F ZINC000816564159 1048835580 /nfs/dbraw/zinc/83/55/80/1048835580.db2.gz WQQILABVAUQQCI-UHFFFAOYSA-N -1 3 333.334 4.324 20 0 EIADHM Cc1nc(COC(=O)c2cc3cc(Cl)sc3[n-]2)c(C)s1 ZINC000810650362 1048840368 /nfs/dbraw/zinc/84/03/68/1048840368.db2.gz RIJLDPONFZBGDW-UHFFFAOYSA-N -1 3 326.830 4.313 20 0 EIADHM COc1cccc([O-])c1C(=O)N(C)Cc1oc2c(cccc2C)c1C ZINC001144861360 1048871092 /nfs/dbraw/zinc/87/10/92/1048871092.db2.gz BXAYAEDIOIXVBV-UHFFFAOYSA-N -1 3 339.391 4.036 20 0 EIADHM CCN(c1ccc(NC(=O)c2ccc(C(C)=O)c([O-])c2)cc1)C(C)C ZINC000816845046 1048873064 /nfs/dbraw/zinc/87/30/64/1048873064.db2.gz ZIQXPXSRXVYNKN-UHFFFAOYSA-N -1 3 340.423 4.082 20 0 EIADHM C[C@@H](CC1CCOCC1)OC(=O)c1cc2cc(Cl)sc2[n-]1 ZINC000810877552 1048881740 /nfs/dbraw/zinc/88/17/40/1048881740.db2.gz ZNQZGMXECBCODH-VIFPVBQESA-N -1 3 327.833 4.245 20 0 EIADHM CCc1ccc([O-])c(C(=O)Nc2cccc(C(=O)OC(C)(C)C)c2)c1 ZINC001144887955 1048884364 /nfs/dbraw/zinc/88/43/64/1048884364.db2.gz ONJFEZXMLJWYFT-UHFFFAOYSA-N -1 3 341.407 4.162 20 0 EIADHM O=C(NCc1ccc(Oc2ccc(F)cc2)cc1)c1ccccc1[O-] ZINC001135779924 1048885318 /nfs/dbraw/zinc/88/53/18/1048885318.db2.gz KNWUIVSOTWBMKQ-UHFFFAOYSA-N -1 3 337.350 4.254 20 0 EIADHM Cc1cccc(OCCCNC(=O)c2cc3sccc3c([O-])c2)c1 ZINC001135788031 1048886147 /nfs/dbraw/zinc/88/61/47/1048886147.db2.gz STZZXCPMICJSQP-UHFFFAOYSA-N -1 3 341.432 4.114 20 0 EIADHM CC(C)(C)c1ncsc1C(=O)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000134169857 1048890820 /nfs/dbraw/zinc/89/08/20/1048890820.db2.gz YIGWGQUTNWWHIG-UHFFFAOYSA-N -1 3 344.358 4.417 20 0 EIADHM C[C@H]1CCc2nc(NC(=O)c3cc([O-])c4ccccc4c3)sc2C1 ZINC001135903328 1048953313 /nfs/dbraw/zinc/95/33/13/1048953313.db2.gz QZAUUCUWLUOXBX-NSHDSACASA-N -1 3 338.432 4.379 20 0 EIADHM O=C(c1cc2sccc2c([O-])c1)N1CCC[C@H](CC(F)(F)F)C1 ZINC000817633762 1049022906 /nfs/dbraw/zinc/02/29/06/1049022906.db2.gz SRIIGTQIERGLBB-SNVBAGLBSA-N -1 3 343.370 4.412 20 0 EIADHM Cc1ccc(C(=O)Nc2ccc3c(c2)[C@H](O)CCCC3)c([O-])c1C ZINC001146454116 1049028162 /nfs/dbraw/zinc/02/81/62/1049028162.db2.gz IBEZBNKSTFAPSP-GOSISDBHSA-N -1 3 325.408 4.021 20 0 EIADHM C[C@H](OC(=O)c1cc2cc(Cl)sc2[n-]1)C(=O)c1ccccc1 ZINC000811393784 1049050657 /nfs/dbraw/zinc/05/06/57/1049050657.db2.gz DUKCWVNTIMQXKC-VIFPVBQESA-N -1 3 333.796 4.311 20 0 EIADHM Cc1sc2[n-]c([C@@H](C)OC(=O)[C@H]3CC34CCCC4)nc(=O)c2c1C ZINC000747733905 1049204327 /nfs/dbraw/zinc/20/43/27/1049204327.db2.gz XRBJLZRIVXNFRI-ZYHUDNBSSA-N -1 3 346.452 4.198 20 0 EIADHM CCO[C@H]1C[C@@H](NC(=O)c2cc3sccc3c([O-])c2)C12CCCC2 ZINC001148552722 1049330271 /nfs/dbraw/zinc/33/02/71/1049330271.db2.gz DOMOOGDKDGSAPZ-SJORKVTESA-N -1 3 345.464 4.075 20 0 EIADHM CC(=O)c1cc(C(=O)NC2CCC(c3ccccc3)CC2)ccc1[O-] ZINC001148668347 1049356780 /nfs/dbraw/zinc/35/67/80/1049356780.db2.gz ATDFBMUGICWIPV-UHFFFAOYSA-N -1 3 337.419 4.051 20 0 EIADHM CC(=O)c1cc(C(=O)N(C(C)C)[C@@H](C)c2ccccc2)ccc1[O-] ZINC001148661960 1049357720 /nfs/dbraw/zinc/35/77/20/1049357720.db2.gz HOYGTZLTFJPNEZ-AWEZNQCLSA-N -1 3 325.408 4.207 20 0 EIADHM CC(=O)c1cc(C(=O)N[C@@H](C)c2ccc(Cl)c(C)c2)ccc1[O-] ZINC001148670938 1049359799 /nfs/dbraw/zinc/35/97/99/1049359799.db2.gz NHUVLYHWVCSXFC-NSHDSACASA-N -1 3 331.799 4.048 20 0 EIADHM O=S(=O)(/C=C/c1ccc(Cl)cc1)[N-]c1cc2c(cn1)CCCC2 ZINC000812330268 1049430749 /nfs/dbraw/zinc/43/07/49/1049430749.db2.gz BDDGTPZSECTSAN-MDZDMXLPSA-N -1 3 348.855 4.026 20 0 EIADHM CC[C@H]1CCc2nc(NC(=O)c3ccc(C)c(C)c3[O-])sc2C1 ZINC001136324089 1049476043 /nfs/dbraw/zinc/47/60/43/1049476043.db2.gz VRJKEAVDGYUZKH-LBPRGKRZSA-N -1 3 330.453 4.233 20 0 EIADHM Cc1cc2cc(C(=O)[N-]c3nnc(C(F)(F)F)s3)oc2cc1C ZINC000079692202 1049483103 /nfs/dbraw/zinc/48/31/03/1049483103.db2.gz CORUQLGVQNNBHE-UHFFFAOYSA-N -1 3 341.314 4.172 20 0 EIADHM COc1cccc(C(=O)Nc2ccccc2COc2ccccc2)c1[O-] ZINC001136342372 1049513657 /nfs/dbraw/zinc/51/36/57/1049513657.db2.gz NJXQFNMPNHAQIC-UHFFFAOYSA-N -1 3 349.386 4.232 20 0 EIADHM COCCCOc1cccc(C(=O)Nc2c([O-])cccc2Cl)c1C ZINC000820557905 1049526148 /nfs/dbraw/zinc/52/61/48/1049526148.db2.gz IXSIMNXSIXTEBG-UHFFFAOYSA-N -1 3 349.814 4.022 20 0 EIADHM CCc1cccc(C(=O)Nc2nnc(C3CCCCC3)s2)c1[O-] ZINC001136358850 1049530478 /nfs/dbraw/zinc/53/04/78/1049530478.db2.gz HOZDLASRHHACOW-UHFFFAOYSA-N -1 3 331.441 4.106 20 0 EIADHM CCCN(C(=O)c1cc([O-])ccc1Cl)[C@H]1CCc2ccccc2C1 ZINC001136388301 1049570930 /nfs/dbraw/zinc/57/09/30/1049570930.db2.gz OXIOCEPEHPXYLD-INIZCTEOSA-N -1 3 343.854 4.455 20 0 EIADHM O=C(Cc1cccc(OCc2ccc(Cl)cc2)c1)[N-]OC1CCC1 ZINC000812796719 1049595030 /nfs/dbraw/zinc/59/50/30/1049595030.db2.gz XSZSYYFTODNUJA-UHFFFAOYSA-N -1 3 345.826 4.062 20 0 EIADHM C=Cc1ccc(S(=O)(=O)[N-]c2cc(Cl)c(N)c(Cl)c2)cc1 ZINC000821134759 1049603366 /nfs/dbraw/zinc/60/33/66/1049603366.db2.gz AMVKQDWFZWQLLY-UHFFFAOYSA-N -1 3 343.235 4.019 20 0 EIADHM Cc1cc(C(=O)Nc2cc(Cl)ccc2[O-])c2ccc(F)cc2n1 ZINC000111210367 1049611082 /nfs/dbraw/zinc/61/10/82/1049611082.db2.gz NITHGTINNVVDGQ-UHFFFAOYSA-N -1 3 330.746 4.294 20 0 EIADHM [O-]c1cccc(CN2CCC3(CC2)OCCc2ccsc23)c1Cl ZINC000512239924 1049651087 /nfs/dbraw/zinc/65/10/87/1049651087.db2.gz BOAHLNPUOIUFIP-UHFFFAOYSA-N -1 3 349.883 4.171 20 0 EIADHM COc1ccc([O-])c(C(=O)Nc2ccc(Nc3ccccc3)cc2)c1 ZINC000822232369 1049744221 /nfs/dbraw/zinc/74/42/21/1049744221.db2.gz FTLJAWRDSYONET-UHFFFAOYSA-N -1 3 334.375 4.397 20 0 EIADHM CC(C)COc1ccc(NC(=O)c2cc3sccc3c([O-])c2)cn1 ZINC001136751565 1049863074 /nfs/dbraw/zinc/86/30/74/1049863074.db2.gz NBSJYHHPTJPZPY-UHFFFAOYSA-N -1 3 342.420 4.289 20 0 EIADHM COc1ccc(C(=O)N[C@@H](c2ccccc2Cl)C(C)C)c([O-])c1 ZINC001136785064 1049880225 /nfs/dbraw/zinc/88/02/25/1049880225.db2.gz NMFWEKJYUOWREO-QGZVFWFLSA-N -1 3 333.815 4.181 20 0 EIADHM CC(C)CCc1nnc([N-]C(=O)c2c(F)cccc2Cl)s1 ZINC000617097056 1049949509 /nfs/dbraw/zinc/94/95/09/1049949509.db2.gz FMBFXVQAXZKHIM-UHFFFAOYSA-N -1 3 327.812 4.172 20 0 EIADHM CSc1cc(Cl)ccc1[N-]C(=O)c1coc2c1C(=O)CCC2 ZINC000617253523 1049967851 /nfs/dbraw/zinc/96/78/51/1049967851.db2.gz SRUOPPSSTWLYHP-UHFFFAOYSA-N -1 3 335.812 4.426 20 0 EIADHM CC(C)(C)c1nnc([N-]C(=O)c2occc2-c2ccccc2)s1 ZINC000617311174 1049975920 /nfs/dbraw/zinc/97/59/20/1049975920.db2.gz KJMRTJGUNSJQIU-UHFFFAOYSA-N -1 3 327.409 4.348 20 0 EIADHM CN(CC1CCCCC1)Cn1c(Cc2cccs2)n[n-]c1=S ZINC000069373267 1050086013 /nfs/dbraw/zinc/08/60/13/1050086013.db2.gz YHSLPIYOVOORGE-UHFFFAOYSA-N -1 3 336.530 4.063 20 0 EIADHM COc1ccc(CNC(=O)c2ccc(C(C)C)cc2[O-])cc1Cl ZINC001177315622 1050190782 /nfs/dbraw/zinc/19/07/82/1050190782.db2.gz JDAFKWUYNDAAAJ-UHFFFAOYSA-N -1 3 333.815 4.108 20 0 EIADHM C[C@@H](NC(=O)Nc1cc(Br)ccc1[O-])C1CCCCC1 ZINC001186342588 1050303496 /nfs/dbraw/zinc/30/34/96/1050303496.db2.gz KLHVOVCMLRUWQQ-SNVBAGLBSA-N -1 3 341.249 4.245 20 0 EIADHM COc1ccc(-c2ccc(-c3noc(-c4cncc([O-])c4)n3)cc2)cc1 ZINC001212709995 1050334937 /nfs/dbraw/zinc/33/49/37/1050334937.db2.gz ZINFSRCZQHAVKT-UHFFFAOYSA-N -1 3 345.358 4.180 20 0 EIADHM CCC[C@H]1CCCC[C@@H]1[N-]S(=O)(=O)c1cc(C)c(Cl)s1 ZINC001186566989 1050361625 /nfs/dbraw/zinc/36/16/25/1050361625.db2.gz QNNWTVNPJKYVON-RYUDHWBXSA-N -1 3 335.922 4.347 20 0 EIADHM CCOc1cc(/C=C/C(=O)c2cc(O)ccc2OC)cc(Cl)c1[O-] ZINC000182286608 1050591650 /nfs/dbraw/zinc/59/16/50/1050591650.db2.gz TWHNEPKLEGIUPM-GQCTYLIASA-N -1 3 348.782 4.055 20 0 EIADHM CO[C@@H](CSc1nnc([N-]c2ccccc2F)s1)C1CCC1 ZINC001188114591 1050702345 /nfs/dbraw/zinc/70/23/45/1050702345.db2.gz KODZJBRVNIOARR-ZDUSSCGKSA-N -1 3 339.461 4.328 20 0 EIADHM CC(C)(C)c1cc([N-]S(=O)(=O)C2CCC2)c(O)c(C(C)(C)C)c1 ZINC001188137742 1050708390 /nfs/dbraw/zinc/70/83/90/1050708390.db2.gz HXZGOPOLGMNOND-UHFFFAOYSA-N -1 3 339.501 4.281 20 0 EIADHM O=C(Nc1ccc(Cl)c(C(F)(F)F)c1)Nc1cncc([O-])c1 ZINC001188206139 1050726125 /nfs/dbraw/zinc/72/61/25/1050726125.db2.gz GNPXFATVDOBKLU-UHFFFAOYSA-N -1 3 331.681 4.103 20 0 EIADHM O=C(NCc1ncccc1[O-])C1CCC(c2ccc(Cl)cc2)CC1 ZINC001179657145 1050739720 /nfs/dbraw/zinc/73/97/20/1050739720.db2.gz ZLUGOKZVVLPMJL-UHFFFAOYSA-N -1 3 344.842 4.031 20 0 EIADHM O=C(c1cc(Nc2cccc(Cl)c2[O-])ccc1F)N1CCCC1 ZINC001188437397 1050768366 /nfs/dbraw/zinc/76/83/66/1050768366.db2.gz WOKUBNBGWLVIIR-UHFFFAOYSA-N -1 3 334.778 4.164 20 0 EIADHM Cc1cccc([O-])c1C(=O)N[C@@H]1CCc2ccc(C(F)(F)F)cc21 ZINC001188659172 1050813918 /nfs/dbraw/zinc/81/39/18/1050813918.db2.gz OFAZKLXBONVBDO-CQSZACIVSA-N -1 3 335.325 4.137 20 0 EIADHM CC(=O)c1cccc([O-])c1NC(=O)c1ccc(Oc2cccnc2)cc1 ZINC001188619764 1050815946 /nfs/dbraw/zinc/81/59/46/1050815946.db2.gz IAAOBXVTBYOSDC-UHFFFAOYSA-N -1 3 348.358 4.034 20 0 EIADHM O=C(Cc1cc2ccccc2o1)Nc1ccc(Br)cc1[O-] ZINC000619557136 1050819046 /nfs/dbraw/zinc/81/90/46/1050819046.db2.gz LKFNNUOKMPVZSC-UHFFFAOYSA-N -1 3 346.180 4.082 20 0 EIADHM Cn1c2ccccc2nc1[C@H]1CCCCN1Cc1ccc([O-])c(F)c1 ZINC001179970257 1050836328 /nfs/dbraw/zinc/83/63/28/1050836328.db2.gz VCPRZOVXKHXPNF-GOSISDBHSA-N -1 3 339.414 4.145 20 0 EIADHM O=C(Nc1ccccc1)c1cccc(Nc2cc(=O)[n-]c(C3CC3)n2)c1 ZINC001174206400 1050842094 /nfs/dbraw/zinc/84/20/94/1050842094.db2.gz QSORPRSQWXOMKQ-UHFFFAOYSA-N -1 3 346.390 4.056 20 0 EIADHM COc1cccc([C@@H](C)SCc2noc(-c3ccccc3[O-])n2)c1 ZINC001188952305 1050870783 /nfs/dbraw/zinc/87/07/83/1050870783.db2.gz JOKLDXODTBYAIF-GFCCVEGCSA-N -1 3 342.420 4.445 20 0 EIADHM O=c1ccn(-c2ccc(Nc3cccc(N4CCCCC4)c3)cc2)[n-]1 ZINC001174305517 1050878970 /nfs/dbraw/zinc/87/89/70/1050878970.db2.gz NNFPXEPUQUUNBW-UHFFFAOYSA-N -1 3 334.423 4.312 20 0 EIADHM [O-]c1cccc(Nc2ccc(C(F)(F)F)nc2)c1Br ZINC001174313026 1050885725 /nfs/dbraw/zinc/88/57/25/1050885725.db2.gz XVNAGDABRHGKIW-UHFFFAOYSA-N -1 3 333.107 4.312 20 0 EIADHM COc1cccc(CN(Cc2ccc([O-])c(F)c2F)CC(C)C)c1 ZINC001180153171 1050902580 /nfs/dbraw/zinc/90/25/80/1050902580.db2.gz HKGIKHRZUPBWDW-UHFFFAOYSA-N -1 3 335.394 4.337 20 0 EIADHM O=S(=O)(CCc1ccc(Cl)cc1)[N-]c1cc(Cl)ccc1F ZINC001189100381 1050910129 /nfs/dbraw/zinc/91/01/29/1050910129.db2.gz AVWYQGPSLUDAEC-UHFFFAOYSA-N -1 3 348.226 4.117 20 0 EIADHM Cc1cccc([N-]S(=O)(=O)Cc2ccccc2C(F)(F)F)c1F ZINC001189529369 1051013080 /nfs/dbraw/zinc/01/30/80/1051013080.db2.gz DSCPKQKOWVIJKJ-UHFFFAOYSA-N -1 3 347.333 4.095 20 0 EIADHM Cc1nc(-c2cccnc2)sc1C(=O)Nc1cc([O-])cc(Cl)c1 ZINC001190183263 1051131312 /nfs/dbraw/zinc/13/13/12/1051131312.db2.gz HTSXRMWIBBEVTL-UHFFFAOYSA-N -1 3 345.811 4.125 20 0 EIADHM Cc1nn(CC(C)C)c(C)c1CCC(=O)Nc1ccc(Cl)cc1[O-] ZINC000153684519 1051214720 /nfs/dbraw/zinc/21/47/20/1051214720.db2.gz BQLORSFXYYYWFS-UHFFFAOYSA-N -1 3 349.862 4.086 20 0 EIADHM O=S(=O)([N-]Cc1cc2ccccc2s1)c1ccc(Cl)s1 ZINC001190665103 1051235272 /nfs/dbraw/zinc/23/52/72/1051235272.db2.gz VZIDMLRXFQSGCL-UHFFFAOYSA-N -1 3 343.882 4.095 20 0 EIADHM Cc1cccc(C(=O)Nc2cc(F)c(Br)cc2C)c1[O-] ZINC000157505837 1051258426 /nfs/dbraw/zinc/25/84/26/1051258426.db2.gz PXZYWRMKSCDGDL-UHFFFAOYSA-N -1 3 338.176 4.163 20 0 EIADHM Cc1cc(C)c(C(=O)NCc2ccc([O-])c(Br)c2)c(C)c1 ZINC000154402443 1051295737 /nfs/dbraw/zinc/29/57/37/1051295737.db2.gz RZXNPYHEPAUVCO-UHFFFAOYSA-N -1 3 348.240 4.010 20 0 EIADHM [O-]c1cc(F)c(Nc2ccc(N3CCSCC3)c(F)c2)c(F)c1 ZINC001175099567 1051345747 /nfs/dbraw/zinc/34/57/47/1051345747.db2.gz NBJZATHMDCIKQL-UHFFFAOYSA-N -1 3 340.370 4.106 20 0 EIADHM O=C(NC1CCCCC1)c1cccc(Nc2c(F)cc([O-])cc2F)c1 ZINC001175100000 1051348159 /nfs/dbraw/zinc/34/81/59/1051348159.db2.gz MAISBTDOJRMJKO-UHFFFAOYSA-N -1 3 346.377 4.477 20 0 EIADHM [O-]c1cc(F)c(Nc2c(Br)ccc(F)c2F)c(F)c1 ZINC001175102031 1051349357 /nfs/dbraw/zinc/34/93/57/1051349357.db2.gz CMGBFGZJAZWPLS-UHFFFAOYSA-N -1 3 336.082 4.455 20 0 EIADHM COC(=O)c1cccc2c(Nc3c(F)cc([O-])cc3F)cccc12 ZINC001175103076 1051352089 /nfs/dbraw/zinc/35/20/89/1051352089.db2.gz SVKKHPDRUNBHMU-UHFFFAOYSA-N -1 3 329.302 4.354 20 0 EIADHM [O-]c1cc(F)c(Nc2c(F)cccc2OC2CCOCC2)c(F)c1 ZINC001175103813 1051352316 /nfs/dbraw/zinc/35/23/16/1051352316.db2.gz ZHXYPHXIODETJJ-UHFFFAOYSA-N -1 3 339.313 4.111 20 0 EIADHM COc1ccc(-c2cc([N-]c3c(F)ccc(OC)c3F)on2)cc1 ZINC001175116506 1051357649 /nfs/dbraw/zinc/35/76/49/1051357649.db2.gz UPGIJSQDHZAAFP-UHFFFAOYSA-N -1 3 332.306 4.381 20 0 EIADHM CCOc1ccc(Nc2cccc([O-])c2Br)cc1F ZINC001175069924 1051359653 /nfs/dbraw/zinc/35/96/53/1051359653.db2.gz QSNFMCXFSCFVSX-UHFFFAOYSA-N -1 3 326.165 4.436 20 0 EIADHM CCCCc1ccc(S(=O)(=O)[N-]c2ccc(C(C)=O)cc2F)cc1 ZINC001191249596 1051393846 /nfs/dbraw/zinc/39/38/46/1051393846.db2.gz WQFQNTXMCRLXGE-UHFFFAOYSA-N -1 3 349.427 4.172 20 0 EIADHM [O-]c1ccc(F)c(Nc2cccc(I)c2)c1F ZINC001175268112 1051504412 /nfs/dbraw/zinc/50/44/12/1051504412.db2.gz HVBMAWUJRVKAID-UHFFFAOYSA-N -1 3 347.102 4.019 20 0 EIADHM CCOc1cc(F)ccc1Nc1cccc([O-])c1Br ZINC001175290816 1051488428 /nfs/dbraw/zinc/48/84/28/1051488428.db2.gz QATGLKBZZFFHSV-UHFFFAOYSA-N -1 3 326.165 4.436 20 0 EIADHM Cc1cc(Nc2c(F)ccc([O-])c2F)n(Cc2cccc(F)c2)n1 ZINC001175266202 1051502543 /nfs/dbraw/zinc/50/25/43/1051502543.db2.gz RGHFVCXRMQRVRV-UHFFFAOYSA-N -1 3 333.313 4.106 20 0 EIADHM COc1ccc(OC(F)(F)F)cc1Nc1c(F)ccc([O-])c1F ZINC001175267635 1051503111 /nfs/dbraw/zinc/50/31/11/1051503111.db2.gz DIDIUSIQBWKQPA-UHFFFAOYSA-N -1 3 335.228 4.321 20 0 EIADHM Cc1c(Br)ccc(N)c1Nc1c(F)ccc([O-])c1F ZINC001175267934 1051503514 /nfs/dbraw/zinc/50/35/14/1051503514.db2.gz DQRJWVZOKJYVHQ-UHFFFAOYSA-N -1 3 329.144 4.067 20 0 EIADHM O=c1cc(Oc2ccc(Nc3c(F)ccc([O-])c3F)cc2)cc[nH]1 ZINC001175268790 1051504684 /nfs/dbraw/zinc/50/46/84/1051504684.db2.gz WABMIRFEPZYVER-UHFFFAOYSA-N -1 3 330.290 4.307 20 0 EIADHM [O-]c1ccc(F)c(Nc2cccc([C@@H]3CN4C=CSC4=N3)c2)c1F ZINC001175270193 1051508017 /nfs/dbraw/zinc/50/80/17/1051508017.db2.gz WBNPPPPXSJWQPK-ZDUSSCGKSA-N -1 3 345.374 4.345 20 0 EIADHM COc1cc(Nc2c(F)ccc([O-])c2F)c(C)cc1Br ZINC001175269770 1051508174 /nfs/dbraw/zinc/50/81/74/1051508174.db2.gz KVVFLLHMQANOGC-UHFFFAOYSA-N -1 3 344.155 4.494 20 0 EIADHM COC(=O)c1ccc(Nc2c(F)ccc([O-])c2F)cc1C(F)(F)F ZINC001175271628 1051509832 /nfs/dbraw/zinc/50/98/32/1051509832.db2.gz YNCNDBGFCJGOKA-UHFFFAOYSA-N -1 3 347.239 4.219 20 0 EIADHM C[C@H]1CC[C@H](NC(=O)Nc2ccc(C(=O)OC(C)(C)C)cc2[O-])CC1 ZINC001191826248 1051565203 /nfs/dbraw/zinc/56/52/03/1051565203.db2.gz YZPZYGXVKAOJEZ-MQMHXKEQSA-N -1 3 348.443 4.048 20 0 EIADHM CCOc1ccc(C)cc1S(=O)(=O)[N-]c1cccc(C)c1Cl ZINC001191829006 1051565451 /nfs/dbraw/zinc/56/54/51/1051565451.db2.gz OMJBAXBBSPFOJX-UHFFFAOYSA-N -1 3 339.844 4.156 20 0 EIADHM CCCC[C@H](CC)CCCN(C)C(=O)c1cc(=O)[n-]c(C2CC2)n1 ZINC000621111516 1051664150 /nfs/dbraw/zinc/66/41/50/1051664150.db2.gz LNVDOKISVSSOCR-AWEZNQCLSA-N -1 3 333.476 4.128 20 0 EIADHM C[C@@H]1CCN(C(=O)c2ccc(C(C)(C)C)cc2[O-])CCC1(F)F ZINC001192314800 1051688648 /nfs/dbraw/zinc/68/86/48/1051688648.db2.gz TZPANMQJXGTTQM-GFCCVEGCSA-N -1 3 325.399 4.197 20 0 EIADHM O=C([N-]c1cc(F)cc2cccnc21)c1nc(C(F)(F)F)cs1 ZINC001192457863 1051740716 /nfs/dbraw/zinc/74/07/16/1051740716.db2.gz LZPIUAXIDIBPOD-UHFFFAOYSA-N -1 3 341.289 4.102 20 0 EIADHM Cc1ccc(Nc2ccc(OC3CCOCC3)nc2)c(Cl)c1[O-] ZINC001175729087 1051745519 /nfs/dbraw/zinc/74/55/19/1051745519.db2.gz IXSPOYGQPLXDBK-UHFFFAOYSA-N -1 3 334.803 4.050 20 0 EIADHM CCCCOC(=O)c1ccccc1C(=O)Nc1cc([O-])cc(Cl)c1 ZINC001192619830 1051783788 /nfs/dbraw/zinc/78/37/88/1051783788.db2.gz ZUJZIJCXMYQOLA-UHFFFAOYSA-N -1 3 347.798 4.255 20 0 EIADHM [O-]c1c(F)cc(Br)cc1Nc1cnn(-c2ccccc2)c1 ZINC001175795576 1051790533 /nfs/dbraw/zinc/79/05/33/1051790533.db2.gz KWOXPYMDVIRXOJ-UHFFFAOYSA-N -1 3 348.175 4.223 20 0 EIADHM Cc1cc(S(=O)(=O)[N-]c2c(F)cccc2NC(C)C)c(C)s1 ZINC000158875324 1051797386 /nfs/dbraw/zinc/79/73/86/1051797386.db2.gz KZHYOAUNPRSWCQ-UHFFFAOYSA-N -1 3 342.461 4.125 20 0 EIADHM CC(C)(Cc1ccccc1C(F)(F)F)C(=O)Nc1cncc([O-])c1 ZINC001183947191 1051930509 /nfs/dbraw/zinc/93/05/09/1051930509.db2.gz YQIGEYHNTYCTAM-UHFFFAOYSA-N -1 3 338.329 4.013 20 0 EIADHM O=C(c1cc([O-])cc(C(F)(F)F)c1)N1CC2C[C@@H]3CC1C[C@H](C2)C3 ZINC000621759488 1051935130 /nfs/dbraw/zinc/93/51/30/1051935130.db2.gz YHOPZSJPXROCMF-QOARYFPJSA-N -1 3 339.357 4.062 20 0 EIADHM Cc1ccc(Nc2cc(C(=O)N3CCCC3)ccc2F)c(Cl)c1[O-] ZINC001176212842 1051958626 /nfs/dbraw/zinc/95/86/26/1051958626.db2.gz BTQPYSRKOBTBFD-UHFFFAOYSA-N -1 3 348.805 4.473 20 0 EIADHM C[C@H]1C[C@H](NC(=O)c2ccc([O-])cc2C(F)(F)F)CC(C)(C)C1 ZINC001193758021 1051990744 /nfs/dbraw/zinc/99/07/44/1051990744.db2.gz IXOYMCTULRMJMU-QWRGUYRKSA-N -1 3 329.362 4.356 20 0 EIADHM C[C@@H]1C[C@H](NC(=O)c2ccc([O-])cc2C(F)(F)F)c2ccccc21 ZINC001193758052 1051991641 /nfs/dbraw/zinc/99/16/41/1051991641.db2.gz JXJUQPGZJMOBFX-HWPZZCPQSA-N -1 3 335.325 4.389 20 0 EIADHM CC(C)c1ccc(Cl)c(C(=O)Nc2ccc3[nH][n-]c(=O)c3c2)c1 ZINC001193859713 1052017408 /nfs/dbraw/zinc/01/74/08/1052017408.db2.gz IBHYATFDCVPOOE-UHFFFAOYSA-N -1 3 329.787 4.298 20 0 EIADHM [O-]c1cc(Cl)cnc1Nc1cccc2c1cnn2[C@H]1CCCCO1 ZINC001176319476 1052024659 /nfs/dbraw/zinc/02/46/59/1052024659.db2.gz QYXJXQSZZZBVGY-MRXNPFEDSA-N -1 3 344.802 4.233 20 0 EIADHM [O-]c1cc(Br)cnc1Nc1ccc2cc(O)ccc2c1 ZINC001176384290 1052027458 /nfs/dbraw/zinc/02/74/58/1052027458.db2.gz MGNBZVDYTSBATN-UHFFFAOYSA-N -1 3 331.169 4.152 20 0 EIADHM O=S(=O)([N-]c1cc(O)ccc1F)c1ccc(-c2cccs2)cc1 ZINC001194163337 1052091810 /nfs/dbraw/zinc/09/18/10/1052091810.db2.gz QLTVQITXMNSRRC-UHFFFAOYSA-N -1 3 349.408 4.061 20 0 EIADHM Cc1ccc([N-]S(=O)(=O)c2ccc(-c3cccs3)cc2)c(F)n1 ZINC001194142661 1052099309 /nfs/dbraw/zinc/09/93/09/1052099309.db2.gz VOYNOUCIZNMLBX-UHFFFAOYSA-N -1 3 348.424 4.058 20 0 EIADHM CCN(CC)C(=O)c1cc(Nc2cccc(Cl)c2[O-])ccc1F ZINC001176518898 1052107370 /nfs/dbraw/zinc/10/73/70/1052107370.db2.gz WQLUFWVYPHKKEE-UHFFFAOYSA-N -1 3 336.794 4.410 20 0 EIADHM Cc1cc(S(=O)(=O)[N-][C@@H]2CC[C@@H]3CCCC[C@H]3C2)sc1Cl ZINC001184928600 1052131766 /nfs/dbraw/zinc/13/17/66/1052131766.db2.gz RLANXSVPPLSSQQ-RWMBFGLXSA-N -1 3 347.933 4.347 20 0 EIADHM C[C@H](N(C)C(=O)c1cc(Cc2ccccc2)ccc1[O-])C(C)(C)C ZINC000622296977 1052190763 /nfs/dbraw/zinc/19/07/63/1052190763.db2.gz KWZBZCMJASNYPW-HNNXBMFYSA-N -1 3 325.452 4.490 20 0 EIADHM CCc1cccc(C(=O)Nc2ccccc2NCC(F)(F)F)c1[O-] ZINC000622333271 1052211220 /nfs/dbraw/zinc/21/12/20/1052211220.db2.gz QWESUMUFFREDPX-UHFFFAOYSA-N -1 3 338.329 4.181 20 0 EIADHM CC(C)c1ccc(C(=O)NC2(c3nccs3)CCCC2)c([O-])c1 ZINC000622376272 1052228594 /nfs/dbraw/zinc/22/85/94/1052228594.db2.gz FFQQSKIMCSKSLC-UHFFFAOYSA-N -1 3 330.453 4.171 20 0 EIADHM Cc1nc(C(C)(C)NC(=O)c2ccc(C(C)C)cc2[O-])sc1C ZINC000622382156 1052237634 /nfs/dbraw/zinc/23/76/34/1052237634.db2.gz MGLIMYDHFCGUHX-UHFFFAOYSA-N -1 3 332.469 4.254 20 0 EIADHM CCc1cccc(C(=O)N(C)[C@@H](C)Cc2ccc(Cl)cc2)c1[O-] ZINC000622381896 1052238287 /nfs/dbraw/zinc/23/82/87/1052238287.db2.gz DXYRNPQVCYTEKO-ZDUSSCGKSA-N -1 3 331.843 4.311 20 0 EIADHM CCc1ccc([O-])c(C(=O)N(C)[C@@H](Cc2ccc(F)cc2)C(C)C)c1 ZINC000622401572 1052246572 /nfs/dbraw/zinc/24/65/72/1052246572.db2.gz XIULMPBAKHWJJS-IBGZPJMESA-N -1 3 343.442 4.433 20 0 EIADHM C[C@@H]1c2cc(Cl)cc(Cl)c2CCN1C(=O)c1ccccc1[O-] ZINC000622425559 1052260980 /nfs/dbraw/zinc/26/09/80/1052260980.db2.gz HAFBKNIJLWXNMD-SNVBAGLBSA-N -1 3 336.218 4.459 20 0 EIADHM CCCOc1ccc2c(c1)CCN(C(=O)c1cc([O-])ccc1Cl)C2 ZINC000622454253 1052272987 /nfs/dbraw/zinc/27/29/87/1052272987.db2.gz FWMUONJRUCLBBM-UHFFFAOYSA-N -1 3 345.826 4.033 20 0 EIADHM C[C@@H](CC(F)(F)F)NC(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000622514962 1052310774 /nfs/dbraw/zinc/31/07/74/1052310774.db2.gz GSXYXEIZFGJBCZ-LBPRGKRZSA-N -1 3 337.341 4.054 20 0 EIADHM COc1cc(C)c(NC(=O)c2cc([O-])cc(C(F)(F)F)c2)cc1F ZINC000622520385 1052312835 /nfs/dbraw/zinc/31/28/35/1052312835.db2.gz QWCFZCGZZLPDLV-UHFFFAOYSA-N -1 3 343.276 4.119 20 0 EIADHM COc1cc(C(=O)Nc2cc(F)ccc2[O-])ccc1OC1CCCC1 ZINC000174894724 1052576510 /nfs/dbraw/zinc/57/65/10/1052576510.db2.gz AQDCLEPUVXQKPA-UHFFFAOYSA-N -1 3 345.370 4.114 20 0 EIADHM Cc1nc(-c2cccc(C(=O)Nc3cc(F)ccc3[O-])c2)cs1 ZINC000174906304 1052576538 /nfs/dbraw/zinc/57/65/38/1052576538.db2.gz USJBLNPNNIQHPZ-UHFFFAOYSA-N -1 3 328.368 4.216 20 0 EIADHM Cc1onc(-c2ccccc2Cl)c1C(=O)Nc1cc(F)ccc1[O-] ZINC000174878923 1052576828 /nfs/dbraw/zinc/57/68/28/1052576828.db2.gz FMJRRCAJLRLMAU-UHFFFAOYSA-N -1 3 346.745 4.400 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)N[C@@H](C(F)F)C1CCCCC1 ZINC000623046515 1052578850 /nfs/dbraw/zinc/57/88/50/1052578850.db2.gz UJRFDWFWGAOPSO-QGZVFWFLSA-N -1 3 343.389 4.184 20 0 EIADHM Cc1cc(=O)[n-]c([C@H](C)N[C@H](C)c2ccc(SC(C)C)cc2)n1 ZINC000192731860 1052634494 /nfs/dbraw/zinc/63/44/94/1052634494.db2.gz ZTABGHVUWSJXPO-KGLIPLIRSA-N -1 3 331.485 4.403 20 0 EIADHM Cc1cc(=O)[n-]c([C@H](C)N[C@H](Cc2ccccc2)c2cccs2)n1 ZINC000192777968 1052638261 /nfs/dbraw/zinc/63/82/61/1052638261.db2.gz XMZHGPWPKWZASD-GOEBONIOSA-N -1 3 339.464 4.187 20 0 EIADHM CC(C)[C@H](Oc1cccc(Cl)c1)C(=O)Nc1cccc([O-])c1F ZINC000180019181 1052773883 /nfs/dbraw/zinc/77/38/83/1052773883.db2.gz SMAPPCSDFRSPMX-INIZCTEOSA-N -1 3 337.778 4.227 20 0 EIADHM O=C([N-]c1c(F)cc(Cl)cc1F)c1ncccc1C(F)(F)F ZINC000180341514 1052795465 /nfs/dbraw/zinc/79/54/65/1052795465.db2.gz TWYURCDVYKOEBK-UHFFFAOYSA-N -1 3 336.647 4.284 20 0 EIADHM CO[C@H](C)c1nc(C)c(C(=O)[N-]c2c(F)cc(Cl)cc2F)s1 ZINC000180363387 1052796857 /nfs/dbraw/zinc/79/68/57/1052796857.db2.gz SXZCKZIUNARBAG-SSDOTTSWSA-N -1 3 346.786 4.343 20 0 EIADHM O=C([N-]c1cnoc1)c1ccc(-c2nc3ccccc3s2)s1 ZINC000623943504 1052840516 /nfs/dbraw/zinc/84/05/16/1052840516.db2.gz YAYLJFKADSINFG-UHFFFAOYSA-N -1 3 327.390 4.265 20 0 EIADHM CN(C(=O)c1cccc2n[n-]nc21)c1ccc(Oc2ccccc2)cc1 ZINC000183509341 1052976824 /nfs/dbraw/zinc/97/68/24/1052976824.db2.gz FRMGMKUGSGGLHW-UHFFFAOYSA-N -1 3 344.374 4.027 20 0 EIADHM [O-]c1cccc(CNCc2cc(Br)cs2)c1Cl ZINC000383313194 1053319054 /nfs/dbraw/zinc/31/90/54/1053319054.db2.gz NVBIULGIIDQZCD-UHFFFAOYSA-N -1 3 332.650 4.159 20 0 EIADHM CC(C)(C(=O)[O-])[C@H]1CCCN(Cc2cc(F)cc(C(F)(F)F)c2)C1 ZINC000325412931 1053436025 /nfs/dbraw/zinc/43/60/25/1053436025.db2.gz FGPXYJYVWGCKIY-LBPRGKRZSA-N -1 3 347.352 4.167 20 0 EIADHM O=S(=O)([N-]c1ccc2oc3ccccc3c2c1)c1ccc(O)cc1 ZINC001195793636 1053488731 /nfs/dbraw/zinc/48/87/31/1053488731.db2.gz IKONZFLNIYYKRU-UHFFFAOYSA-N -1 3 339.372 4.092 20 0 EIADHM Cc1c([O-])ccc2c(CN[C@@H](C)c3ccccc3Cl)cc(=O)oc12 ZINC000008173036 1053543107 /nfs/dbraw/zinc/54/31/07/1053543107.db2.gz BFXIOLMCUSCHRS-LBPRGKRZSA-N -1 3 343.810 4.311 20 0 EIADHM COc1cccc(NC(=S)Nc2c([O-])cccc2C(F)(F)F)c1 ZINC001196056078 1053564810 /nfs/dbraw/zinc/56/48/10/1053564810.db2.gz DRFWBRQUTXSECF-UHFFFAOYSA-N -1 3 342.342 4.229 20 0 EIADHM CC(C)[C@H](NCc1cc(=O)oc2cc([O-])ccc12)c1ccccc1F ZINC000852447014 1053580993 /nfs/dbraw/zinc/58/09/93/1053580993.db2.gz PUAAGXSVMOBMAI-FQEVSTJZSA-N -1 3 341.382 4.125 20 0 EIADHM CC[C@H](NCc1cccc([O-])c1Cl)c1cccc(OC)c1OC ZINC000865758122 1053585415 /nfs/dbraw/zinc/58/54/15/1053585415.db2.gz XSPRDJUMNLVFDI-AWEZNQCLSA-N -1 3 335.831 4.304 20 0 EIADHM CC[C@@H](NCc1cccc([O-])c1Cl)c1cccc(OC)c1OC ZINC000865758123 1053586245 /nfs/dbraw/zinc/58/62/45/1053586245.db2.gz XSPRDJUMNLVFDI-CQSZACIVSA-N -1 3 335.831 4.304 20 0 EIADHM Cc1sc2[n-]c([C@H](C)OC(=O)[C@H](C)CC(C)C)nc(=O)c2c1C ZINC000765527005 1053621118 /nfs/dbraw/zinc/62/11/18/1053621118.db2.gz IJZWDHPWWHWSLC-KOLCDFICSA-N -1 3 336.457 4.300 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2ccc(F)c(C)c2Cl)c(F)c1 ZINC001196385045 1053653024 /nfs/dbraw/zinc/65/30/24/1053653024.db2.gz WGAUWOPYCGKVLJ-UHFFFAOYSA-N -1 3 331.771 4.036 20 0 EIADHM Cc1cc(F)cc(C)c1S(=O)(=O)[N-]c1cccc(C(F)F)c1 ZINC000386281796 1053664496 /nfs/dbraw/zinc/66/44/96/1053664496.db2.gz FRBLAKCORMYPCG-UHFFFAOYSA-N -1 3 329.343 4.181 20 0 EIADHM CCn1c2ccccc2nc1NC(=O)c1cc([O-])c2ccccc2c1 ZINC000471623566 1053670713 /nfs/dbraw/zinc/67/07/13/1053670713.db2.gz CBTKQQWTTWQGJA-UHFFFAOYSA-N -1 3 331.375 4.167 20 0 EIADHM O=C(Nc1ccc(NC(=O)C2CC2)cc1)c1cc([O-])c2ccccc2c1 ZINC000471637433 1053676992 /nfs/dbraw/zinc/67/69/92/1053676992.db2.gz ZVNSONHXFUKENS-UHFFFAOYSA-N -1 3 346.386 4.146 20 0 EIADHM O=C(NCc1nc2ccccc2s1)c1cc([O-])c2ccccc2c1 ZINC000471649650 1053684170 /nfs/dbraw/zinc/68/41/70/1053684170.db2.gz ZQZLNASRDUEQJD-UHFFFAOYSA-N -1 3 334.400 4.085 20 0 EIADHM CN(Cc1ccc(F)c(F)c1)C(=O)c1cc([O-])c2ccccc2c1 ZINC000471691026 1053690565 /nfs/dbraw/zinc/69/05/65/1053690565.db2.gz BWJVIVDWUDEYKE-UHFFFAOYSA-N -1 3 327.330 4.096 20 0 EIADHM COc1ccccc1-c1cc(C(=O)[N-]c2c(F)cccc2Cl)no1 ZINC001127904494 1053729442 /nfs/dbraw/zinc/72/94/42/1053729442.db2.gz SOQBBSOZSPBDII-UHFFFAOYSA-N -1 3 346.745 4.395 20 0 EIADHM COc1ccc(-c2cc(C(=O)[N-]c3c(F)cccc3Cl)no2)cc1 ZINC001127904730 1053730802 /nfs/dbraw/zinc/73/08/02/1053730802.db2.gz ZBRAUBMNAYJUTG-UHFFFAOYSA-N -1 3 346.745 4.395 20 0 EIADHM [O-]c1cccc(C(F)(F)F)c1NC(=S)Nc1ccc(F)cc1 ZINC001196948651 1053812205 /nfs/dbraw/zinc/81/22/05/1053812205.db2.gz XBBOGZJRYYBJML-UHFFFAOYSA-N -1 3 330.306 4.359 20 0 EIADHM C[C@@H](c1cccc(F)c1)N1CCN(Cc2ccc([O-])c(Cl)c2)CC1 ZINC001197069511 1053833244 /nfs/dbraw/zinc/83/32/44/1053833244.db2.gz JGDFGOITSVDSPL-AWEZNQCLSA-N -1 3 348.849 4.064 20 0 EIADHM COc1ccnc(F)c1C(=O)[N-]c1ccccc1SC(C)(C)C ZINC001197146220 1053845233 /nfs/dbraw/zinc/84/52/33/1053845233.db2.gz GSIQTGCGWLKUAV-UHFFFAOYSA-N -1 3 334.416 4.372 20 0 EIADHM CC(C)Oc1ncc(Cl)cc1[N-]c1nnc(C(C)(C)C)s1 ZINC001203309897 1053857288 /nfs/dbraw/zinc/85/72/88/1053857288.db2.gz HSBLLMKYFNMXIW-UHFFFAOYSA-N -1 3 326.853 4.415 20 0 EIADHM Cc1cccc([N-]S(=O)(=O)Cc2cc(Cl)ccc2Cl)c1F ZINC001197526786 1053924711 /nfs/dbraw/zinc/92/47/11/1053924711.db2.gz HGUUWIDPGWKJFT-UHFFFAOYSA-N -1 3 348.226 4.383 20 0 EIADHM [O-]c1cc(C(F)(F)F)ccc1NC(=S)Nc1cccc(F)c1 ZINC001197643765 1053956413 /nfs/dbraw/zinc/95/64/13/1053956413.db2.gz DUOPXLIMOIQYPB-UHFFFAOYSA-N -1 3 330.306 4.359 20 0 EIADHM CCCCc1nnc([N-]C(=O)c2ccc(C(F)(F)F)s2)s1 ZINC000671664966 1053963078 /nfs/dbraw/zinc/96/30/78/1053963078.db2.gz QQTNXGZFJJBCGT-UHFFFAOYSA-N -1 3 335.376 4.213 20 0 EIADHM O=C(c1cc2sccc2c([O-])c1)N1CCC([C@H]2CCCCO2)CC1 ZINC000855948542 1053999658 /nfs/dbraw/zinc/99/96/58/1053999658.db2.gz PRPTWOVNPNHIHB-QGZVFWFLSA-N -1 3 345.464 4.028 20 0 EIADHM [O-]c1cc(NC(=S)Nc2cccc(C(F)(F)F)c2)ccc1F ZINC001198059121 1054055099 /nfs/dbraw/zinc/05/50/99/1054055099.db2.gz IKSVKSQQJWQQBT-UHFFFAOYSA-N -1 3 330.306 4.359 20 0 EIADHM Cc1cccc(C)c1NC(=S)Nc1cc(=O)n(-c2ccccc2)[n-]1 ZINC001198332047 1054124250 /nfs/dbraw/zinc/12/42/50/1054124250.db2.gz DSVUTYLYFQCNGH-UHFFFAOYSA-N -1 3 338.436 4.004 20 0 EIADHM CC(C)(CC(=O)[N-]OCCCC(F)(F)F)CC(=O)c1ccccc1 ZINC000871216166 1054169996 /nfs/dbraw/zinc/16/99/96/1054169996.db2.gz SEELCXQRAAYVJK-UHFFFAOYSA-N -1 3 345.361 4.066 20 0 EIADHM O=C(CCc1ccc(-c2ccccc2)[nH]1)[N-]OCCCC(F)(F)F ZINC000871211677 1054170065 /nfs/dbraw/zinc/17/00/65/1054170065.db2.gz OYTQRQRPRLGUQI-UHFFFAOYSA-N -1 3 340.345 4.005 20 0 EIADHM CC(C)(C)c1ncsc1C(=O)[N-]c1cc(F)c(F)c(F)c1F ZINC000871268108 1054179455 /nfs/dbraw/zinc/17/94/55/1054179455.db2.gz HIOGGYYGMFRYET-UHFFFAOYSA-N -1 3 332.322 4.249 20 0 EIADHM C[C@@H]1CN(C(=O)c2cc([O-])c3ccccc3c2)C[C@H](c2ccccc2)O1 ZINC000471878099 1054192717 /nfs/dbraw/zinc/19/27/17/1054192717.db2.gz WMPDCRGIXVGIDI-QVKFZJNVSA-N -1 3 347.414 4.148 20 0 EIADHM O=C(Nc1cnn(-c2ccccc2F)c1)c1cc([O-])c2ccccc2c1 ZINC000472257136 1054252639 /nfs/dbraw/zinc/25/26/39/1054252639.db2.gz LZZIVXAPSQRCSK-UHFFFAOYSA-N -1 3 347.349 4.123 20 0 EIADHM COc1cccc(F)c1[C@H](C)NC(=O)c1cc([O-])c2ccccc2c1 ZINC000472212914 1054255702 /nfs/dbraw/zinc/25/57/02/1054255702.db2.gz NKBDDPAWRPDVNW-LBPRGKRZSA-N -1 3 339.366 4.184 20 0 EIADHM O=C(Nc1ccc(O)cc1F)c1cc(Cc2ccccc2)ccc1[O-] ZINC000857481610 1054271442 /nfs/dbraw/zinc/27/14/42/1054271442.db2.gz CIGMDMPOFYBHOM-UHFFFAOYSA-N -1 3 337.350 4.080 20 0 EIADHM CCc1cc(C)cc(CC)c1[N-]S(=O)(=O)c1ccc(OC)cc1C ZINC001198943949 1054317991 /nfs/dbraw/zinc/31/79/91/1054317991.db2.gz USLHUWIIZMTPBH-UHFFFAOYSA-N -1 3 347.480 4.238 20 0 EIADHM O=C([N-]c1ncc(-c2ccccc2)s1)c1cnoc1C(F)(F)F ZINC001199046557 1054332610 /nfs/dbraw/zinc/33/26/10/1054332610.db2.gz JGXXJSIHRLZJJN-UHFFFAOYSA-N -1 3 339.298 4.069 20 0 EIADHM CC(C)C[C@H](NC(=O)c1c[n-]c2ccccc2c1=O)c1ccccc1 ZINC000046017244 1054359164 /nfs/dbraw/zinc/35/91/64/1054359164.db2.gz MBPAEEWKZMPVEN-IBGZPJMESA-N -1 3 334.419 4.045 20 0 EIADHM CCOc1ccc2c(c1)[C@H](N[C@@H](C)c1cccc([O-])c1F)CCO2 ZINC000872062894 1054372902 /nfs/dbraw/zinc/37/29/02/1054372902.db2.gz LNTGNQMQZCIEEA-BLLLJJGKSA-N -1 3 331.387 4.104 20 0 EIADHM [O-]c1ccc(NC(=S)NCC2CCCCC2)cc1Br ZINC001199923332 1054496016 /nfs/dbraw/zinc/49/60/16/1054496016.db2.gz VMOFOHYWXJCSLE-UHFFFAOYSA-N -1 3 343.290 4.021 20 0 EIADHM O=C(Nc1ccc(Nc2ncc(Cl)cc2[O-])cc1)c1ccccc1 ZINC001201307362 1054749756 /nfs/dbraw/zinc/74/97/56/1054749756.db2.gz MHLVOUSOSBWBEE-UHFFFAOYSA-N -1 3 339.782 4.437 20 0 EIADHM Cc1cccc(C(C)C)c1NC(=O)[C@H](C)OC(=O)c1ccc([O-])cc1 ZINC000005694133 1054902617 /nfs/dbraw/zinc/90/26/17/1054902617.db2.gz HKHBSFRLQMBROM-AWEZNQCLSA-N -1 3 341.407 4.008 20 0 EIADHM Cc1cc(O)cc([N-]S(=O)(=O)c2c(C)c(C)c(C)c(C)c2C)c1 ZINC001201797522 1054908856 /nfs/dbraw/zinc/90/88/56/1054908856.db2.gz DAPLQEIOBJPRET-UHFFFAOYSA-N -1 3 333.453 4.044 20 0 EIADHM Cc1c(C)c(C)c(S(=O)(=O)[N-]c2cccc([C@H](C)O)c2)c(C)c1C ZINC001201789013 1054919862 /nfs/dbraw/zinc/91/98/62/1054919862.db2.gz AUPSLQZWYHUJQV-INIZCTEOSA-N -1 3 347.480 4.083 20 0 EIADHM CC(=O)c1cccc(NC(=O)Nc2ccccc2Br)c1[O-] ZINC001201979328 1054956944 /nfs/dbraw/zinc/95/69/44/1054956944.db2.gz YYMRJBLPPMJISA-UHFFFAOYSA-N -1 3 349.184 4.001 20 0 EIADHM CC(=O)c1cccc([O-])c1NC(=O)Nc1ccccc1C(F)(F)F ZINC001202166444 1055065486 /nfs/dbraw/zinc/06/54/86/1055065486.db2.gz NDFMHCIXPQKSRR-UHFFFAOYSA-N -1 3 338.285 4.258 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(NCC[C@H](C)c3ccccc3)nc2)n1 ZINC000068696602 1055089660 /nfs/dbraw/zinc/08/96/60/1055089660.db2.gz NLOOHNJIHJZWLB-HNNXBMFYSA-N -1 3 348.450 4.000 20 0 EIADHM O=C(NCCCCCCc1ccccc1)c1c[n-]c2ccccc2c1=O ZINC000862626990 1055092942 /nfs/dbraw/zinc/09/29/42/1055092942.db2.gz VMUSDZDHRMYHJE-UHFFFAOYSA-N -1 3 348.446 4.061 20 0 EIADHM Cc1ccc(C(C)(C)CNC(=O)c2cc3sccc3c([O-])c2)nc1 ZINC000862783379 1055109376 /nfs/dbraw/zinc/10/93/76/1055109376.db2.gz RZCWXJPTZSASLL-UHFFFAOYSA-N -1 3 340.448 4.018 20 0 EIADHM CC(C)(C)OC(=O)c1ccc(NC(=O)Nc2cccc(F)c2)c([O-])c1 ZINC001202232779 1055109604 /nfs/dbraw/zinc/10/96/04/1055109604.db2.gz YBZANGRYJJRMAJ-UHFFFAOYSA-N -1 3 346.358 4.131 20 0 EIADHM CCCN(Cc1nnc(-c2ccccc2[O-])o1)Cc1ccc(C)cc1 ZINC000877908516 1055151233 /nfs/dbraw/zinc/15/12/33/1055151233.db2.gz QTQUFSHGFYKELX-UHFFFAOYSA-N -1 3 337.423 4.163 20 0 EIADHM O=C([N-]c1nnc(-c2ccco2)s1)c1cc2cc(Cl)ccc2o1 ZINC000072989911 1055159633 /nfs/dbraw/zinc/15/96/33/1055159633.db2.gz KSAGALDHNVNQOD-UHFFFAOYSA-N -1 3 345.767 4.450 20 0 EIADHM Cc1ccccc1[C@H](NCc1nnc(-c2ccccc2[O-])o1)C(C)C ZINC000878362820 1055262905 /nfs/dbraw/zinc/26/29/05/1055262905.db2.gz IVKIKWFZVBVEIE-LJQANCHMSA-N -1 3 337.423 4.238 20 0 EIADHM COCCOc1c(Cl)cccc1N[C@@H](C)c1ccc(F)cc1[O-] ZINC000186342453 1055370193 /nfs/dbraw/zinc/37/01/93/1055370193.db2.gz KQRKXSXNLIPUSQ-NSHDSACASA-N -1 3 339.794 4.383 20 0 EIADHM CC(=O)Nc1cc(NC(=O)c2cc([O-])c3ccccc3c2)ccc1C ZINC000352845039 1055538687 /nfs/dbraw/zinc/53/86/87/1055538687.db2.gz RRFGJIXRIFXICY-UHFFFAOYSA-N -1 3 334.375 4.065 20 0 EIADHM Cc1nc(SCc2cc(=O)oc3c(C)c([O-])ccc23)sc1C ZINC000741857288 1058403369 /nfs/dbraw/zinc/40/33/69/1058403369.db2.gz HHWSCZZVUJOMTN-UHFFFAOYSA-N -1 3 333.434 4.173 20 0 EIADHM COc1cccc(-c2noc([N-]Cc3ccc([C@@H]4C[C@H]4C)o3)n2)c1 ZINC000742394828 1058594015 /nfs/dbraw/zinc/59/40/15/1058594015.db2.gz YGPLVASYWKKJRR-IAQYHMDHSA-N -1 3 325.368 4.074 20 0 EIADHM CCc1ccsc1C(=O)Oc1cccc(-c2nc(C)cc(=O)[n-]2)c1 ZINC000744218395 1059337200 /nfs/dbraw/zinc/33/72/00/1059337200.db2.gz ZCQMOXDVFYJMOB-UHFFFAOYSA-N -1 3 340.404 4.001 20 0 EIADHM COc1cccc(CCCOC(=O)c2cc(Cl)c(Cl)[n-]2)c1 ZINC000744233397 1059342428 /nfs/dbraw/zinc/34/24/28/1059342428.db2.gz KVCUUTORWRJETR-UHFFFAOYSA-N -1 3 328.195 4.120 20 0 EIADHM COc1ccc(Nc2c(Cl)ccc([O-])c2F)c(Br)n1 ZINC001214557511 1059832083 /nfs/dbraw/zinc/83/20/83/1059832083.db2.gz ARMTUJHVGZZZOD-UHFFFAOYSA-N -1 3 347.571 4.094 20 0 EIADHM Cc1sc2[n-]c([C@H](C)OC(=O)C3C(C)(C)C3(C)C)nc(=O)c2c1C ZINC000746082591 1060004993 /nfs/dbraw/zinc/00/49/93/1060004993.db2.gz QCTXCHCGHDWVJR-VIFPVBQESA-N -1 3 348.468 4.300 20 0 EIADHM CCOC(=O)c1cnc(Cl)cc1Nc1ccc(Cl)c([O-])c1 ZINC001212589214 1060769851 /nfs/dbraw/zinc/76/98/51/1060769851.db2.gz AHJYCCQPLAPUFB-UHFFFAOYSA-N -1 3 327.167 4.014 20 0 EIADHM [O-]c1cc(Nc2cc(Br)c3nccn3c2)ccc1Cl ZINC001212590270 1060818882 /nfs/dbraw/zinc/81/88/82/1060818882.db2.gz DKDNUUALGFZFJL-UHFFFAOYSA-N -1 3 338.592 4.199 20 0 EIADHM Cc1cc(Br)cc(Nc2ccc(Cl)c([O-])c2)c1N ZINC001212592383 1060889271 /nfs/dbraw/zinc/88/92/71/1060889271.db2.gz NCTGJVBDLWQHJM-UHFFFAOYSA-N -1 3 327.609 4.442 20 0 EIADHM COC(=O)c1cc(F)c(Nc2ccc(Cl)c([O-])c2)c(C)c1F ZINC001212593665 1060911238 /nfs/dbraw/zinc/91/12/38/1060911238.db2.gz CYCHXMFXGGSWRN-UHFFFAOYSA-N -1 3 327.714 4.162 20 0 EIADHM Nc1ccc(-c2ccc(Nc3ccc(Cl)c([O-])c3)c(O)c2)cc1O ZINC001212594317 1060931230 /nfs/dbraw/zinc/93/12/30/1060931230.db2.gz WJUCSADCOYGZKE-UHFFFAOYSA-N -1 3 342.782 4.450 20 0 EIADHM [O-]c1cccnc1CNc1ncc(C(F)(F)F)cc1-c1ccco1 ZINC001169730897 1060933413 /nfs/dbraw/zinc/93/34/13/1060933413.db2.gz KWXBHKAWLRGUSX-UHFFFAOYSA-N -1 3 335.285 4.073 20 0 EIADHM [O-]c1cccnc1CNc1cc2ccccc2cc1Br ZINC001169731604 1060933984 /nfs/dbraw/zinc/93/39/84/1060933984.db2.gz CJOPFMFKFNEMOZ-UHFFFAOYSA-N -1 3 329.197 4.315 20 0 EIADHM CC[C@@H](NC(=O)Cc1ccc([O-])c(F)c1)c1ccc(Cl)s1 ZINC000449864637 1032071405 /nfs/dbraw/zinc/07/14/05/1032071405.db2.gz PRXVBZPKSYALLG-LLVKDONJSA-N -1 3 327.808 4.056 20 0 EIADHM COC(=O)c1cnc(S[C@@H](C)c2ccc(C(F)(F)F)cc2)[n-]1 ZINC000193540007 1032158595 /nfs/dbraw/zinc/15/85/95/1032158595.db2.gz NTFLCQLVTBXHEJ-QMMMGPOBSA-N -1 3 330.331 4.068 20 0 EIADHM O=C(COc1c(Cl)cccc1Cl)Nc1ccc(Cl)cc1[O-] ZINC000532836602 1032340539 /nfs/dbraw/zinc/34/05/39/1032340539.db2.gz FNYBJXWBUACTBZ-UHFFFAOYSA-N -1 3 346.597 4.370 20 0 EIADHM C[C@@H](Nc1cnn(CC(F)F)c1)c1cc(Cl)c(Cl)cc1[O-] ZINC000193097613 1032347017 /nfs/dbraw/zinc/34/70/17/1032347017.db2.gz XOEABORJLIQCLK-SSDOTTSWSA-N -1 3 336.169 4.334 20 0 EIADHM Cc1nc(-c2ccc(NC[C@H]3CCCCC3(F)F)nc2)[n-]c(=O)c1C ZINC000450584033 1032564282 /nfs/dbraw/zinc/56/42/82/1032564282.db2.gz NLZFFAGJVZVTSW-CQSZACIVSA-N -1 3 348.397 4.098 20 0 EIADHM O=C(Nc1ccc(-n2cccn2)c(Cl)c1)c1cc([O-])ccc1Cl ZINC000339803183 1019880689 /nfs/dbraw/zinc/88/06/89/1019880689.db2.gz HAKLUTIDAWZSKB-UHFFFAOYSA-N -1 3 348.189 4.137 20 0 EIADHM CC[C@@H](C)Sc1ccc(NC(=O)NCc2ncccc2[O-])c(C)c1 ZINC000471247512 1020213606 /nfs/dbraw/zinc/21/36/06/1020213606.db2.gz SFTNMAZHEKZCRP-CYBMUJFWSA-N -1 3 345.468 4.308 20 0 EIADHM CC[C@H](C)Sc1ccc(NC(=O)NCc2ncccc2[O-])c(C)c1 ZINC000471247513 1020214672 /nfs/dbraw/zinc/21/46/72/1020214672.db2.gz SFTNMAZHEKZCRP-ZDUSSCGKSA-N -1 3 345.468 4.308 20 0 EIADHM O=C(CCCCC(=O)c1ccccc1)Nc1ccc(Cl)cc1[O-] ZINC000153641993 1020347038 /nfs/dbraw/zinc/34/70/38/1020347038.db2.gz VRIBRQBPSGJBAK-UHFFFAOYSA-N -1 3 331.799 4.427 20 0 EIADHM C[C@H](NC(=O)c1c[n-]c2ccccc2c1=O)c1cccc2ccccc21 ZINC000032698927 1020479003 /nfs/dbraw/zinc/47/90/03/1020479003.db2.gz UDFORQKTCATAGH-AWEZNQCLSA-N -1 3 342.398 4.172 20 0 EIADHM [O-]c1ccc(F)c(CNCc2csc(-c3ccccc3)n2)c1F ZINC000510226540 1020516451 /nfs/dbraw/zinc/51/64/51/1020516451.db2.gz FGRXVBRFBNTDTE-UHFFFAOYSA-N -1 3 332.375 4.084 20 0 EIADHM Cc1noc(C)c1[N-]C(=O)c1cc2cc(Br)ccc2o1 ZINC000340266324 1020703709 /nfs/dbraw/zinc/70/37/09/1020703709.db2.gz XKCHGSPERHYDOX-UHFFFAOYSA-N -1 3 335.157 4.052 20 0 EIADHM O=C(N[C@@H]1CCCc2sccc21)c1cc([O-])cc(C(F)(F)F)c1 ZINC000646958990 1020876408 /nfs/dbraw/zinc/87/64/08/1020876408.db2.gz PSDTYEMSMWMCFR-CYBMUJFWSA-N -1 3 341.354 4.280 20 0 EIADHM [O-]c1c(Cl)cccc1Nc1cn2c(cccc2Br)n1 ZINC001210219444 1020956076 /nfs/dbraw/zinc/95/60/76/1020956076.db2.gz JCOWYMJUEHCJAP-UHFFFAOYSA-N -1 3 338.592 4.199 20 0 EIADHM Cc1ccc([N-]S(=O)(=O)c2cccc3c(C)ccnc32)c(Cl)c1 ZINC000547955278 1020958158 /nfs/dbraw/zinc/95/81/58/1020958158.db2.gz FNWHAESAMGWCJK-UHFFFAOYSA-N -1 3 346.839 4.306 20 0 EIADHM [O-]c1c(Cl)cccc1Nc1ccc(I)cc1 ZINC001210223541 1020964062 /nfs/dbraw/zinc/96/40/62/1020964062.db2.gz YVJCZTDYWXXAHT-UHFFFAOYSA-N -1 3 345.567 4.394 20 0 EIADHM Cc1ccc(OC2CCN(C(=O)c3cc([O-])ccc3Cl)CC2)cc1 ZINC000340435751 1021020990 /nfs/dbraw/zinc/02/09/90/1021020990.db2.gz OBMKIAUJUIFWMG-UHFFFAOYSA-N -1 3 345.826 4.038 20 0 EIADHM Cc1ocnc1C(=O)[N-]c1cccc(Cl)c1SCC(F)F ZINC000134994025 1021092490 /nfs/dbraw/zinc/09/24/90/1021092490.db2.gz XWILGCCQHRAQQD-UHFFFAOYSA-N -1 3 332.759 4.246 20 0 EIADHM O=c1[n-]nc(S[C@H]2CCc3ccccc32)n1CCc1ccccc1 ZINC000683736543 1021227230 /nfs/dbraw/zinc/22/72/30/1021227230.db2.gz BBXQETBFJKETPP-KRWDZBQOSA-N -1 3 337.448 4.006 20 0 EIADHM Cc1ccc(CCCN(CCC(=O)[O-])Cc2cccc(F)c2F)cc1 ZINC000570286333 1021316936 /nfs/dbraw/zinc/31/69/36/1021316936.db2.gz IMERHZOFEZKUEN-UHFFFAOYSA-N -1 3 347.405 4.183 20 0 EIADHM CC(C)Oc1cccc([C@@H](C)NC(=O)c2cc([O-])ccc2Cl)c1 ZINC000431722540 1021646970 /nfs/dbraw/zinc/64/69/70/1021646970.db2.gz MSIAESCGVXGDAQ-GFCCVEGCSA-N -1 3 333.815 4.324 20 0 EIADHM C[C@@H](NC(=O)c1cc([O-])ccc1Cl)c1cccc(OC(F)F)c1 ZINC000431753494 1021776636 /nfs/dbraw/zinc/77/66/36/1021776636.db2.gz NYUCVBPRQKAMMT-SECBINFHSA-N -1 3 341.741 4.138 20 0 EIADHM O=C(NCc1ccc(F)cc1C(F)(F)F)c1cc([O-])ccc1Cl ZINC000431757299 1021793466 /nfs/dbraw/zinc/79/34/66/1021793466.db2.gz IVRMEBNIOBQXMI-UHFFFAOYSA-N -1 3 347.695 4.134 20 0 EIADHM [O-]c1cccc(Nc2ccc3nnc(-c4ccccc4)n3c2)c1Cl ZINC001210853835 1021802601 /nfs/dbraw/zinc/80/26/01/1021802601.db2.gz MEXURXHLKPIDOW-UHFFFAOYSA-N -1 3 336.782 4.499 20 0 EIADHM COc1ccc(-c2ocnc2C(=O)[N-]c2cc(F)c(F)cc2F)cc1 ZINC000580320120 1021855633 /nfs/dbraw/zinc/85/56/33/1021855633.db2.gz OBJFLGXCZYNJQL-UHFFFAOYSA-N -1 3 348.280 4.020 20 0 EIADHM C[C@@H](c1ccc(Br)cc1)N1CCC[C@H](CCC(=O)[O-])C1 ZINC000086809215 1021978295 /nfs/dbraw/zinc/97/82/95/1021978295.db2.gz WOKPHXNLUKKFIN-QWHCGFSZSA-N -1 3 340.261 4.087 20 0 EIADHM FC(F)(F)[C@@H](C[C@H]1CCCO1)[N-]c1nc(-c2ccccc2)ns1 ZINC000656224495 1022057752 /nfs/dbraw/zinc/05/77/52/1022057752.db2.gz JVEHHLBGFPLDPF-VXGBXAGGSA-N -1 3 343.374 4.117 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)N1CCC[C@H]1c1cccc(F)c1 ZINC000468641289 1022307593 /nfs/dbraw/zinc/30/75/93/1022307593.db2.gz ZMGBGUNNHHJKFD-SFHVURJKSA-N -1 3 345.389 4.357 20 0 EIADHM CSc1ccsc1C(=O)[N-]c1nc(-c2cccs2)ns1 ZINC000182141560 1022314100 /nfs/dbraw/zinc/31/41/00/1022314100.db2.gz BVQVRTKKZGUKDQ-UHFFFAOYSA-N -1 3 339.492 4.302 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])[C@@H]1SCCc2sccc21 ZINC000175615701 1022409489 /nfs/dbraw/zinc/40/94/89/1022409489.db2.gz WVEDAOLWSAGAHY-CYBMUJFWSA-N -1 3 325.842 4.076 20 0 EIADHM O=C([N-]c1nc(-c2ccc[nH]2)cs1)c1cc(-c2ccccc2)no1 ZINC000041784873 1022626336 /nfs/dbraw/zinc/62/63/36/1022626336.db2.gz NUMUCSNJRATRNE-UHFFFAOYSA-N -1 3 336.376 4.046 20 0 EIADHM CC(C)Oc1ccc(N(C)C(=O)CCCc2ccc([O-])c(F)c2)cc1 ZINC000430525603 1022664197 /nfs/dbraw/zinc/66/41/97/1022664197.db2.gz BWMQECJFAPICHI-UHFFFAOYSA-N -1 3 345.414 4.304 20 0 EIADHM CN(CCOc1ccccc1)Cc1cc(Cl)c([O-])c(Cl)c1 ZINC001140834723 1022673067 /nfs/dbraw/zinc/67/30/67/1022673067.db2.gz WIYVYFYIWHGECX-UHFFFAOYSA-N -1 3 326.223 4.210 20 0 EIADHM CCN(C(=O)c1cc(SC)ccc1[O-])[C@@H](C)Cc1ccsc1 ZINC000613699947 1022746900 /nfs/dbraw/zinc/74/69/00/1022746900.db2.gz FTVKZXDCAMPCJI-LBPRGKRZSA-N -1 3 335.494 4.269 20 0 EIADHM Cc1ncc(C(=O)Nc2cc(Cl)ccc2[O-])c(Cl)c1Cl ZINC000154854759 1022943607 /nfs/dbraw/zinc/94/36/07/1022943607.db2.gz IWGGJPVJKCNODH-UHFFFAOYSA-N -1 3 331.586 4.308 20 0 EIADHM Cc1ccc(-c2noc(C=C([O-])c3ccccc3Cl)n2)c(C)c1 ZINC001211647088 1023216347 /nfs/dbraw/zinc/21/63/47/1023216347.db2.gz GZKBOKLRLXXNEU-UHFFFAOYSA-N -1 3 326.783 4.432 20 0 EIADHM CC(C)[C@@H](NC(=O)CCCc1ccc([O-])c(F)c1)c1ccccc1 ZINC000468544515 1023217054 /nfs/dbraw/zinc/21/70/54/1023217054.db2.gz SORANJBDZPUSIP-HXUWFJFHSA-N -1 3 329.415 4.368 20 0 EIADHM CSCc1c2ccccc2oc1C(=O)Nc1cc(F)ccc1[O-] ZINC000610507482 1023224787 /nfs/dbraw/zinc/22/47/87/1023224787.db2.gz QXWJIAQCGKOITB-UHFFFAOYSA-N -1 3 331.368 4.393 20 0 EIADHM CCCOc1ccc(CN[C@@H](CC(=O)[O-])c2ccsc2)c(C)c1 ZINC000656564335 1023229204 /nfs/dbraw/zinc/22/92/04/1023229204.db2.gz JYRFIKHKXKIVHN-KRWDZBQOSA-N -1 3 333.453 4.151 20 0 EIADHM O=C(c1ccc(O)cc1[O-])N1CCCCC[C@H]1/C=C/c1cccs1 ZINC000180922185 1023231067 /nfs/dbraw/zinc/23/10/67/1023231067.db2.gz OSPFHHVUXDMMSL-KGXGESDWSA-N -1 3 343.448 4.258 20 0 EIADHM CC1(CC(=O)NCc2ccc([O-])c(Br)c2)CCCCC1 ZINC000511635148 1023345626 /nfs/dbraw/zinc/34/56/26/1023345626.db2.gz CTSTVXROQFVKFZ-UHFFFAOYSA-N -1 3 340.261 4.131 20 0 EIADHM O=C([O-])CCN(Cc1cccc(F)c1F)C[C@H]1CCCCC1(F)F ZINC000581553604 1023359224 /nfs/dbraw/zinc/35/92/24/1023359224.db2.gz XLZHYAQVAGGPJG-CYBMUJFWSA-N -1 3 347.352 4.067 20 0 EIADHM Cc1cc(F)c(CNCC[C@@H](Cc2ccccc2)C(=O)[O-])c(Cl)c1 ZINC000417576725 1023361594 /nfs/dbraw/zinc/36/15/94/1023361594.db2.gz ZYOKEWCXEXCNBV-HNNXBMFYSA-N -1 3 349.833 4.211 20 0 EIADHM CC(C)COc1ccccc1CN[C@@H]1C[C@H](C(=O)[O-])c2ccccc21 ZINC000417634312 1023384807 /nfs/dbraw/zinc/38/48/07/1023384807.db2.gz VKHQSGXIYRIRMV-RBUKOAKNSA-N -1 3 339.435 4.124 20 0 EIADHM O=C(N=c1cc(-c2ccccc2)o[n-]1)c1coc(C2CCCCC2)n1 ZINC000549182322 1023440712 /nfs/dbraw/zinc/44/07/12/1023440712.db2.gz CWGGUWGUAUIUDC-UHFFFAOYSA-N -1 3 337.379 4.052 20 0 EIADHM O=C([O-])[C@H](c1cc(Cl)cc(Cl)c1)N1CCC[C@@H](CCF)C1 ZINC000656763097 1023503015 /nfs/dbraw/zinc/50/30/15/1023503015.db2.gz LBRUJEXJEDEFEF-HZMBPMFUSA-N -1 3 334.218 4.191 20 0 EIADHM O=C([O-])[C@@H]1CCN(Cc2cccc(Cl)c2Cl)[C@H]2CCCC[C@@H]12 ZINC000656763461 1023503409 /nfs/dbraw/zinc/50/34/09/1023503409.db2.gz FXSVXTQIAHTRIQ-GUTXKFCHSA-N -1 3 342.266 4.459 20 0 EIADHM O=C([O-])[C@@H]1CCN(Cc2cc(Cl)ccc2Cl)[C@@H]2CCCC[C@@H]12 ZINC000656762473 1023508406 /nfs/dbraw/zinc/50/84/06/1023508406.db2.gz BBLREQZJQNPLKR-SQWLQELKSA-N -1 3 342.266 4.459 20 0 EIADHM CC[C@H](NC(=O)CCCc1ccc([O-])c(F)c1)c1ccc(C)cc1 ZINC000468582111 1023515984 /nfs/dbraw/zinc/51/59/84/1023515984.db2.gz SXAPFHNEHRBECK-SFHVURJKSA-N -1 3 329.415 4.430 20 0 EIADHM CC(C)[C@@H](c1ccccc1)N(C)C(=O)NCc1ccc([O-])c(F)c1 ZINC000163768417 1023702543 /nfs/dbraw/zinc/70/25/43/1023702543.db2.gz SFVXGYONSDQYBJ-SFHVURJKSA-N -1 3 330.403 4.070 20 0 EIADHM Cc1cc(=O)[n-]c(-c2cccc(OC(=O)[C@H]3C[C@H](C)C[C@H](C)C3)c2)n1 ZINC000780391300 1023765604 /nfs/dbraw/zinc/76/56/04/1023765604.db2.gz UNVFFJQGDKHOIV-VIKVFOODSA-N -1 3 340.423 4.135 20 0 EIADHM CC(C)(C)C(=O)c1ccsc1[N-]C(=O)c1nc(Cl)ccc1F ZINC000759878594 1023767341 /nfs/dbraw/zinc/76/73/41/1023767341.db2.gz PVNPHCACULFHPY-UHFFFAOYSA-N -1 3 340.807 4.417 20 0 EIADHM CC[C@H](C)Oc1ccc([N-]S(=O)(=O)c2cc(C)ccc2C)cc1 ZINC000511701746 1023833009 /nfs/dbraw/zinc/83/30/09/1023833009.db2.gz QYXNLELDDPWPJF-HNNXBMFYSA-N -1 3 333.453 4.282 20 0 EIADHM COc1ccc(C(=O)Nc2cc(Cl)ccc2[O-])c(OCC2CC2)c1 ZINC000473065993 1023834321 /nfs/dbraw/zinc/83/43/21/1023834321.db2.gz LDEHKZUZQMPPFI-UHFFFAOYSA-N -1 3 347.798 4.095 20 0 EIADHM CC(C)CCO[C@@H]1CCCC[C@H]1NC(=O)c1cc([O-])ccc1Cl ZINC000511855361 1023943854 /nfs/dbraw/zinc/94/38/54/1023943854.db2.gz NMZLIHXIFYARGA-IAGOWNOFSA-N -1 3 339.863 4.149 20 0 EIADHM O=C(Nc1c([O-])cccc1Cl)c1ccn(-c2cccc(Cl)c2)n1 ZINC000557181936 1024089531 /nfs/dbraw/zinc/08/95/31/1024089531.db2.gz ATGPCALOFDWHIX-UHFFFAOYSA-N -1 3 348.189 4.137 20 0 EIADHM Cc1cccc(C)c1[C@H]1CCCN1Cc1nc(=O)c2sccc2[n-]1 ZINC000661132264 1024258797 /nfs/dbraw/zinc/25/87/97/1024258797.db2.gz HMLOQUNEFZLSFE-OAHLLOKOSA-N -1 3 339.464 4.351 20 0 EIADHM Cc1cc2sc(NC(=O)c3cc([O-])ccc3Cl)nc2cc1F ZINC000510841423 1024608114 /nfs/dbraw/zinc/60/81/14/1024608114.db2.gz IPKVGLWYXDAULB-UHFFFAOYSA-N -1 3 336.775 4.355 20 0 EIADHM Cc1cc(Cl)ccc1S(=O)(=O)[N-]c1cccc(Cl)c1F ZINC000048653617 1024671494 /nfs/dbraw/zinc/67/14/94/1024671494.db2.gz OTLWCLWZEPCVHB-UHFFFAOYSA-N -1 3 334.199 4.242 20 0 EIADHM O=C([O-])c1ccc(-c2nc(CN(C3CC3)C3CCCCC3)co2)cc1 ZINC000652400984 1024809669 /nfs/dbraw/zinc/80/96/69/1024809669.db2.gz CXPNQDZCEHSSDE-UHFFFAOYSA-N -1 3 340.423 4.337 20 0 EIADHM O=C([O-])c1ccc(-c2nc(CN3CCCC[C@H]3C3CCC3)co2)cc1 ZINC000652415441 1024822453 /nfs/dbraw/zinc/82/24/53/1024822453.db2.gz RLUCDZZIXCIMTM-SFHVURJKSA-N -1 3 340.423 4.194 20 0 EIADHM CC[C@@]1(C)CCCN(Cc2cc(Br)ccc2C(=O)[O-])C1 ZINC000652416502 1024824284 /nfs/dbraw/zinc/82/42/84/1024824284.db2.gz KXXNRNRXZCHUPL-INIZCTEOSA-N -1 3 340.261 4.159 20 0 EIADHM C[C@H](c1ccc(Cl)cc1)[C@@H](C)N(C)Cc1nc(C(=O)[O-])cs1 ZINC000652429384 1024825647 /nfs/dbraw/zinc/82/56/47/1024825647.db2.gz NMIRGJPJIFWECU-WDEREUQCSA-N -1 3 338.860 4.119 20 0 EIADHM CCC1(c2ccccc2)CN(C(=O)c2cc([O-])c3ccccc3c2)C1 ZINC001299159318 1024828959 /nfs/dbraw/zinc/82/89/59/1024828959.db2.gz UCYBPUKRRVJYKV-UHFFFAOYSA-N -1 3 331.415 4.349 20 0 EIADHM CN(CC[C@@H](C(=O)[O-])c1ccccc1)Cc1cc(Cl)ccc1F ZINC000652436855 1024831318 /nfs/dbraw/zinc/83/13/18/1024831318.db2.gz GNVIXZGGALLWAV-MRXNPFEDSA-N -1 3 335.806 4.169 20 0 EIADHM O=C([O-])C[C@H](NCc1cccc(OC2CCCC2)c1)c1ccsc1 ZINC000276960641 1024832687 /nfs/dbraw/zinc/83/26/87/1024832687.db2.gz FRPTVTYXCPVULU-SFHVURJKSA-N -1 3 345.464 4.375 20 0 EIADHM C[C@@H](CCSc1ccccc1)N1Cc2ccccc2[C@H](C(=O)[O-])C1 ZINC000652469725 1024845546 /nfs/dbraw/zinc/84/55/46/1024845546.db2.gz CXGSFCRWRDOPBW-HNAYVOBHSA-N -1 3 341.476 4.241 20 0 EIADHM O=C([O-])[C@H]1CN(CCCc2cccc3ccccc32)Cc2ccccc21 ZINC000652470993 1024846504 /nfs/dbraw/zinc/84/65/04/1024846504.db2.gz PNBHNMFYFLPXRA-QFIPXVFZSA-N -1 3 345.442 4.456 20 0 EIADHM O=C([O-])c1ccc(CN2CCCC[C@H]2Cc2ccccc2F)c(F)c1 ZINC000652507924 1024859436 /nfs/dbraw/zinc/85/94/36/1024859436.db2.gz RISYLZAZVFRNPF-KRWDZBQOSA-N -1 3 345.389 4.260 20 0 EIADHM CCc1cccc2cc(CNC[C@H](CCC(=O)[O-])C(F)(F)F)oc21 ZINC000663260954 1024966265 /nfs/dbraw/zinc/96/62/65/1024966265.db2.gz FLWYKARSLIWCMX-ZDUSSCGKSA-N -1 3 343.345 4.128 20 0 EIADHM CC(=O)c1ccc(C(=O)Nc2ccccc2CCC(C)C)cc1[O-] ZINC001625907393 1025065460 /nfs/dbraw/zinc/06/54/60/1025065460.db2.gz HHPGWOPQLILVTM-UHFFFAOYSA-N -1 3 325.408 4.436 20 0 EIADHM O=C(Nc1cc(Br)ccc1[O-])c1csc(Cl)c1 ZINC000188650567 1025159942 /nfs/dbraw/zinc/15/99/42/1025159942.db2.gz OCCJIDSQJQHZOR-UHFFFAOYSA-N -1 3 332.606 4.122 20 0 EIADHM [O-]c1cc(F)cc(CNc2ccnn2Cc2ccc(Cl)c(F)c2)c1 ZINC000472051162 1025534582 /nfs/dbraw/zinc/53/45/82/1025534582.db2.gz DVJFOXQWZSRGHT-UHFFFAOYSA-N -1 3 349.768 4.181 20 0 EIADHM Cc1ccc([N-]S(=O)(=O)c2ccc(OCC(C)C)cc2)c(C)c1 ZINC000506795675 1025761691 /nfs/dbraw/zinc/76/16/91/1025761691.db2.gz LSQGFUVXWFHHOF-UHFFFAOYSA-N -1 3 333.453 4.139 20 0 EIADHM CCc1cccc(C)c1[N-]S(=O)(=O)c1ccc(OCC(C)C)cc1 ZINC000506801754 1025773782 /nfs/dbraw/zinc/77/37/82/1025773782.db2.gz QEVZGAWXZKXZCP-UHFFFAOYSA-N -1 3 347.480 4.393 20 0 EIADHM CC[C@H](C)[C@H](C)[N-]S(=O)(=O)c1ccc(Cl)cc1C(F)(F)F ZINC000512029404 1025793592 /nfs/dbraw/zinc/79/35/92/1025793592.db2.gz CBXOHAZHPXWREY-IUCAKERBSA-N -1 3 343.798 4.072 20 0 EIADHM O=C(NCc1ncccc1[O-])c1cc2sc3ccccc3c2s1 ZINC000473634948 1025926664 /nfs/dbraw/zinc/92/66/64/1025926664.db2.gz BQTGNSXQZORPCJ-UHFFFAOYSA-N -1 3 340.429 4.147 20 0 EIADHM CC(C)c1nnc([N-]C(=O)c2ncccc2Oc2ccccc2)s1 ZINC000440439567 1025979604 /nfs/dbraw/zinc/97/96/04/1025979604.db2.gz CEDSXFPZOLBJHM-UHFFFAOYSA-N -1 3 340.408 4.101 20 0 EIADHM CC(C)Cn1ncc(NC(=O)c2cc([O-])ccc2Cl)c1C(F)F ZINC000344194307 1026120348 /nfs/dbraw/zinc/12/03/48/1026120348.db2.gz KHHIVYGVNKGWGF-UHFFFAOYSA-N -1 3 343.761 4.088 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)Nc1cc(Cl)cc(Cl)c1 ZINC000548700631 1026276809 /nfs/dbraw/zinc/27/68/09/1026276809.db2.gz VECFOHYIXXENSH-UHFFFAOYSA-N -1 3 329.158 4.160 20 0 EIADHM O=C(c1cc([O-])ccc1Cl)N(Cc1c(F)cccc1F)C1CC1 ZINC000349701410 1026308764 /nfs/dbraw/zinc/30/87/64/1026308764.db2.gz XASBOZNGDUQQTJ-UHFFFAOYSA-N -1 3 337.753 4.129 20 0 EIADHM C[C@@H](c1ncc(-c2ccc(Cl)cc2)o1)N1CCC[C@@](C)(C(=O)[O-])C1 ZINC000563277255 1026311534 /nfs/dbraw/zinc/31/15/34/1026311534.db2.gz NMKYEBYKMSHFBU-KPZWWZAWSA-N -1 3 348.830 4.243 20 0 EIADHM Cc1ccc(-c2nc(Cc3cccc(Br)c3)no2)c([O-])c1 ZINC000111687905 1026319166 /nfs/dbraw/zinc/31/91/66/1026319166.db2.gz YZWRLVQYEMYKGG-UHFFFAOYSA-N -1 3 345.196 4.104 20 0 EIADHM C[C@@H]1CCC[C@H](C)N1Cc1nc(=O)c2c(-c3ccco3)csc2[n-]1 ZINC000108863904 1026322788 /nfs/dbraw/zinc/32/27/88/1026322788.db2.gz FSHQAHVVNZIDLP-TXEJJXNPSA-N -1 3 343.452 4.008 20 0 EIADHM CSc1ccc(C(=O)[N-]c2nnc(Cc3ccc(C)cc3)s2)o1 ZINC000112246671 1026417469 /nfs/dbraw/zinc/41/74/69/1026417469.db2.gz KJHRHHFSSOSAAP-UHFFFAOYSA-N -1 3 345.449 4.005 20 0 EIADHM Cc1cnc(Cl)c([N-]S(=O)(=O)c2ccc(C(C)(C)C)cc2)c1 ZINC000318897336 1026422421 /nfs/dbraw/zinc/42/24/21/1026422421.db2.gz RIAYDXUTMCAIJF-UHFFFAOYSA-N -1 3 338.860 4.142 20 0 EIADHM O=C([O-])[C@@H](NCc1ccc(C(F)(F)F)cc1)c1cccc(Cl)c1 ZINC000426737472 1026518829 /nfs/dbraw/zinc/51/88/29/1026518829.db2.gz OITVYOADSJQJSS-AWEZNQCLSA-N -1 3 343.732 4.274 20 0 EIADHM O=C([O-])[C@H](NCc1ccc(C(F)(F)F)cc1)c1cccc(Cl)c1 ZINC000426737473 1026520232 /nfs/dbraw/zinc/52/02/32/1026520232.db2.gz OITVYOADSJQJSS-CQSZACIVSA-N -1 3 343.732 4.274 20 0 EIADHM CN(Cc1ccccc1Br)Cc1c(F)ccc([O-])c1F ZINC000506926433 1026527190 /nfs/dbraw/zinc/52/71/90/1026527190.db2.gz DYGJUYWOUAUYIU-UHFFFAOYSA-N -1 3 342.183 4.065 20 0 EIADHM CC(C)COc1cccc(CN[C@@H](C(=O)[O-])c2cccc(Cl)c2)c1 ZINC000426748152 1026533328 /nfs/dbraw/zinc/53/33/28/1026533328.db2.gz VFZODKJSMYYNRV-GOSISDBHSA-N -1 3 347.842 4.290 20 0 EIADHM O=C([O-])C[C@H](NCc1ccsc1)c1cc(Cl)cc(Cl)c1 ZINC000426753123 1026538020 /nfs/dbraw/zinc/53/80/20/1026538020.db2.gz GYTHEYGCLDTGIW-ZDUSSCGKSA-N -1 3 330.236 4.361 20 0 EIADHM COc1ccc([C@@H](CCC(=O)[O-])NCc2ccc(Cl)s2)cc1 ZINC000426754187 1026539096 /nfs/dbraw/zinc/53/90/96/1026539096.db2.gz OICULOGFDCENJA-CQSZACIVSA-N -1 3 339.844 4.106 20 0 EIADHM CSc1ccc(CN[C@H](C(=O)[O-])c2ccc(Cl)c(F)c2)cc1 ZINC000426755606 1026542324 /nfs/dbraw/zinc/54/23/24/1026542324.db2.gz DNQOZLBCLCEMHQ-HNNXBMFYSA-N -1 3 339.819 4.117 20 0 EIADHM O=C([O-])C[C@H](NCc1cnc(-c2ccsc2)s1)c1ccccc1 ZINC000426770248 1026549701 /nfs/dbraw/zinc/54/97/01/1026549701.db2.gz QIHIZTXNQUXINN-HNNXBMFYSA-N -1 3 344.461 4.177 20 0 EIADHM Cc1cc([C@@H](NCc2cc(F)cc(Cl)c2)C(=O)[O-])ccc1Cl ZINC000426786463 1026562591 /nfs/dbraw/zinc/56/25/91/1026562591.db2.gz VTSYYOMQYGNRDU-OAHLLOKOSA-N -1 3 342.197 4.356 20 0 EIADHM Cc1cc([C@H](NCc2coc3ccccc23)C(=O)[O-])ccc1Cl ZINC000426799940 1026569319 /nfs/dbraw/zinc/56/93/19/1026569319.db2.gz MMCWTFJUUNRXEO-KRWDZBQOSA-N -1 3 329.783 4.310 20 0 EIADHM O=C([O-])[C@H](NCc1ccc(-c2ccccc2)cc1)c1cccc(F)c1 ZINC000426814678 1026577750 /nfs/dbraw/zinc/57/77/50/1026577750.db2.gz AIKCAHVWBSJFBU-HXUWFJFHSA-N -1 3 335.378 4.408 20 0 EIADHM COc1ccc(OC)c([C@@H]2CCCN2Cc2c(F)ccc([O-])c2F)c1 ZINC000507022040 1026600602 /nfs/dbraw/zinc/60/06/02/1026600602.db2.gz MRHXFWBUMXZIET-INIZCTEOSA-N -1 3 349.377 4.025 20 0 EIADHM CC(C)C[C@@H](C)n1nccc1NC(=O)CCCc1ccc([O-])c(F)c1 ZINC000426889763 1026603261 /nfs/dbraw/zinc/60/32/61/1026603261.db2.gz OOCSNRAYWRBGOA-CQSZACIVSA-N -1 3 347.434 4.296 20 0 EIADHM O=C(Cc1coc2ccccc12)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000582741728 1027176012 /nfs/dbraw/zinc/17/60/12/1027176012.db2.gz VKDJGYWFARKVNR-UHFFFAOYSA-N -1 3 335.281 4.338 20 0 EIADHM CC(=O)c1cccc(NC(=O)c2sc(C3CCCC3)nc2C)c1[O-] ZINC000582776526 1027308886 /nfs/dbraw/zinc/30/88/86/1027308886.db2.gz BPGBTKXGWUUBDD-UHFFFAOYSA-N -1 3 344.436 4.270 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@@H]3CCC[C@@H](C)CC3)nc2)n1 ZINC000302702758 1027366428 /nfs/dbraw/zinc/36/64/28/1027366428.db2.gz XRLHMQLSGALGQY-CZUORRHYSA-N -1 3 326.444 4.187 20 0 EIADHM COc1cc(CO[N-]C(=O)CCC2CCCCC2)ccc1SC ZINC000303566705 1027587206 /nfs/dbraw/zinc/58/72/06/1027587206.db2.gz MEGAVLCZWZWYCC-UHFFFAOYSA-N -1 3 337.485 4.325 20 0 EIADHM CCN(C(=O)c1ccccc1[O-])[C@@H](c1ccc(C)cc1)c1cccnc1 ZINC000112822274 1027652015 /nfs/dbraw/zinc/65/20/15/1027652015.db2.gz TWRKQDITGIAITE-NRFANRHFSA-N -1 3 346.430 4.347 20 0 EIADHM COc1cc(/C=C/C(=O)c2cccc(C)c2)cc(Br)c1[O-] ZINC000023164353 1027955150 /nfs/dbraw/zinc/95/51/50/1027955150.db2.gz TYOPELYJKKIGKO-VOTSOKGWSA-N -1 3 347.208 4.368 20 0 EIADHM Cc1cc(C)cc(CN(C)Cc2nc3c4ccccc4oc3c(=O)[n-]2)c1 ZINC000444700159 1027986165 /nfs/dbraw/zinc/98/61/65/1027986165.db2.gz VDXSPMVKDCASRT-UHFFFAOYSA-N -1 3 347.418 4.330 20 0 EIADHM COCOc1ccccc1Nc1cc(Br)cc(F)c1[O-] ZINC001211566515 1028020824 /nfs/dbraw/zinc/02/08/24/1028020824.db2.gz JUCIVKXYDQRJDR-UHFFFAOYSA-N -1 3 342.164 4.020 20 0 EIADHM [O-]c1ccc(F)c(CN(Cc2ccccc2)CC2CCOCC2)c1F ZINC000508517381 1028278623 /nfs/dbraw/zinc/27/86/23/1028278623.db2.gz FEFDGGNPFWVWDO-UHFFFAOYSA-N -1 3 347.405 4.099 20 0 EIADHM CC(=O)c1cccc(NC(=O)c2cc(C3CC3)nc3ccccc32)c1[O-] ZINC000583227885 1028298092 /nfs/dbraw/zinc/29/80/92/1028298092.db2.gz FBJRDLZMVLAENR-UHFFFAOYSA-N -1 3 346.386 4.273 20 0 EIADHM O=C1c2cc(Cl)ccc2N[C@H](c2ccc([O-])cc2F)N1CC1CC1 ZINC000639415443 1028363118 /nfs/dbraw/zinc/36/31/18/1028363118.db2.gz XMRLXDAUQDXVKT-KRWDZBQOSA-N -1 3 346.789 4.161 20 0 EIADHM [O-]c1ccc(OCc2ccccc2)cc1-c1nc(-c2ccoc2)no1 ZINC000445465016 1028587357 /nfs/dbraw/zinc/58/73/57/1028587357.db2.gz XBKBLKDRROVRPI-UHFFFAOYSA-N -1 3 334.331 4.281 20 0 EIADHM [O-]c1cc2ccccc2cc1-c1nc([C@H]2COc3ccccc3O2)no1 ZINC000445468193 1028595608 /nfs/dbraw/zinc/59/56/08/1028595608.db2.gz DIBQKVSHUCRHOZ-GOSISDBHSA-N -1 3 346.342 4.108 20 0 EIADHM Cc1cc([C@H](C)NC(=O)CCCc2ccc([O-])c(F)c2)c(C)s1 ZINC000468315171 1028727017 /nfs/dbraw/zinc/72/70/17/1028727017.db2.gz AALOXLICUMWGSP-LBPRGKRZSA-N -1 3 335.444 4.410 20 0 EIADHM COc1cc(Nc2cc(F)c([O-])c(F)c2)c(Br)cc1F ZINC001213389000 1028851603 /nfs/dbraw/zinc/85/16/03/1028851603.db2.gz XFIDDLRHSYHAQC-UHFFFAOYSA-N -1 3 348.118 4.324 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(NCC3(C4CCC4)CCC3)nc2)n1 ZINC000583551948 1028865840 /nfs/dbraw/zinc/86/58/40/1028865840.db2.gz QSFAOFBVCSLYEQ-UHFFFAOYSA-N -1 3 338.455 4.189 20 0 EIADHM O=S(=O)([N-]Cc1ccccc1-c1ccc(Cl)cc1)c1ccco1 ZINC000445746436 1028871439 /nfs/dbraw/zinc/87/14/39/1028871439.db2.gz ABHCHZYRDMIHRM-UHFFFAOYSA-N -1 3 347.823 4.079 20 0 EIADHM c1ccc(-c2nc([N-][C@@H](c3ccccc3)c3ccccn3)no2)cc1 ZINC000156926563 1028876480 /nfs/dbraw/zinc/87/64/80/1028876480.db2.gz MWEAWPUNMJZRKQ-SFHVURJKSA-N -1 3 328.375 4.333 20 0 EIADHM CSc1ccsc1C(=O)[N-]c1c(F)cc(C(C)=O)cc1F ZINC000347197112 1028937270 /nfs/dbraw/zinc/93/72/70/1028937270.db2.gz IAUUMUMVMFFVLU-UHFFFAOYSA-N -1 3 327.377 4.203 20 0 EIADHM CC[C@@H](C)n1[nH]c(=NC(=O)c2cc3cc(Cl)sc3[n-]2)cc1C ZINC000583726022 1029097335 /nfs/dbraw/zinc/09/73/35/1029097335.db2.gz RYGXNWUZCZSUNA-MRVPVSSYSA-N -1 3 336.848 4.033 20 0 EIADHM CC[C@H](C)n1[nH]c(=NC(=O)c2cc3cc(Cl)sc3[n-]2)cc1C ZINC000583726023 1029098202 /nfs/dbraw/zinc/09/82/02/1029098202.db2.gz RYGXNWUZCZSUNA-QMMMGPOBSA-N -1 3 336.848 4.033 20 0 EIADHM CC(C)[C@H](NC(=O)c1cc([O-])ccc1Cl)c1nc2ccccc2[nH]1 ZINC000583901211 1029345636 /nfs/dbraw/zinc/34/56/36/1029345636.db2.gz RKPZWZXCUVZUIO-INIZCTEOSA-N -1 3 343.814 4.049 20 0 EIADHM O=S(=O)([N-]Cc1ccc2ccccc2c1)c1ccc(Cl)s1 ZINC000525186952 1029500941 /nfs/dbraw/zinc/50/09/41/1029500941.db2.gz FCFHIJTYVZFKTD-UHFFFAOYSA-N -1 3 337.853 4.033 20 0 EIADHM CC1CCC(OC2CCN([C@H](C(=O)[O-])c3ccccc3F)CC2)CC1 ZINC000584118769 1029628330 /nfs/dbraw/zinc/62/83/30/1029628330.db2.gz LBJHZUYZGGDUHN-ZOJXTTQQSA-N -1 3 349.446 4.011 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(NCCCC3CCCC3)nc2)n1 ZINC000301186086 1029683525 /nfs/dbraw/zinc/68/35/25/1029683525.db2.gz UVGGMMKMANBNTO-UHFFFAOYSA-N -1 3 326.444 4.189 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(NC3CCC(C)(C)CC3)nc2)n1 ZINC000301444656 1029734492 /nfs/dbraw/zinc/73/44/92/1029734492.db2.gz VIDPZIFUAYUMBF-UHFFFAOYSA-N -1 3 326.444 4.187 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@@H]3CCCCC3(C)C)nc2)n1 ZINC000301615023 1029772834 /nfs/dbraw/zinc/77/28/34/1029772834.db2.gz IQDYDCRKPXOVPW-OAHLLOKOSA-N -1 3 326.444 4.187 20 0 EIADHM COc1ccc(SCCC(=O)Nc2cc(Cl)ccc2[O-])cc1 ZINC000302910206 1029869402 /nfs/dbraw/zinc/86/94/02/1029869402.db2.gz KSEAUZYXZPXHNT-UHFFFAOYSA-N -1 3 337.828 4.175 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@H](C)CCC=C(C)C)nc2)n1 ZINC000450680910 1029895112 /nfs/dbraw/zinc/89/51/12/1029895112.db2.gz ZGBABLVZJCISFV-CQSZACIVSA-N -1 3 326.444 4.353 20 0 EIADHM Cc1ccc(Cl)cc1[N-]S(=O)(=O)c1ccc(OC(C)C)cc1 ZINC000096659470 1030018774 /nfs/dbraw/zinc/01/87/74/1030018774.db2.gz YEMCLAZWWHWANN-UHFFFAOYSA-N -1 3 339.844 4.236 20 0 EIADHM COc1ccc(S(=O)(=O)[N-]c2ccc(Cl)c(Cl)c2)c(C)c1 ZINC000096659706 1030020281 /nfs/dbraw/zinc/02/02/81/1030020281.db2.gz BYOWMAYXJIGTHG-UHFFFAOYSA-N -1 3 346.235 4.111 20 0 EIADHM O=C([O-])c1ccccc1OCCN1CCC[C@@H]1c1cccc(Cl)c1 ZINC000183914447 1030041817 /nfs/dbraw/zinc/04/18/17/1030041817.db2.gz IZXNCDMPBOXXQC-QGZVFWFLSA-N -1 3 345.826 4.254 20 0 EIADHM Cc1nc(CSc2nnc([N-]c3ccccc3F)s2)oc1C ZINC000142030892 1030069148 /nfs/dbraw/zinc/06/91/48/1030069148.db2.gz VODWGOARQWVVJA-UHFFFAOYSA-N -1 3 336.417 4.318 20 0 EIADHM COc1ccc2cccc(CC(=O)Nc3ccc(Cl)cc3[O-])c2c1 ZINC000536219062 1030096865 /nfs/dbraw/zinc/09/68/65/1030096865.db2.gz HNINAFNLKHLKSF-UHFFFAOYSA-N -1 3 341.794 4.389 20 0 EIADHM Cc1ccc([O-])c(NC(=O)c2[nH]c3ccc(Cl)cc3c2Cl)n1 ZINC000447636669 1030248260 /nfs/dbraw/zinc/24/82/60/1030248260.db2.gz NGIDKBIKQLAZTE-UHFFFAOYSA-N -1 3 336.178 4.136 20 0 EIADHM CCc1cccc(C(=O)N2C[C@H](C)CSc3ccccc32)c1[O-] ZINC001143457817 1030291324 /nfs/dbraw/zinc/29/13/24/1030291324.db2.gz DGNJPVKBDSSCMY-ZDUSSCGKSA-N -1 3 327.449 4.343 20 0 EIADHM CCN(Cc1ccc(C)cc1)C(=O)CCCc1ccc([O-])c(F)c1 ZINC000530325575 1030316488 /nfs/dbraw/zinc/31/64/88/1030316488.db2.gz OHWBAKYBAHTPJT-UHFFFAOYSA-N -1 3 329.415 4.211 20 0 EIADHM Cc1cc(=O)[n-]c([C@H](C)N2CCC(=Cc3ccc(F)c(F)c3)CC2)n1 ZINC000447883241 1030394935 /nfs/dbraw/zinc/39/49/35/1030394935.db2.gz RXGQDDQJZOOKTH-ZDUSSCGKSA-N -1 3 345.393 4.009 20 0 EIADHM Cc1cnc([C@@H](C)/N=C/c2cc(Br)ccc2[O-])s1 ZINC000175894653 1030497753 /nfs/dbraw/zinc/49/77/53/1030497753.db2.gz HZOVAEUSILORMY-NEFPKRPYSA-N -1 3 325.231 4.100 20 0 EIADHM CCc1ccc(C(=O)Nc2cc3c(cc2Cl)OCCCO3)c([O-])c1 ZINC000527287523 1030610581 /nfs/dbraw/zinc/61/05/81/1030610581.db2.gz VLZDDGDFSFSWBH-UHFFFAOYSA-N -1 3 347.798 4.022 20 0 EIADHM O=C(Nc1cc(F)ccc1[O-])c1cc2c(s1)-c1ccccc1OC2 ZINC000530896411 1030787718 /nfs/dbraw/zinc/78/77/18/1030787718.db2.gz RLSWNJJTLPRXSE-UHFFFAOYSA-N -1 3 341.363 4.405 20 0 EIADHM CCCCS[C@@H](C)C(=O)Nc1cc(Br)ccc1[O-] ZINC000530917367 1030800651 /nfs/dbraw/zinc/80/06/51/1030800651.db2.gz VYEFFCVDENJURE-VIFPVBQESA-N -1 3 332.263 4.015 20 0 EIADHM O=C([O-])c1cccc(CN2CC(c3cccc(C(F)(F)F)c3)C2)c1 ZINC000263412180 1030856649 /nfs/dbraw/zinc/85/66/49/1030856649.db2.gz LUJWVRINSWRUTM-UHFFFAOYSA-N -1 3 335.325 4.003 20 0 EIADHM CCCCCn1cc(C(=O)N=c2[n-]oc(C)c2C)c2ccccc21 ZINC000452160836 1030858692 /nfs/dbraw/zinc/85/86/92/1030858692.db2.gz JFJLSAPRDQKYRI-UHFFFAOYSA-N -1 3 325.412 4.111 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2ccc(OC(C)C)cc2)cc1Cl ZINC000006416114 1030865280 /nfs/dbraw/zinc/86/52/80/1030865280.db2.gz IJKIUNKJRCCLRE-UHFFFAOYSA-N -1 3 339.844 4.236 20 0 EIADHM CCCC[C@@H](CC)CN1CCC12CN(C(=O)c1ccccc1[S-])C2 ZINC001272012767 1030895304 /nfs/dbraw/zinc/89/53/04/1030895304.db2.gz FTQFKMFHDCDAGP-MRXNPFEDSA-N -1 3 346.540 4.092 20 0 EIADHM O=C(Cc1ccc([O-])c(F)c1)N1CCC[C@H]1c1cccc(Cl)c1 ZINC000448740545 1031024842 /nfs/dbraw/zinc/02/48/42/1031024842.db2.gz VIDHHOTYMADCPV-INIZCTEOSA-N -1 3 333.790 4.091 20 0 EIADHM O=C(Nc1cc(F)ccc1[O-])c1cc(-c2ccc(Cl)cc2)on1 ZINC000531372700 1031160613 /nfs/dbraw/zinc/16/06/13/1031160613.db2.gz ZOGDFWOIAUIYHA-UHFFFAOYSA-N -1 3 332.718 4.092 20 0 EIADHM O=[S@@](Cc1ncc(-c2ccc(Cl)cc2)o1)c1ccc([O-])cc1 ZINC000108085410 1031286407 /nfs/dbraw/zinc/28/64/07/1031286407.db2.gz SKJQXIXLLIYXAJ-JOCHJYFZSA-N -1 3 333.796 4.008 20 0 EIADHM [O-]c1ccccc1-c1nc(CSc2ccnc3ccccc32)no1 ZINC000109199720 1031299445 /nfs/dbraw/zinc/29/94/45/1031299445.db2.gz JPRWBHHPZXWMQW-UHFFFAOYSA-N -1 3 335.388 4.283 20 0 EIADHM Cc1c(Br)ccc([O-])c1NC(=O)c1cccn1C(C)C ZINC000452763003 1031315860 /nfs/dbraw/zinc/31/58/60/1031315860.db2.gz YUFDYQLNKRUGQR-UHFFFAOYSA-N -1 3 337.217 4.098 20 0 EIADHM CC(C)Oc1ccc([N-]S(=O)(=O)c2ccc(F)c(Cl)c2)cc1 ZINC000614827164 1031590597 /nfs/dbraw/zinc/59/05/97/1031590597.db2.gz FIGWMBYPYJBVTL-UHFFFAOYSA-N -1 3 343.807 4.067 20 0 EIADHM CCc1ccc([O-])c(C(=O)N2CCC(=Cc3ccccc3F)CC2)c1 ZINC000531801079 1031636819 /nfs/dbraw/zinc/63/68/19/1031636819.db2.gz IXBAWQGOMUJQNM-UHFFFAOYSA-N -1 3 339.410 4.413 20 0 EIADHM [O-]c1ccc(F)c(CN[C@@H]2CCCc3c(F)cc(F)cc32)c1F ZINC000449351835 1031650734 /nfs/dbraw/zinc/65/07/34/1031650734.db2.gz RBIZRBHVIUESFX-OAHLLOKOSA-N -1 3 325.305 4.116 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2cc(-c3ncco3)ccc2C)c(C)c1 ZINC000134685838 1032009724 /nfs/dbraw/zinc/00/97/24/1032009724.db2.gz PUFYDJWCYNGRFQ-UHFFFAOYSA-N -1 3 342.420 4.068 20 0 EIADHM CSc1ccc([O-])c(C(=O)N2CCC(F)(c3ccccc3)CC2)c1 ZINC000614169982 1033558405 /nfs/dbraw/zinc/55/84/05/1033558405.db2.gz GJHYLURGTBXSFS-UHFFFAOYSA-N -1 3 345.439 4.215 20 0 EIADHM C[C@H](NCc1cccc([O-])c1Cl)c1ccc(NC(=O)C2CC2)cc1 ZINC000645146037 1033831361 /nfs/dbraw/zinc/83/13/61/1033831361.db2.gz LQSQOCWAXIQTRZ-LBPRGKRZSA-N -1 3 344.842 4.245 20 0 EIADHM Cc1ccc(Cl)c(OCC(=O)Nc2cc(Cl)ccc2[O-])c1 ZINC000614238642 1033866954 /nfs/dbraw/zinc/86/69/54/1033866954.db2.gz KOBVRQHKLSAPAY-UHFFFAOYSA-N -1 3 326.179 4.025 20 0 EIADHM Cc1ccccc1[C@]1(F)CCN(C(=O)c2cc([O-])ccc2Cl)C1 ZINC000512873620 1034111488 /nfs/dbraw/zinc/11/14/88/1034111488.db2.gz CDGKOFJRWZKWPJ-SFHVURJKSA-N -1 3 333.790 4.065 20 0 EIADHM Cc1ccc(-n2cc(NCc3c(F)ccc([O-])c3F)cn2)c(C)c1 ZINC000513107569 1034600983 /nfs/dbraw/zinc/60/09/83/1034600983.db2.gz WLQDKPLSEVFSSC-UHFFFAOYSA-N -1 3 329.350 4.085 20 0 EIADHM C[C@@H](NC(=O)c1cc([O-])ccc1Cl)c1ccc2ncsc2c1 ZINC000501360238 1035430133 /nfs/dbraw/zinc/43/01/33/1035430133.db2.gz VGDLEEHVAKLYEY-SECBINFHSA-N -1 3 332.812 4.146 20 0 EIADHM C=Cc1ccc(C(=O)Nc2n[n-]c(-c3cc4ccccc4o3)n2)cc1 ZINC000485121429 1035716625 /nfs/dbraw/zinc/71/66/25/1035716625.db2.gz JGXSMQSSJHJZRM-UHFFFAOYSA-N -1 3 330.347 4.113 20 0 EIADHM CCc1ccsc1C(=O)Nc1nnc(-c2cc3ccccc3o2)[n-]1 ZINC000485125296 1035718875 /nfs/dbraw/zinc/71/88/75/1035718875.db2.gz SPHQYHQHBAYDRS-UHFFFAOYSA-N -1 3 338.392 4.094 20 0 EIADHM CCc1ccsc1C(=O)Nc1n[n-]c(-c2cc3ccccc3o2)n1 ZINC000485125296 1035718903 /nfs/dbraw/zinc/71/89/03/1035718903.db2.gz SPHQYHQHBAYDRS-UHFFFAOYSA-N -1 3 338.392 4.094 20 0 EIADHM O=c1cc(CSCc2cc(C3CC3)no2)nc(-c2ccccc2)[n-]1 ZINC000596366778 1035870804 /nfs/dbraw/zinc/87/08/04/1035870804.db2.gz OVVUIHIUJXLUAM-UHFFFAOYSA-N -1 3 339.420 4.148 20 0 EIADHM O=c1cc(CSCc2coc(-c3cccs3)n2)nc(C2CC2)[n-]1 ZINC000571866768 1036277776 /nfs/dbraw/zinc/27/77/76/1036277776.db2.gz APYGFRSIPKMVCS-UHFFFAOYSA-N -1 3 345.449 4.210 20 0 EIADHM O=C([O-])[C@@H](c1c(F)cccc1Cl)N1CCC[C@]2(CC=CCC2)C1 ZINC000572127907 1036440607 /nfs/dbraw/zinc/44/06/07/1036440607.db2.gz ZBVJPSISMDXFEN-SJLPKXTDSA-N -1 3 337.822 4.427 20 0 EIADHM O=C(Nc1ccc2c3c(cccc31)CC2)c1c[n-]c2ccccc2c1=O ZINC000588850279 1036553362 /nfs/dbraw/zinc/55/33/62/1036553362.db2.gz QWXVGZXQYWNPNF-UHFFFAOYSA-N -1 3 340.382 4.032 20 0 EIADHM CCS[C@H]1CC[C@@H](N(C)C(=O)c2cc([O-])cc(C(F)(F)F)c2)C1 ZINC000598691307 1036753586 /nfs/dbraw/zinc/75/35/86/1036753586.db2.gz UHVVCASSOQZPRO-OCCSQVGLSA-N -1 3 347.402 4.157 20 0 EIADHM CC(C)(C)OC(=O)c1ccc(CNCc2cccc([O-])c2Cl)cc1 ZINC000590186848 1037006410 /nfs/dbraw/zinc/00/64/10/1037006410.db2.gz KCHACNQWDZOCCN-UHFFFAOYSA-N -1 3 347.842 4.291 20 0 EIADHM C[C@H]([N-]S(=O)(=O)c1ccc(Cl)s1)C(C)(C)c1ccccc1 ZINC000590299075 1037035988 /nfs/dbraw/zinc/03/59/88/1037035988.db2.gz CNDWSJHVVVQERZ-NSHDSACASA-N -1 3 343.901 4.046 20 0 EIADHM CC(C)(C)n1nc(C(=O)Nc2cc(Cl)ccc2[O-])cc1C1CC1 ZINC000067145655 1037187972 /nfs/dbraw/zinc/18/79/72/1037187972.db2.gz ZJMJSDSIZAPVJB-UHFFFAOYSA-N -1 3 333.819 4.127 20 0 EIADHM Cn1c2ccccc2c(Cl)c1C(=O)Nc1c([O-])cccc1Cl ZINC000573047598 1037244088 /nfs/dbraw/zinc/24/40/88/1037244088.db2.gz SSTJUYLYDMQUQM-UHFFFAOYSA-N -1 3 335.190 4.443 20 0 EIADHM Cc1ccc(Sc2nc3c(cnn3-c3ccccc3)c(=O)[n-]2)cc1C ZINC000605432586 1037785195 /nfs/dbraw/zinc/78/51/95/1037785195.db2.gz AWGSKZFNTIPLMN-UHFFFAOYSA-N -1 3 348.431 4.289 20 0 EIADHM CSc1cc(O)ccc1[N-]C(=O)c1cc(-c2ccccc2)on1 ZINC000489090802 1037862434 /nfs/dbraw/zinc/86/24/34/1037862434.db2.gz LINLMVLWJXGSFP-UHFFFAOYSA-N -1 3 326.377 4.021 20 0 EIADHM CC(C)COc1ccccc1CN[C@@H](CC(=O)[O-])c1cccs1 ZINC000669472643 1037942060 /nfs/dbraw/zinc/94/20/60/1037942060.db2.gz HYHGYKGJJLKOAW-HNNXBMFYSA-N -1 3 333.453 4.089 20 0 EIADHM CC(C)c1ccc([C@@H](C)CC(=O)Nc2n[n-]c(-c3ccco3)n2)cc1 ZINC000606365250 1038037252 /nfs/dbraw/zinc/03/72/52/1038037252.db2.gz WDOGSBWRWSRXPP-ZDUSSCGKSA-N -1 3 338.411 4.320 20 0 EIADHM CCCCn1ncc([N-]S(=O)(=O)[C@H](CC)CCC)c1C(C)C ZINC000574280067 1038051824 /nfs/dbraw/zinc/05/18/24/1038051824.db2.gz BUJHTLJXWJFMBZ-CQSZACIVSA-N -1 3 329.510 4.127 20 0 EIADHM COc1cc(F)c([N-]C(=O)c2c(F)ccc(F)c2Cl)cc1F ZINC001127212143 1038104367 /nfs/dbraw/zinc/10/43/67/1038104367.db2.gz DRSWCSALPHLQBJ-UHFFFAOYSA-N -1 3 333.668 4.157 20 0 EIADHM C[C@@H](CC1CCCCC1)NC(=O)c1cc([O-])cc(Br)c1 ZINC000700844058 1038151017 /nfs/dbraw/zinc/15/10/17/1038151017.db2.gz BFXGPFVNTKPBLM-NSHDSACASA-N -1 3 340.261 4.243 20 0 EIADHM Cc1ccc(C(C)C)c(O[C@H](C)C(=O)NCc2ccc([O-])c(F)c2)c1 ZINC000606536675 1038155038 /nfs/dbraw/zinc/15/50/38/1038155038.db2.gz PNCHGZQQTBNLAR-CQSZACIVSA-N -1 3 345.414 4.047 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)N[C@H](c1ccccc1)C1CCCC1 ZINC000606646964 1038206291 /nfs/dbraw/zinc/20/62/91/1038206291.db2.gz DTBMDVUIIRACGZ-LJQANCHMSA-N -1 3 342.414 4.262 20 0 EIADHM Cc1ccc([C@@H](C)N(C)C(=O)NCc2ccc([O-])c(F)c2)c(C)c1 ZINC000606715022 1038229603 /nfs/dbraw/zinc/22/96/03/1038229603.db2.gz NJIAKBFFHRNBPP-CQSZACIVSA-N -1 3 330.403 4.051 20 0 EIADHM Cc1oc([C@H](C)N(C)CCOc2ccc(Cl)cc2)cc1C(=O)[O-] ZINC000515659943 1038231773 /nfs/dbraw/zinc/23/17/73/1038231773.db2.gz FSTNXHPPVNDOKW-NSHDSACASA-N -1 3 337.803 4.011 20 0 EIADHM Cc1cc([C@H](C)N2CC[C@@H](c3c(F)cccc3F)C2)oc1C(=O)[O-] ZINC000574524878 1038288653 /nfs/dbraw/zinc/28/86/53/1038288653.db2.gz KDLIARKEFABJAP-NWDGAFQWSA-N -1 3 335.350 4.115 20 0 EIADHM O=C(N[C@H]1CC[C@H](Cc2ccccc2)C1)c1cc([O-])ccc1Cl ZINC000504601828 1038426941 /nfs/dbraw/zinc/42/69/41/1038426941.db2.gz PZKWAUZOMUOCIB-CABCVRRESA-N -1 3 329.827 4.187 20 0 EIADHM O=C([N-]c1cc([N+](=O)[O-])ccc1F)c1ccc(-c2ccccc2)o1 ZINC000059337232 1038434485 /nfs/dbraw/zinc/43/44/85/1038434485.db2.gz FUAOIVKKPVFGGE-UHFFFAOYSA-N -1 3 326.283 4.246 20 0 EIADHM CC[C@H](c1ccncc1)N(CC)C(=O)c1cc(SC)ccc1[O-] ZINC000669052219 1038470139 /nfs/dbraw/zinc/47/01/39/1038470139.db2.gz BQYOZFOWORMJKS-MRXNPFEDSA-N -1 3 330.453 4.123 20 0 EIADHM O=C([O-])CC[C@H]1CCCCN1Cc1ccc(F)cc1C(F)(F)F ZINC000322707456 1038826058 /nfs/dbraw/zinc/82/60/58/1038826058.db2.gz PZAMCIUPNAUKGZ-CYBMUJFWSA-N -1 3 333.325 4.064 20 0 EIADHM Cc1cc2cc([N-]S(=O)(=O)c3ccc(OC(C)C)cc3)ccc2[nH]1 ZINC000539112631 1038843521 /nfs/dbraw/zinc/84/35/21/1038843521.db2.gz NHIVUBNBSDYLIN-UHFFFAOYSA-N -1 3 344.436 4.064 20 0 EIADHM CC(=O)c1cccc(NC(=O)Cc2ccc(-c3ccccc3)cc2)c1[O-] ZINC000552069362 1039094456 /nfs/dbraw/zinc/09/44/56/1039094456.db2.gz PCDQODTURMZCAS-UHFFFAOYSA-N -1 3 345.398 4.443 20 0 EIADHM CC(=O)c1cccc(NC(=O)Cc2ccc(Cl)c(Cl)c2)c1[O-] ZINC000552069412 1039096346 /nfs/dbraw/zinc/09/63/46/1039096346.db2.gz QUVFKRSNSMWRNM-UHFFFAOYSA-N -1 3 338.190 4.083 20 0 EIADHM CC(=O)c1cccc(NC(=O)[C@H](Sc2ccccc2)C(C)C)c1[O-] ZINC000552069379 1039096731 /nfs/dbraw/zinc/09/67/31/1039096731.db2.gz PQGNILVLPVYOST-GOSISDBHSA-N -1 3 343.448 4.350 20 0 EIADHM O=C([N-]C1CCC(C(F)(F)F)CC1)C(F)(F)c1ccc(F)cc1 ZINC000150084533 1039337440 /nfs/dbraw/zinc/33/74/40/1039337440.db2.gz NPRVXOJAIUFMMP-UHFFFAOYSA-N -1 3 339.279 4.155 20 0 EIADHM CC(=O)c1cccc(NC(=O)c2ccc3ccc(Cl)cc3n2)c1[O-] ZINC000552287242 1039340949 /nfs/dbraw/zinc/34/09/49/1039340949.db2.gz MCQRGUFYNGCALK-UHFFFAOYSA-N -1 3 340.766 4.049 20 0 EIADHM C[C@@H](Sc1cc(Cl)ccc1Cl)C(=O)Nc1ncccc1[O-] ZINC000059363164 1039351582 /nfs/dbraw/zinc/35/15/82/1039351582.db2.gz HCURXKMUOLWNQW-MRVPVSSYSA-N -1 3 343.235 4.213 20 0 EIADHM Cc1c(C(=O)Nc2c([O-])cccc2Cl)[nH]c2c1C(=O)CC(C)(C)C2 ZINC000552432613 1039510540 /nfs/dbraw/zinc/51/05/40/1039510540.db2.gz SJLBHLRCBJLBHB-UHFFFAOYSA-N -1 3 346.814 4.090 20 0 EIADHM O=C(COc1cc(Cl)cc(Cl)c1)Nc1c([O-])cccc1Cl ZINC000552435524 1039514788 /nfs/dbraw/zinc/51/47/88/1039514788.db2.gz LBGBSMDMHLMIFX-UHFFFAOYSA-N -1 3 346.597 4.370 20 0 EIADHM Cc1ccc(CN(Cc2ccco2)Cc2nc(C)ccc2[O-])s1 ZINC000092536758 1039560638 /nfs/dbraw/zinc/56/06/38/1039560638.db2.gz GWCLNHJBSVEGNG-UHFFFAOYSA-N -1 3 328.437 4.261 20 0 EIADHM O=C(Cc1ccccc1C(F)(F)F)Nc1c([O-])cccc1Cl ZINC000552781554 1039817199 /nfs/dbraw/zinc/81/71/99/1039817199.db2.gz LIOWZWBPVRZKKZ-UHFFFAOYSA-N -1 3 329.705 4.246 20 0 EIADHM CCc1cccc(C(=O)N(C)[C@H](C)c2nc3ccccc3s2)c1[O-] ZINC000537650940 1039842662 /nfs/dbraw/zinc/84/26/62/1039842662.db2.gz DKBDTQVTOLWHHD-GFCCVEGCSA-N -1 3 340.448 4.398 20 0 EIADHM O=C(Nc1ccc(CC(F)(F)F)cc1)c1cc([O-])ccc1Cl ZINC000551061805 1039933788 /nfs/dbraw/zinc/93/37/88/1039933788.db2.gz BKYVAMJTGSTQDC-UHFFFAOYSA-N -1 3 329.705 4.403 20 0 EIADHM CCC(C)(C)c1ccc(CSc2nc3nncc-3c(O)[n-]2)cc1 ZINC000505631559 1040196644 /nfs/dbraw/zinc/19/66/44/1040196644.db2.gz DADWNJRXNSFTMG-UHFFFAOYSA-N -1 3 328.441 4.038 20 0 EIADHM [O-]c1cccc(CN[C@H]2CCCc3ccccc32)c1Br ZINC000315011371 1040234726 /nfs/dbraw/zinc/23/47/26/1040234726.db2.gz KGTUJDOLBYJMBH-HNNXBMFYSA-N -1 3 332.241 4.322 20 0 EIADHM CCCc1cc(=O)[n-]c(C(=Cc2cc(C)c(OC)c(C)c2)CC)n1 ZINC000435336117 1040291006 /nfs/dbraw/zinc/29/10/06/1040291006.db2.gz NAOSGQROBJAPMM-WJDWOHSUSA-N -1 3 326.440 4.298 20 0 EIADHM CC[C@H](CC(F)F)C(=O)Nc1c(C)c(Br)ccc1[O-] ZINC000457840605 1040307920 /nfs/dbraw/zinc/30/79/20/1040307920.db2.gz HLZAZSUYNJQGBD-MRVPVSSYSA-N -1 3 336.176 4.083 20 0 EIADHM O=C(c1cc([O-])ccc1Cl)N1CC(Cc2ccccc2Cl)C1 ZINC000551545538 1040398735 /nfs/dbraw/zinc/39/87/35/1040398735.db2.gz WOGCRIPTFIOXAO-UHFFFAOYSA-N -1 3 336.218 4.014 20 0 EIADHM COc1cc(C)c([N-]S(=O)(=O)c2ccc(C)c(Cl)c2)cc1C ZINC000435733911 1040587061 /nfs/dbraw/zinc/58/70/61/1040587061.db2.gz VJWRKAGOTOCCFX-UHFFFAOYSA-N -1 3 339.844 4.075 20 0 EIADHM C[C@H](c1ccco1)N(CCOc1ccc(C(=O)[O-])cc1Cl)C1CC1 ZINC000567173102 1040848012 /nfs/dbraw/zinc/84/80/12/1040848012.db2.gz MSFFNHLCPRDLKN-GFCCVEGCSA-N -1 3 349.814 4.236 20 0 EIADHM CCCOc1ccc(S(=O)(=O)[N-]c2ccc(OC(C)C)cc2)cc1 ZINC000515632520 1040912215 /nfs/dbraw/zinc/91/22/15/1040912215.db2.gz VCEMOIHOUOJKOW-UHFFFAOYSA-N -1 3 349.452 4.063 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@H](C)C3CCC(F)CC3)nc2)n1 ZINC000664538278 1041009694 /nfs/dbraw/zinc/00/96/94/1041009694.db2.gz BJTJRGXMAKOEFD-DNOWBOINSA-N -1 3 344.434 4.135 20 0 EIADHM CCOC(=O)c1ccc(NC(=O)c2ccc3sccc3c2)c([O-])c1 ZINC000540028796 1041043576 /nfs/dbraw/zinc/04/35/76/1041043576.db2.gz PRHJZVNQVRCHMT-UHFFFAOYSA-N -1 3 341.388 4.036 20 0 EIADHM CCC(CC)CN(CC)Cc1cc(C(=O)[O-])ccc1Br ZINC000903886757 1041224934 /nfs/dbraw/zinc/22/49/34/1041224934.db2.gz IBEDSPAHLLKRIS-UHFFFAOYSA-N -1 3 342.277 4.405 20 0 EIADHM Cc1cnc2c(cccc2S(=O)(=O)[N-]c2c(C)cccc2Cl)c1 ZINC000461114985 1041246893 /nfs/dbraw/zinc/24/68/93/1041246893.db2.gz VLYRTTILBKBXJH-UHFFFAOYSA-N -1 3 346.839 4.306 20 0 EIADHM CCc1nc(CNC/C(C)=C/c2ccc(Cl)cc2)ccc1C(=O)[O-] ZINC000903996303 1041254470 /nfs/dbraw/zinc/25/44/70/1041254470.db2.gz CJPAVXQZXSLWHH-JLHYYAGUSA-N -1 3 344.842 4.189 20 0 EIADHM Cc1cc(F)c(CN[C@H](CCc2ccccc2)CC(=O)[O-])c(Cl)c1 ZINC000904040791 1041294868 /nfs/dbraw/zinc/29/48/68/1041294868.db2.gz VCGTWVGZFFEVAZ-OAHLLOKOSA-N -1 3 349.833 4.353 20 0 EIADHM COc1cc(CN[C@H](CC(=O)[O-])c2cccc(C)c2)ccc1SC ZINC000904046203 1041301585 /nfs/dbraw/zinc/30/15/85/1041301585.db2.gz XGLWEMHVUGVTCF-MRXNPFEDSA-N -1 3 345.464 4.031 20 0 EIADHM Cc1nc2c(cccc2-c2noc(-c3ccc(C(C)C)cc3[O-])n2)[nH]1 ZINC000436520911 1041302850 /nfs/dbraw/zinc/30/28/50/1041302850.db2.gz JUAICLZABPCATG-UHFFFAOYSA-N -1 3 334.379 4.417 20 0 EIADHM CSCC[C@@H](C)N(C)C(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436532749 1041314847 /nfs/dbraw/zinc/31/48/47/1041314847.db2.gz WUAYKXGOBQOXTQ-OAHLLOKOSA-N -1 3 343.492 4.197 20 0 EIADHM COc1ccc(C(=O)N(Cc2ccc3ccccc3c2)C2CC2)c([O-])c1 ZINC000436546339 1041322421 /nfs/dbraw/zinc/32/24/21/1041322421.db2.gz ODGCKBPIIHHNLK-UHFFFAOYSA-N -1 3 347.414 4.359 20 0 EIADHM COc1ccc(C(=O)N(Cc2cccc(F)c2)C2CCCC2)c([O-])c1 ZINC000436556358 1041328821 /nfs/dbraw/zinc/32/88/21/1041328821.db2.gz RXLIWYMPWDJORB-UHFFFAOYSA-N -1 3 343.398 4.125 20 0 EIADHM Oc1[n-]c(SCc2ccc(C3CCCC3)cc2)nc2nncc1-2 ZINC000554699846 1041339827 /nfs/dbraw/zinc/33/98/27/1041339827.db2.gz QVGZEZQOJMXJHZ-UHFFFAOYSA-N -1 3 326.425 4.008 20 0 EIADHM COc1cc(-c2nc([C@H]3CCCC(C)(C)C3)no2)cc(OC)c1[O-] ZINC000436561768 1041344746 /nfs/dbraw/zinc/34/47/46/1041344746.db2.gz CQOFMFZMFJEZFZ-NSHDSACASA-N -1 3 332.400 4.143 20 0 EIADHM Cc1ccc(CCN(Cc2ccco2)C(=O)c2ccccc2[O-])cc1 ZINC000436572012 1041348446 /nfs/dbraw/zinc/34/84/46/1041348446.db2.gz FCZFTAWTAPBJLD-UHFFFAOYSA-N -1 3 335.403 4.179 20 0 EIADHM Cc1csc([C@@H](NC(=O)c2ccc(C(C)C)cc2[O-])C2CC2)n1 ZINC000436580638 1041356690 /nfs/dbraw/zinc/35/66/90/1041356690.db2.gz CIHGYIHPLQSCEB-INIZCTEOSA-N -1 3 330.453 4.162 20 0 EIADHM CC(C)c1ccc(C(=O)N(Cc2cccc(O)c2)CC2CC2)c([O-])c1 ZINC000436583745 1041360790 /nfs/dbraw/zinc/36/07/90/1041360790.db2.gz KXQXOBRNMKFQOU-UHFFFAOYSA-N -1 3 339.435 4.274 20 0 EIADHM COc1ccc(C(=O)N2CCCC[C@@H]2c2ccc(C)cc2)c([O-])c1 ZINC000436581471 1041360927 /nfs/dbraw/zinc/36/09/27/1041360927.db2.gz FOQONRNMRZWUAJ-GOSISDBHSA-N -1 3 325.408 4.077 20 0 EIADHM CCc1ccc([C@H]2CCCCN2CCOc2ccccc2C(=O)[O-])o1 ZINC000516076655 1041379814 /nfs/dbraw/zinc/37/98/14/1041379814.db2.gz UXXYIPMCPSNEMQ-QGZVFWFLSA-N -1 3 343.423 4.146 20 0 EIADHM CC(C)c1ccc(C(=O)N(C)Cc2ccc(OC(F)F)cc2)c([O-])c1 ZINC000436637272 1041385278 /nfs/dbraw/zinc/38/52/78/1041385278.db2.gz VEBXBVIHNGOHMN-UHFFFAOYSA-N -1 3 349.377 4.389 20 0 EIADHM CCN(CCOc1ccccc1C)[C@H](C)c1cc(C)c(C(=O)[O-])o1 ZINC000516091842 1041400240 /nfs/dbraw/zinc/40/02/40/1041400240.db2.gz VMQZRYRJLOXZBR-OAHLLOKOSA-N -1 3 331.412 4.057 20 0 EIADHM CCc1ccc([C@@H]2CCCCCN2C(=O)c2ccc(O)cc2[O-])o1 ZINC000436668993 1041407770 /nfs/dbraw/zinc/40/77/70/1041407770.db2.gz GTBZDKHTVVSBHY-INIZCTEOSA-N -1 3 329.396 4.011 20 0 EIADHM CSc1ccc(NC(=O)c2ccc(C(C)=O)c([O-])c2)cc1Cl ZINC000436658898 1041413675 /nfs/dbraw/zinc/41/36/75/1041413675.db2.gz WCNBKASMUUDDBL-UHFFFAOYSA-N -1 3 335.812 4.222 20 0 EIADHM CCCC[C@@H](C)N(CCCC)C(=O)c1cc(OC)c([O-])c(OC)c1 ZINC000436709394 1041428080 /nfs/dbraw/zinc/42/80/80/1041428080.db2.gz MXWDRCQPQNWNFR-CQSZACIVSA-N -1 3 337.460 4.230 20 0 EIADHM CCc1ccc(C(=O)N2CCn3cccc3[C@@H]2c2ccccc2)c([O-])c1 ZINC000436809461 1041491051 /nfs/dbraw/zinc/49/10/51/1041491051.db2.gz SULBOJULUTVOBL-NRFANRHFSA-N -1 3 346.430 4.002 20 0 EIADHM CCc1ccc(C(=O)N2CCC(=Cc3cccc(F)c3)CC2)c([O-])c1 ZINC000436814641 1041492670 /nfs/dbraw/zinc/49/26/70/1041492670.db2.gz INLOSJIUJASGMT-UHFFFAOYSA-N -1 3 339.410 4.413 20 0 EIADHM CCc1ccc(C(=O)N2CC[C@H](CSc3ccccc3)C2)c([O-])c1 ZINC000436835091 1041497656 /nfs/dbraw/zinc/49/76/56/1041497656.db2.gz UDHUUDJJBFLEOI-INIZCTEOSA-N -1 3 341.476 4.209 20 0 EIADHM CC1(c2ccc(Cl)cc2)CCN(C(=O)c2ccccc2[O-])CC1 ZINC000436832707 1041497899 /nfs/dbraw/zinc/49/78/99/1041497899.db2.gz JXPIXMGBZGNJHP-UHFFFAOYSA-N -1 3 329.827 4.240 20 0 EIADHM CCc1ccc(C(=O)N(CC)[C@@H](C)c2cccc(OC)c2)c([O-])c1 ZINC000436820842 1041500961 /nfs/dbraw/zinc/50/09/61/1041500961.db2.gz SUNAJOIUDCGZDH-AWEZNQCLSA-N -1 3 327.424 4.187 20 0 EIADHM CC(C)c1ccc(C(=O)N2CC[C@H](c3c(F)cccc3F)C2)c([O-])c1 ZINC000436822362 1041502433 /nfs/dbraw/zinc/50/24/33/1041502433.db2.gz UBMKWKOKQIHBCG-AWEZNQCLSA-N -1 3 345.389 4.424 20 0 EIADHM Cc1cccc(C(=O)Nc2ccccc2O[C@H](C)C(F)(F)F)c1[O-] ZINC000436843680 1041511052 /nfs/dbraw/zinc/51/10/52/1041511052.db2.gz JTMOEHLPOYJDLH-LLVKDONJSA-N -1 3 339.313 4.283 20 0 EIADHM CCc1cccc(C(=O)N(CC)[C@H](C)c2cccc(OC)c2)c1[O-] ZINC000538756870 1041530986 /nfs/dbraw/zinc/53/09/86/1041530986.db2.gz FKDWHUZUYQIXMZ-CQSZACIVSA-N -1 3 327.424 4.187 20 0 EIADHM CC(C)(c1ccc(NC(=O)c2c([O-])cccc2O)cc1)C(F)(F)F ZINC000436886599 1041542460 /nfs/dbraw/zinc/54/24/60/1041542460.db2.gz SXNDUOIYHMUMJW-UHFFFAOYSA-N -1 3 339.313 4.190 20 0 EIADHM COc1cccc(C(=O)Nc2ccccc2-c2csc(C)n2)c1[O-] ZINC000436905273 1041546485 /nfs/dbraw/zinc/54/64/85/1041546485.db2.gz HNELBAXZGQOZHV-UHFFFAOYSA-N -1 3 340.404 4.085 20 0 EIADHM COc1ccc([O-])c(-c2nc(-c3ccccc3OCC(C)C)no2)c1 ZINC000436907111 1041547556 /nfs/dbraw/zinc/54/75/56/1041547556.db2.gz DJJXJHVCWMVRQY-UHFFFAOYSA-N -1 3 340.379 4.153 20 0 EIADHM COc1ccc([O-])c(-c2nc(-c3ccc(C(F)(F)F)cc3)no2)c1 ZINC000436895525 1041551177 /nfs/dbraw/zinc/55/11/77/1041551177.db2.gz XETAUVUFSZWMIL-UHFFFAOYSA-N -1 3 336.269 4.137 20 0 EIADHM O=C(Nc1ccsc1)c1cc(OCc2ccccc2)ccc1[O-] ZINC000436899509 1041553271 /nfs/dbraw/zinc/55/32/71/1041553271.db2.gz KIFSXSUDGAADMD-UHFFFAOYSA-N -1 3 325.389 4.285 20 0 EIADHM COc1ccc([O-])c(-c2nc(-c3ccc(OC(C)(C)C)cc3)no2)c1 ZINC000436901710 1041553816 /nfs/dbraw/zinc/55/38/16/1041553816.db2.gz NCLBCGJWBRPDKK-UHFFFAOYSA-N -1 3 340.379 4.295 20 0 EIADHM O=C([O-])CCC1CCN(Cc2cc(-c3ccc(Cl)cc3)no2)CC1 ZINC000538857880 1041557827 /nfs/dbraw/zinc/55/78/27/1041557827.db2.gz QKHHKAONYVNQLH-UHFFFAOYSA-N -1 3 348.830 4.072 20 0 EIADHM COc1cccc(-c2nc(-c3ccc(C(C)(F)F)cc3)no2)c1[O-] ZINC000436957407 1041574661 /nfs/dbraw/zinc/57/46/61/1041574661.db2.gz XPFKASMALYNZRN-UHFFFAOYSA-N -1 3 332.306 4.230 20 0 EIADHM C[C@@H]1C[C@@H](C)CN(C(=O)c2cc(Oc3ccccc3)ccc2[O-])C1 ZINC000436953455 1041574728 /nfs/dbraw/zinc/57/47/28/1041574728.db2.gz POMGSFSTXOFEEH-HUUCEWRRSA-N -1 3 325.408 4.303 20 0 EIADHM Cc1ccc(C(=O)N(C)Cc2ccc(Br)cc2C)c([O-])c1 ZINC000437005240 1041589479 /nfs/dbraw/zinc/58/94/79/1041589479.db2.gz SPPRXSOHQMZWEF-UHFFFAOYSA-N -1 3 348.240 4.044 20 0 EIADHM CSc1ccc(S(=O)(=O)[N-]c2cc(C)ccc2F)cc1Cl ZINC000463521539 1041613602 /nfs/dbraw/zinc/61/36/02/1041613602.db2.gz YIDXXASDSPHLNU-UHFFFAOYSA-N -1 3 345.848 4.310 20 0 EIADHM CC[C@@H](Sc1ccccc1)C(=O)Nc1cccc(C(C)=O)c1[O-] ZINC000516888871 1041797941 /nfs/dbraw/zinc/79/79/41/1041797941.db2.gz KVPXRKCBAOHXBW-MRXNPFEDSA-N -1 3 329.421 4.104 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)c1ccc(Cl)c(C(F)(F)F)c1 ZINC000438195230 1042084552 /nfs/dbraw/zinc/08/45/52/1042084552.db2.gz BEYLQFKCYZJUCZ-UHFFFAOYSA-N -1 3 347.695 4.134 20 0 EIADHM Cc1onc(-c2ccccc2)c1C(=O)Nc1cc(Cl)ccc1[O-] ZINC000518050386 1042323150 /nfs/dbraw/zinc/32/31/50/1042323150.db2.gz HZPNRJXDCTYHMF-UHFFFAOYSA-N -1 3 328.755 4.261 20 0 EIADHM CN(Cc1cccc(F)c1)C(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000303151905 1042328300 /nfs/dbraw/zinc/32/83/00/1042328300.db2.gz RQXBMSSMDILGHW-UHFFFAOYSA-N -1 3 349.405 4.394 20 0 EIADHM CC[C@H](O[C@@H]1CCC[C@H](C)C1)C(=O)Nc1cc(Cl)ccc1[O-] ZINC000439097176 1042492134 /nfs/dbraw/zinc/49/21/34/1042492134.db2.gz LWYFQXWOBNQDAY-GHJWDPDVSA-N -1 3 325.836 4.358 20 0 EIADHM CCc1ccc(-c2ccc(C(=O)NCc3ccc([O-])c(F)c3)o2)cc1 ZINC000439531833 1042675839 /nfs/dbraw/zinc/67/58/39/1042675839.db2.gz VZBUUHQKHBXBIB-UHFFFAOYSA-N -1 3 339.366 4.284 20 0 EIADHM [O-]c1cccc(CNCc2cccc(Cl)c2)c1Br ZINC000315518106 1042833448 /nfs/dbraw/zinc/83/34/48/1042833448.db2.gz FPGGAWFVXZMPKH-UHFFFAOYSA-N -1 3 326.621 4.098 20 0 EIADHM CC(C)c1cnc(CNCCC[C@@H](Cc2ccccc2)C(=O)[O-])s1 ZINC000417554439 1042872146 /nfs/dbraw/zinc/87/21/46/1042872146.db2.gz JJLLIFCJYBPAGL-INIZCTEOSA-N -1 3 346.496 4.080 20 0 EIADHM COc1ccc(CN[C@H](CCC(=O)[O-])c2ccccc2)c(Cl)c1 ZINC000417604128 1042899240 /nfs/dbraw/zinc/89/92/40/1042899240.db2.gz UAAPYLORYQQHMJ-QGZVFWFLSA-N -1 3 333.815 4.044 20 0 EIADHM CCc1c(C(=O)Nc2ccc(Cl)cc2[O-])cnn1CCC(C)C ZINC000427692415 1043161942 /nfs/dbraw/zinc/16/19/42/1043161942.db2.gz BTRJHZFFBOWBLW-UHFFFAOYSA-N -1 3 335.835 4.103 20 0 EIADHM C[C@H]1CN(Cc2nc3c4ccccc4oc3c(=O)[n-]2)Cc2ccccc21 ZINC000727240245 1043174080 /nfs/dbraw/zinc/17/40/80/1043174080.db2.gz HNQHNSKORSPVTE-ZDUSSCGKSA-N -1 3 345.402 4.201 20 0 EIADHM C[C@@H](NC(=O)c1cc([O-])c2ccccc2c1)c1ccc(Cl)cn1 ZINC000525937510 1043236080 /nfs/dbraw/zinc/23/60/80/1043236080.db2.gz RWKACHCIVUULGV-LLVKDONJSA-N -1 3 326.783 4.085 20 0 EIADHM Cn1nc(CC(C)(C)C)cc1NC(=O)c1cc([O-])c2ccccc2c1 ZINC000526874140 1043243241 /nfs/dbraw/zinc/24/32/41/1043243241.db2.gz AMOCYCTYWAZKML-UHFFFAOYSA-N -1 3 337.423 4.120 20 0 EIADHM CCOc1cccc([C@H]2C[C@H]2NC(=O)c2cc([O-])c3ccccc3c2)c1 ZINC000526921005 1043244959 /nfs/dbraw/zinc/24/49/59/1043244959.db2.gz FBLWHMWYOLGJOH-WOJBJXKFSA-N -1 3 347.414 4.230 20 0 EIADHM O=C(NCCOc1ccccc1Cl)c1cc([O-])c2ccccc2c1 ZINC000526919061 1043245134 /nfs/dbraw/zinc/24/51/34/1043245134.db2.gz OPIKIZHDQBSPPH-UHFFFAOYSA-N -1 3 341.794 4.008 20 0 EIADHM O=C(N[C@@H]1CCO[C@H](c2ccccc2)C1)c1cc([O-])c2ccccc2c1 ZINC000526924227 1043245611 /nfs/dbraw/zinc/24/56/11/1043245611.db2.gz CMVQPHPTKPPJOI-NQIIRXRSSA-N -1 3 347.414 4.196 20 0 EIADHM CO[C@H]1CCOc2c(NC(=O)c3cc([O-])c4ccccc4c3)cccc21 ZINC000526934884 1043246689 /nfs/dbraw/zinc/24/66/89/1043246689.db2.gz MCSIWIYTPCQGNZ-IBGZPJMESA-N -1 3 349.386 4.268 20 0 EIADHM O=C(NCCc1cccc2cccnc21)c1cc([O-])c2ccccc2c1 ZINC000527165930 1043250899 /nfs/dbraw/zinc/25/08/99/1043250899.db2.gz JMCRTKPKHFQHEN-UHFFFAOYSA-N -1 3 342.398 4.066 20 0 EIADHM CSc1ccc(F)cc1CNC(=O)c1cc([O-])c2ccccc2c1 ZINC000527176982 1043252886 /nfs/dbraw/zinc/25/28/86/1043252886.db2.gz ZMUGQTYGEBSAIY-UHFFFAOYSA-N -1 3 341.407 4.336 20 0 EIADHM CC[C@H](C)N(Cc1ccccc1)C(=O)NCc1ccc([O-])c(F)c1 ZINC000163675929 1043257973 /nfs/dbraw/zinc/25/79/73/1043257973.db2.gz NKDVSFUAIFPZMC-AWEZNQCLSA-N -1 3 330.403 4.042 20 0 EIADHM C[C@@H]1CO[C@H](c2ccccc2)CN1C(=O)c1cc([O-])c2ccccc2c1 ZINC000527449293 1043260385 /nfs/dbraw/zinc/26/03/85/1043260385.db2.gz XXDORCKWLWIVIH-VFNWGFHPSA-N -1 3 347.414 4.148 20 0 EIADHM O=C(Nc1cc(F)ccc1[O-])c1ccc(Cl)cc1C(F)(F)F ZINC000186259698 1043261076 /nfs/dbraw/zinc/26/10/76/1043261076.db2.gz AOEXRMWDOQLIQH-UHFFFAOYSA-N -1 3 333.668 4.456 20 0 EIADHM C[C@H](CCCC(F)(F)F)NC(=O)CCCc1ccc([O-])c(F)c1 ZINC000427967968 1043279756 /nfs/dbraw/zinc/27/97/56/1043279756.db2.gz VVQXVPARTCSZTA-LLVKDONJSA-N -1 3 335.341 4.091 20 0 EIADHM O=C([N-][C@@H](c1ccco1)c1ccccc1)C(F)(F)c1ccccc1F ZINC000766058157 1043369495 /nfs/dbraw/zinc/36/94/95/1043369495.db2.gz CJBSDUZJZVJETR-QGZVFWFLSA-N -1 3 345.320 4.416 20 0 EIADHM Cc1cc(S(=O)(=O)[N-][C@H](C)CCCC(F)(F)F)sc1Cl ZINC000494366760 1043436062 /nfs/dbraw/zinc/43/60/62/1043436062.db2.gz IXTJBDVJWVONFM-MRVPVSSYSA-N -1 3 349.827 4.109 20 0 EIADHM O=C([N-]c1c(F)cccc1F)c1cnc(Cc2ccc(F)cc2)s1 ZINC000171252343 1043518086 /nfs/dbraw/zinc/51/80/86/1043518086.db2.gz YMJPSVMBVZDYBI-UHFFFAOYSA-N -1 3 348.349 4.404 20 0 EIADHM CCC(CC)c1nnc([N-]C(=O)c2cc3nc(C)ccc3o2)s1 ZINC000171519384 1043598913 /nfs/dbraw/zinc/59/89/13/1043598913.db2.gz LPGQBUDSNZAUDA-UHFFFAOYSA-N -1 3 330.413 4.144 20 0 EIADHM Cc1cc(C)c([N-]S(=O)(=O)c2ccc(F)cc2F)c(Cl)c1 ZINC000244252349 1043689624 /nfs/dbraw/zinc/68/96/24/1043689624.db2.gz WHUVDFPXPIEFAV-UHFFFAOYSA-N -1 3 331.771 4.036 20 0 EIADHM COc1ccc2nc(C)c(C(=O)Nc3cc(Cl)ccc3[O-])cc2c1 ZINC000731456819 1043761565 /nfs/dbraw/zinc/76/15/65/1043761565.db2.gz HNNFEQARKPSEJS-UHFFFAOYSA-N -1 3 342.782 4.163 20 0 EIADHM O=c1[n-]c(Sc2nc(-c3ccc(F)cc3)c[nH]2)nc2ccccc12 ZINC000731918754 1043844965 /nfs/dbraw/zinc/84/49/65/1043844965.db2.gz WEMRUOVMAMVMGY-UHFFFAOYSA-N -1 3 338.367 4.016 20 0 EIADHM Cc1cccc(-c2cnc([N-]C(=O)c3ocnc3C(F)F)s2)c1 ZINC001128818550 1043866211 /nfs/dbraw/zinc/86/62/11/1043866211.db2.gz HBBSDXOYNXCHEH-UHFFFAOYSA-N -1 3 335.335 4.296 20 0 EIADHM Cc1nc2c(s1)[C@H](N(C)Cc1cc(C(=O)[O-])sc1C)CCC2 ZINC000522007582 1044152413 /nfs/dbraw/zinc/15/24/13/1044152413.db2.gz GCGITVREPYPXRG-CYBMUJFWSA-N -1 3 336.482 4.029 20 0 EIADHM Cc1cc(CN2CCC(CCc3ccccc3)CC2)oc1C(=O)[O-] ZINC000522007382 1044154611 /nfs/dbraw/zinc/15/46/11/1044154611.db2.gz GSBZPOJYFKGJTD-UHFFFAOYSA-N -1 3 327.424 4.131 20 0 EIADHM C[C@H](c1ccccc1Br)N1CCC[C@@H](CCC(=O)[O-])C1 ZINC000226455278 1044213066 /nfs/dbraw/zinc/21/30/66/1044213066.db2.gz CTKQASCBTLOYRI-OLZOCXBDSA-N -1 3 340.261 4.087 20 0 EIADHM O=C(OCc1cc(Cl)nc(Cl)c1)c1cc(Cl)c(Cl)[n-]1 ZINC000733430121 1044221779 /nfs/dbraw/zinc/22/17/79/1044221779.db2.gz NLLYEYWKRMCAMG-UHFFFAOYSA-N -1 3 339.993 4.380 20 0 EIADHM COc1cccc(C=C2CCN(C(=O)c3c(C)cccc3[O-])CC2)c1 ZINC000626108075 1044398235 /nfs/dbraw/zinc/39/82/35/1044398235.db2.gz RXIYJSPDTHRTGA-UHFFFAOYSA-N -1 3 337.419 4.029 20 0 EIADHM CC(C)c1ccccc1NC(=O)CO[N-]C(=O)CCC1CCCCC1 ZINC000733998296 1044457759 /nfs/dbraw/zinc/45/77/59/1044457759.db2.gz QYXUQYMUXNWUNT-UHFFFAOYSA-N -1 3 346.471 4.157 20 0 EIADHM O=C([N-]c1nnc(-c2ccsc2)s1)c1cc2cc(F)ccc2o1 ZINC000117626018 1044494623 /nfs/dbraw/zinc/49/46/23/1044494623.db2.gz WCESFPDXBZAUCE-UHFFFAOYSA-N -1 3 345.380 4.404 20 0 EIADHM Cc1cc(NCc2ccc([O-])c(F)c2)ccc1OC1CCOCC1 ZINC000825145644 1044613562 /nfs/dbraw/zinc/61/35/62/1044613562.db2.gz IIBQEBBJDKFCKT-UHFFFAOYSA-N -1 3 331.387 4.010 20 0 EIADHM Cc1ccc(-c2noc(-c3ccccc3[O-])n2)cc1Br ZINC000230997937 1044833563 /nfs/dbraw/zinc/83/35/63/1044833563.db2.gz XSBNJAVJAJCQAO-UHFFFAOYSA-N -1 3 331.169 4.180 20 0 EIADHM CCCc1ccc(C(=O)COC(=O)c2cc3ccsc3[n-]2)cc1 ZINC000914891858 1044852249 /nfs/dbraw/zinc/85/22/49/1044852249.db2.gz PUBSXAIUTZJMPT-UHFFFAOYSA-N -1 3 327.405 4.222 20 0 EIADHM COc1ccccc1CSCc1cc(=O)oc2c(C)c([O-])ccc12 ZINC000735982255 1044888923 /nfs/dbraw/zinc/88/89/23/1044888923.db2.gz UGDLTJMHYHRLCV-UHFFFAOYSA-N -1 3 342.416 4.249 20 0 EIADHM O=C(N[C@H](CCc1ccccc1)c1ccccc1)c1ccccc1[O-] ZINC001626085742 1044958865 /nfs/dbraw/zinc/95/88/65/1044958865.db2.gz OTYCMXYGDLJJSP-HXUWFJFHSA-N -1 3 331.415 4.496 20 0 EIADHM Cc1cccc(C)c1[N-]S(=O)(=O)c1ccc(C(F)(F)F)cc1C ZINC000509103338 1045132287 /nfs/dbraw/zinc/13/22/87/1045132287.db2.gz OHIJLPNWJJTFOF-UHFFFAOYSA-N -1 3 343.370 4.431 20 0 EIADHM [O-]c1ccc(F)c(CNc2cccc(OCc3cscn3)c2)c1F ZINC000509414404 1045133502 /nfs/dbraw/zinc/13/35/02/1045133502.db2.gz BUPXROZHJWOYSS-UHFFFAOYSA-N -1 3 348.374 4.318 20 0 EIADHM Cc1noc(C(F)F)c1C(=O)[N-]c1nc2cc(Cl)ccc2s1 ZINC000673697999 1045218233 /nfs/dbraw/zinc/21/82/33/1045218233.db2.gz LOHXDRNJRGELHL-UHFFFAOYSA-N -1 3 343.742 4.436 20 0 EIADHM O=C([N-]c1cccc2oc(C(F)(F)F)nc21)c1nc(Cl)cs1 ZINC000790960645 1045636860 /nfs/dbraw/zinc/63/68/60/1045636860.db2.gz QJJMYJFQFCRIRE-UHFFFAOYSA-N -1 3 347.705 4.209 20 0 EIADHM Cc1ccc(Br)cc1C(=O)Nc1ccc(Cl)cc1[O-] ZINC000533618421 1045638624 /nfs/dbraw/zinc/63/86/24/1045638624.db2.gz JPCZWNGOHXUHCD-UHFFFAOYSA-N -1 3 340.604 4.369 20 0 EIADHM Cc1sc(Cl)nc1C(=O)[N-]c1cc(-c2ccccc2F)on1 ZINC000791039713 1045681114 /nfs/dbraw/zinc/68/11/14/1045681114.db2.gz VQLMQTQPTJJCQC-UHFFFAOYSA-N -1 3 337.763 4.151 20 0 EIADHM Cc1cc(C(=O)O[C@@H](C)c2nc(=O)c3c(C)c(C)sc3[n-]2)oc1C ZINC000768122974 1045719742 /nfs/dbraw/zinc/71/97/42/1045719742.db2.gz BWCPTRZLAUBVMI-JTQLQIEISA-N -1 3 346.408 4.142 20 0 EIADHM O=C(N[C@H]1CCOC2(CCCCC2)C1)c1cc2sccc2c([O-])c1 ZINC000791383079 1045728850 /nfs/dbraw/zinc/72/88/50/1045728850.db2.gz AMJVMALQRSDHSZ-AWEZNQCLSA-N -1 3 345.464 4.219 20 0 EIADHM CCOc1ccc(OC)cc1NC(=O)c1cc2sccc2c([O-])c1 ZINC000791354193 1045729534 /nfs/dbraw/zinc/72/95/34/1045729534.db2.gz WMDUYXQARFZUHA-UHFFFAOYSA-N -1 3 343.404 4.267 20 0 EIADHM CCS[C@@H]1CCCC[C@H]1NC(=O)c1cc2sccc2c([O-])c1 ZINC000791382385 1045729599 /nfs/dbraw/zinc/72/95/99/1045729599.db2.gz YOMWXYLUJTZICV-UKRRQHHQSA-N -1 3 335.494 4.401 20 0 EIADHM Cc1c(NC(=O)c2cc3sccc3c([O-])c2)cccc1N(C)C ZINC000791390869 1045733512 /nfs/dbraw/zinc/73/35/12/1045733512.db2.gz GDHXFRYGGSEGDO-UHFFFAOYSA-N -1 3 326.421 4.234 20 0 EIADHM COc1c(Br)cccc1Nc1ccc([O-])c(F)c1F ZINC001212013702 1045834629 /nfs/dbraw/zinc/83/46/29/1045834629.db2.gz FSEPLPNEDZPXSU-UHFFFAOYSA-N -1 3 330.128 4.185 20 0 EIADHM COc1cccc(Nc2ccc([O-])c(F)c2F)c1Br ZINC001212007624 1045829767 /nfs/dbraw/zinc/82/97/67/1045829767.db2.gz RRJBIKPMRZXDHD-UHFFFAOYSA-N -1 3 330.128 4.185 20 0 EIADHM CC(=O)N1CC(C)(C)c2ccc(Nc3ccc([O-])c(F)c3F)cc21 ZINC001212009890 1045832212 /nfs/dbraw/zinc/83/22/12/1045832212.db2.gz XBSXRXPWKRIAGI-UHFFFAOYSA-N -1 3 332.350 4.058 20 0 EIADHM Cc1cc(Br)cc(Nc2ccc([O-])c(F)c2F)c1N ZINC001212009826 1045832354 /nfs/dbraw/zinc/83/23/54/1045832354.db2.gz VLIYCUWVLQKPGG-UHFFFAOYSA-N -1 3 329.144 4.067 20 0 EIADHM COc1cc(Br)cc(C)c1Nc1ccc([O-])c(F)c1F ZINC001212011194 1045834208 /nfs/dbraw/zinc/83/42/08/1045834208.db2.gz XDYKQQDJFGHXQL-UHFFFAOYSA-N -1 3 344.155 4.494 20 0 EIADHM COc1cc(Br)c(Nc2ccc([O-])c(F)c2F)cc1F ZINC001212013813 1045834896 /nfs/dbraw/zinc/83/48/96/1045834896.db2.gz LDEWUELRGKMNJG-UHFFFAOYSA-N -1 3 348.118 4.324 20 0 EIADHM COc1ccc(C)cc1[N-]S(=O)(=O)/C=C/c1cccc(Cl)c1 ZINC000768865069 1045848294 /nfs/dbraw/zinc/84/82/94/1045848294.db2.gz YPTBLYQIUAYIEF-CMDGGOBGSA-N -1 3 337.828 4.070 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N1CCC[C@H]1c1ccc(O)cc1 ZINC000792226642 1045878653 /nfs/dbraw/zinc/87/86/53/1045878653.db2.gz UOHJIDJWGDWHET-IBGZPJMESA-N -1 3 333.387 4.228 20 0 EIADHM CCOc1cc(CNc2cccc(NC(C)=O)c2)cc(Cl)c1[O-] ZINC000076275260 1045881432 /nfs/dbraw/zinc/88/14/32/1045881432.db2.gz JFRVXJVLGALMGZ-UHFFFAOYSA-N -1 3 334.803 4.015 20 0 EIADHM O=C([N-]Cc1cccc(Cl)c1Cl)C(F)(F)c1ccccc1 ZINC000916046571 1045887223 /nfs/dbraw/zinc/88/72/23/1045887223.db2.gz STRZIQNRGQDALE-UHFFFAOYSA-N -1 3 330.161 4.402 20 0 EIADHM COc1cc(Cl)ccc1NC(=O)c1cc([O-])c2ccccc2c1 ZINC000792332714 1045892049 /nfs/dbraw/zinc/89/20/49/1045892049.db2.gz LMBYVPBTRQYCKZ-UHFFFAOYSA-N -1 3 327.767 4.460 20 0 EIADHM CC(C)[C@@H](NC(=O)c1cc([O-])c2ccccc2c1)[C@@H](O)c1ccccc1 ZINC000792492629 1045898132 /nfs/dbraw/zinc/89/81/32/1045898132.db2.gz ZRRSTHVIQFLYQM-RTWAWAEBSA-N -1 3 349.430 4.033 20 0 EIADHM O=C([O-])[C@@H]1CCN(Cc2cc(Cl)ccc2Cl)[C@@H]2CCC[C@H]21 ZINC000629374932 1045899310 /nfs/dbraw/zinc/89/93/10/1045899310.db2.gz XEHUBNISLKSXSJ-GZBFAFLISA-N -1 3 328.239 4.069 20 0 EIADHM COC(=O)c1cc(Cl)cc(Nc2c(Cl)ccc([O-])c2F)c1O ZINC001214563894 1046010285 /nfs/dbraw/zinc/01/02/85/1046010285.db2.gz YFMZWXDTZVCUPY-UHFFFAOYSA-N -1 3 346.141 4.074 20 0 EIADHM CC[C@H](C)Oc1ccccc1/C=C\C(=O)NCc1ccc([O-])c(F)c1 ZINC000769554782 1046018698 /nfs/dbraw/zinc/01/86/98/1046018698.db2.gz LUGKQKYLTVJNIE-FPAJZGIOSA-N -1 3 343.398 4.038 20 0 EIADHM CC[C@@H](C)c1ccc(S(=O)(=O)[N-]c2cccc(OC)c2F)cc1 ZINC000769890830 1046106974 /nfs/dbraw/zinc/10/69/74/1046106974.db2.gz PTEZHRLWGQIPCO-GFCCVEGCSA-N -1 3 337.416 4.149 20 0 EIADHM CC(C)Oc1ccc(CN2CCC[C@H](CCC(=O)[O-])C2)cc1Cl ZINC000263168746 1046258170 /nfs/dbraw/zinc/25/81/70/1046258170.db2.gz RPWQWDCDQYLDGA-CQSZACIVSA-N -1 3 339.863 4.204 20 0 EIADHM CC[C@@H](NCc1cccc([O-])c1Br)c1nc(C)cs1 ZINC000459434820 1046669372 /nfs/dbraw/zinc/66/93/72/1046669372.db2.gz VAKWNVBWGJHGJQ-LLVKDONJSA-N -1 3 341.274 4.161 20 0 EIADHM CC[C@H](NCc1cccc([O-])c1Br)c1c(C)noc1C ZINC000459443712 1046675951 /nfs/dbraw/zinc/67/59/51/1046675951.db2.gz QEOFTEATCFEUKV-LBPRGKRZSA-N -1 3 339.233 4.000 20 0 EIADHM CCc1cccc(C(=O)N2CCC(c3c[nH]c4ccccc43)CC2)c1[O-] ZINC000536691506 1046677636 /nfs/dbraw/zinc/67/76/36/1046677636.db2.gz AKZIZMRRQHCMII-UHFFFAOYSA-N -1 3 348.446 4.456 20 0 EIADHM C[C@@H]1C[C@@H](c2cccnc2)N(Cc2cccc([O-])c2Br)C1 ZINC000459489720 1046714148 /nfs/dbraw/zinc/71/41/48/1046714148.db2.gz UOTYIDNZCYHQPZ-DOMZBBRYSA-N -1 3 347.256 4.133 20 0 EIADHM O=C(Nc1cccc([O-])c1F)c1cc2ccc(Br)cc2[nH]1 ZINC000128210346 1046782956 /nfs/dbraw/zinc/78/29/56/1046782956.db2.gz JEUXDGIUXIJYRK-UHFFFAOYSA-N -1 3 349.159 4.027 20 0 EIADHM CCOc1cc(CN2CC(C)(C)[C@@H]2c2ccncc2)cc(Cl)c1[O-] ZINC000459592872 1046802873 /nfs/dbraw/zinc/80/28/73/1046802873.db2.gz PMPFJWUCKAOIEN-SFHVURJKSA-N -1 3 346.858 4.422 20 0 EIADHM O=C(OCc1ccccc1Oc1cccnc1)c1cc2occc2[n-]1 ZINC000786030085 1046803775 /nfs/dbraw/zinc/80/37/75/1046803775.db2.gz UFCVXMVDKHYIDY-UHFFFAOYSA-N -1 3 334.331 4.305 20 0 EIADHM O=C(OCc1ccc(Cl)nc1C(F)(F)F)c1cc2occc2[n-]1 ZINC000786033918 1046803831 /nfs/dbraw/zinc/80/38/31/1046803831.db2.gz OLHOUWBXQLJMRW-UHFFFAOYSA-N -1 3 344.676 4.185 20 0 EIADHM CC[C@H](OC(=O)c1cc2occc2[n-]1)C(=O)c1ccc(Cl)cc1 ZINC000786030447 1046804130 /nfs/dbraw/zinc/80/41/30/1046804130.db2.gz FXHSGIKUJXXZQI-AWEZNQCLSA-N -1 3 331.755 4.233 20 0 EIADHM CCc1cc(=O)[n-]c(CN[C@@H](C)c2ccc(Oc3ccccc3)cc2)n1 ZINC000537060731 1046909736 /nfs/dbraw/zinc/90/97/36/1046909736.db2.gz PFQHKHPWILPJGW-HNNXBMFYSA-N -1 3 349.434 4.388 20 0 EIADHM Cc1ccc([O-])c(C(=O)Nc2cccc(-c3cn4c(n3)CCCC4)c2)c1 ZINC000917501381 1046915361 /nfs/dbraw/zinc/91/53/61/1046915361.db2.gz QXOCSUALPYCXGT-UHFFFAOYSA-N -1 3 347.418 4.153 20 0 EIADHM C[C@H]1CC[C@H](c2ccccc2)N(C(=O)NCc2ccc([O-])c(F)c2)C1 ZINC000497800971 1047087860 /nfs/dbraw/zinc/08/78/60/1047087860.db2.gz WJTFDMVIGCSITN-KBXCAEBGSA-N -1 3 342.414 4.214 20 0 EIADHM C[C@@H]1CC[C@H](c2ccccc2)N(C(=O)NCc2ccc([O-])c(F)c2)C1 ZINC000497801052 1047088887 /nfs/dbraw/zinc/08/88/87/1047088887.db2.gz WJTFDMVIGCSITN-RDTXWAMCSA-N -1 3 342.414 4.214 20 0 EIADHM C[C@@H](Oc1cc(Cl)cc(Cl)c1)C(=O)Nc1cccc([O-])c1F ZINC000128831415 1047101519 /nfs/dbraw/zinc/10/15/19/1047101519.db2.gz OSAWXXBRZPZSFS-MRVPVSSYSA-N -1 3 344.169 4.244 20 0 EIADHM CCS[C@@H]1CCCCN(C(=O)c2cc3sccc3c([O-])c2)C1 ZINC000788300623 1047154448 /nfs/dbraw/zinc/15/44/48/1047154448.db2.gz COWUEIRMLQVAGP-CYBMUJFWSA-N -1 3 335.494 4.355 20 0 EIADHM CC(C)(C)c1nnc([N-]C(=O)c2cc3c(cccc3F)s2)s1 ZINC000917857944 1047181915 /nfs/dbraw/zinc/18/19/15/1047181915.db2.gz YGRYYAUQWFPRIZ-UHFFFAOYSA-N -1 3 335.429 4.442 20 0 EIADHM O=C(CCCOc1cccc2ccccc21)Nc1cccc([O-])c1F ZINC000129088175 1047287047 /nfs/dbraw/zinc/28/70/47/1047287047.db2.gz JBRDIBARMFJPJO-UHFFFAOYSA-N -1 3 339.366 4.482 20 0 EIADHM CC(C)CC[C@H](N)C(=O)Nc1c([O-])c(Cl)cc(Cl)c1Cl ZINC000638297310 1047370805 /nfs/dbraw/zinc/37/08/05/1047370805.db2.gz AUPYWQDNBLIWRI-VIFPVBQESA-N -1 3 339.650 4.054 20 0 EIADHM CC[C@@H](Nc1ccccc1)C(=O)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000476143061 1047372968 /nfs/dbraw/zinc/37/29/68/1047372968.db2.gz HVANPYFKGDWQTE-CQSZACIVSA-N -1 3 338.329 4.240 20 0 EIADHM O=C(CSCc1cccc(Cl)c1)Nc1cccc([O-])c1F ZINC000129442827 1047392938 /nfs/dbraw/zinc/39/29/38/1047392938.db2.gz FWDBVXPOROIULT-UHFFFAOYSA-N -1 3 325.792 4.057 20 0 EIADHM CCc1c([N-]C(=O)C(F)(F)Cc2ccccc2)onc1C(F)(F)F ZINC000807268485 1047436436 /nfs/dbraw/zinc/43/64/36/1047436436.db2.gz OXPJVBFNCOIISA-UHFFFAOYSA-N -1 3 348.271 4.072 20 0 EIADHM CC(C)[C@H]1N(C(=O)CCCc2ccc([O-])c(F)c2)CC12CC=CC2 ZINC000649138544 1047458994 /nfs/dbraw/zinc/45/89/94/1047458994.db2.gz JSFXXBKPEFMPBX-LJQANCHMSA-N -1 3 331.431 4.057 20 0 EIADHM CN(C)Cc1cccc(C(=O)Nc2cc(Cl)c([O-])c(Cl)c2)c1 ZINC000154737899 1047459191 /nfs/dbraw/zinc/45/91/91/1047459191.db2.gz NZQBNLUGVNOKHK-UHFFFAOYSA-N -1 3 339.222 4.013 20 0 EIADHM COCc1c(C(=O)Nc2cccc([O-])c2F)sc2cccc(F)c21 ZINC000129678947 1047466216 /nfs/dbraw/zinc/46/62/16/1047466216.db2.gz WMUSZIMXDIHWRD-UHFFFAOYSA-N -1 3 349.358 4.284 20 0 EIADHM Cc1ccc(C(=O)Nc2ccc(-n3ccnc3)c(Cl)c2)c([O-])c1C ZINC001625994077 1047764220 /nfs/dbraw/zinc/76/42/20/1047764220.db2.gz PPHCHSHTLGBRKS-UHFFFAOYSA-N -1 3 341.798 4.100 20 0 EIADHM Cc1ccc(-c2cc(C(=O)O[C@H](C)c3ccc(F)c(F)c3)n[n-]2)o1 ZINC000919329078 1047814042 /nfs/dbraw/zinc/81/40/42/1047814042.db2.gz UNVHVTNOGMJGDD-SNVBAGLBSA-N -1 3 332.306 4.174 20 0 EIADHM Cc1ccc(-c2cc(C(=O)O[C@H](C)c3ccc(F)c(F)c3)[n-]n2)o1 ZINC000919329078 1047814044 /nfs/dbraw/zinc/81/40/44/1047814044.db2.gz UNVHVTNOGMJGDD-SNVBAGLBSA-N -1 3 332.306 4.174 20 0 EIADHM Cc1cccc([C@H](NC(=O)c2cc([O-])ccc2Cl)C(F)(F)F)c1 ZINC000498804985 1047853671 /nfs/dbraw/zinc/85/36/71/1047853671.db2.gz OPKNHKWRCYLUTL-AWEZNQCLSA-N -1 3 343.732 4.387 20 0 EIADHM Cc1sc2[n-]c([C@H](C)OC(=O)C=C3CCCC3)nc(=O)c2c1C ZINC000919595971 1047888112 /nfs/dbraw/zinc/88/81/12/1047888112.db2.gz NUWNHEFKUHNKBQ-JTQLQIEISA-N -1 3 332.425 4.118 20 0 EIADHM CC(=O)c1ccc(C(=O)N[C@H]2C[C@@H](C(C)C)c3ccccc32)cc1[O-] ZINC001171069146 1047952172 /nfs/dbraw/zinc/95/21/72/1047952172.db2.gz HIEFGCNOHLDBJI-OALUTQOASA-N -1 3 337.419 4.209 20 0 EIADHM O=C(OCc1csc(-c2ccco2)n1)c1cc(Cl)c(Cl)[n-]1 ZINC000825320712 1048069375 /nfs/dbraw/zinc/06/93/75/1048069375.db2.gz XGBQHLLYJJCOCG-UHFFFAOYSA-N -1 3 343.191 4.395 20 0 EIADHM CC(=O)c1cccc(NC(=O)c2cccc(Oc3ccncc3)c2)c1[O-] ZINC000556893021 1048117965 /nfs/dbraw/zinc/11/79/65/1048117965.db2.gz OPWMVYUTSBNNPC-UHFFFAOYSA-N -1 3 348.358 4.034 20 0 EIADHM CC(=O)c1cccc(NC(=O)c2cc3c(s2)CCCCC3)c1[O-] ZINC000556893934 1048119409 /nfs/dbraw/zinc/11/94/09/1048119409.db2.gz AOGGJBIDZKIWCL-UHFFFAOYSA-N -1 3 329.421 4.178 20 0 EIADHM CC(=O)c1cccc(NC(=O)c2csc3c2CC[C@H](C)C3)c1[O-] ZINC000556893734 1048136529 /nfs/dbraw/zinc/13/65/29/1048136529.db2.gz ZYUQRFBMZCDCLC-JTQLQIEISA-N -1 3 329.421 4.033 20 0 EIADHM CCCCC[C@H](NC(=O)c1ccc(OC)cc1[O-])c1ccccc1 ZINC001143658293 1048140631 /nfs/dbraw/zinc/14/06/31/1048140631.db2.gz MLFYNRPUGYEIGV-SFHVURJKSA-N -1 3 327.424 4.452 20 0 EIADHM C[C@@H]1CO[C@H](c2ccccc2)[C@@H](C)N1C(=O)c1cc([O-])ccc1Cl ZINC000815553565 1048506400 /nfs/dbraw/zinc/50/64/00/1048506400.db2.gz CYZFXESYNWPMNL-VFVRVIDISA-N -1 3 345.826 4.036 20 0 EIADHM CCc1noc(C)c1[N-]C(=O)c1csc(-c2ccccc2C)n1 ZINC000133039636 1048570092 /nfs/dbraw/zinc/57/00/92/1048570092.db2.gz ZQKGSPLBBGSVTB-UHFFFAOYSA-N -1 3 327.409 4.230 20 0 EIADHM COc1cc(C)c(NC(=O)c2cc3sccc3c([O-])c2)cc1OC ZINC001135367289 1048687342 /nfs/dbraw/zinc/68/73/42/1048687342.db2.gz XLWBTBWYTPQLKV-UHFFFAOYSA-N -1 3 343.404 4.185 20 0 EIADHM COc1ccc(C2CCN(Cc3c(F)cc([O-])cc3F)CC2)cc1 ZINC001144555210 1048725163 /nfs/dbraw/zinc/72/51/63/1048725163.db2.gz ZMVMGANVKRYJQQ-UHFFFAOYSA-N -1 3 333.378 4.059 20 0 EIADHM Nc1ccccc1N(C(=O)Cc1ccc([O-])c(F)c1)c1ccccc1 ZINC001144628770 1048765859 /nfs/dbraw/zinc/76/58/59/1048765859.db2.gz GNVFSTWBKGTEGL-UHFFFAOYSA-N -1 3 336.366 4.021 20 0 EIADHM C[C@H]1OC2(CCN(Cc3cc(F)c([O-])cc3F)CC2)c2ccccc21 ZINC001144663830 1048782222 /nfs/dbraw/zinc/78/22/22/1048782222.db2.gz KRGDAOVWBLCFGU-CYBMUJFWSA-N -1 3 345.389 4.253 20 0 EIADHM Cc1ccc(CNC(=O)c2cc(Oc3ccccc3)ccc2[O-])cc1 ZINC001135558308 1048795240 /nfs/dbraw/zinc/79/52/40/1048795240.db2.gz DNNOBELZCVCKBI-UHFFFAOYSA-N -1 3 333.387 4.423 20 0 EIADHM CC(C)Oc1ccccc1[N-]S(=O)(=O)/C=C/c1ccc(F)cc1 ZINC000747606001 1048798816 /nfs/dbraw/zinc/79/88/16/1048798816.db2.gz NDUXYEWNGNDGJZ-VAWYXSNFSA-N -1 3 335.400 4.026 20 0 EIADHM O=C(Nc1cc(Br)ccc1[O-])c1c(F)cccc1Cl ZINC000133754510 1048800146 /nfs/dbraw/zinc/80/01/46/1048800146.db2.gz SZWVUNZJLDCTIT-UHFFFAOYSA-N -1 3 344.567 4.200 20 0 EIADHM Cc1cccc(C2(O)CCN(Cc3cccc([O-])c3Cl)CC2)c1C ZINC000816515964 1048824165 /nfs/dbraw/zinc/82/41/65/1048824165.db2.gz QJUYZTAZPZIMSF-UHFFFAOYSA-N -1 3 345.870 4.146 20 0 EIADHM CC(C)(C)Oc1ccccc1[N-]S(=O)(=O)/C=C/c1ccc(F)cc1 ZINC000747616570 1048831922 /nfs/dbraw/zinc/83/19/22/1048831922.db2.gz DVUQCVBZYNAVGJ-OUKQBFOZSA-N -1 3 349.427 4.416 20 0 EIADHM O=C([O-])c1ccc(-c2nc(CN3CCC4(CCCC4)C3)cs2)cc1 ZINC000846244047 1048846535 /nfs/dbraw/zinc/84/65/35/1048846535.db2.gz DWMSUOVZPUXIFN-UHFFFAOYSA-N -1 3 342.464 4.274 20 0 EIADHM O=C([O-])[C@@H](c1ccc(Cl)c(Cl)c1)N1CCC2(CCCC2)C1 ZINC000846244209 1048847445 /nfs/dbraw/zinc/84/74/45/1048847445.db2.gz GHBZOBHAGDVJFO-CQSZACIVSA-N -1 3 328.239 4.385 20 0 EIADHM O=C(OCCCC1CCOCC1)c1cc2cc(Cl)sc2[n-]1 ZINC000810785663 1048860847 /nfs/dbraw/zinc/86/08/47/1048860847.db2.gz OODLMHKAUWLZRJ-UHFFFAOYSA-N -1 3 327.833 4.246 20 0 EIADHM C[C@@]1(CCNC(=O)c2cc3sccc3c([O-])c2)C[C@]1(F)Cl ZINC000846401271 1048861026 /nfs/dbraw/zinc/86/10/26/1048861026.db2.gz SOOIIRLUSUNRRK-HUUCEWRRSA-N -1 3 327.808 4.041 20 0 EIADHM CC(=O)c1cccc([O-])c1NC(=O)CCCc1c[nH]c2ccccc12 ZINC001144973995 1048944419 /nfs/dbraw/zinc/94/44/19/1048944419.db2.gz MGJYGIDWUBHJIL-UHFFFAOYSA-N -1 3 336.391 4.038 20 0 EIADHM CC(=O)c1ccc(-c2nc(=O)c3cc(C(C)(C)C)sc3[n-]2)s1 ZINC000134474343 1048963159 /nfs/dbraw/zinc/96/31/59/1048963159.db2.gz ZZFGULIYLZBUAE-UHFFFAOYSA-N -1 3 332.450 4.213 20 0 EIADHM O=C(OCc1ncc(-c2ccc(F)cc2)o1)c1cc2ccsc2[n-]1 ZINC000817707228 1049029107 /nfs/dbraw/zinc/02/91/07/1049029107.db2.gz JOARUWWHXPVJCF-UHFFFAOYSA-N -1 3 342.351 4.381 20 0 EIADHM CCc1ccc([C@H](NC(=O)c2ccc(OC)cc2[O-])C(C)C)cc1 ZINC001135978372 1049031424 /nfs/dbraw/zinc/03/14/24/1049031424.db2.gz NMCNINGQLPHJGW-LJQANCHMSA-N -1 3 327.424 4.090 20 0 EIADHM Cc1nc(CCOC(=O)c2cc3cc(Cl)sc3[n-]2)cs1 ZINC000811393559 1049052089 /nfs/dbraw/zinc/05/20/89/1049052089.db2.gz MRIDILWHLIQJEU-UHFFFAOYSA-N -1 3 326.830 4.047 20 0 EIADHM Cc1cc(=O)[n-]c([C@H](C)Sc2nnc(-c3ccc(C)c(C)c3)o2)n1 ZINC000135205433 1049086048 /nfs/dbraw/zinc/08/60/48/1049086048.db2.gz DWMODHSDXCNFOY-LBPRGKRZSA-N -1 3 342.424 4.011 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)NC1CCC(C2CCC2)CC1 ZINC001148072178 1049258630 /nfs/dbraw/zinc/25/86/30/1049258630.db2.gz JFGVWMRIHPBLJP-UHFFFAOYSA-N -1 3 333.447 4.329 20 0 EIADHM CSc1cc(C(=O)Nc2ccc(Br)cc2[O-])c(C)o1 ZINC001136219945 1049323579 /nfs/dbraw/zinc/32/35/79/1049323579.db2.gz JJYQFLPPAKKKJL-UHFFFAOYSA-N -1 3 342.214 4.030 20 0 EIADHM COc1ccc(-c2ccccc2NC(=O)c2ccc(C)cc2[O-])nc1 ZINC001148505773 1049328500 /nfs/dbraw/zinc/32/85/00/1049328500.db2.gz GJKRIKSANFCNBY-UHFFFAOYSA-N -1 3 334.375 4.024 20 0 EIADHM Cc1ccc(C(=O)N2CCC3(CCCc4ccccc43)CC2)c([O-])c1 ZINC001148498857 1049329254 /nfs/dbraw/zinc/32/92/54/1049329254.db2.gz OAMQSVIVBFENGA-UHFFFAOYSA-N -1 3 335.447 4.211 20 0 EIADHM CC(=O)c1cc(C(=O)NC2c3ccccc3-c3ccccc32)ccc1[O-] ZINC001148668878 1049359174 /nfs/dbraw/zinc/35/91/74/1049359174.db2.gz MQCQBZMLBOVGGN-UHFFFAOYSA-N -1 3 343.382 4.095 20 0 EIADHM O=C(c1cc2sccc2c([O-])c1)N1CCc2c(F)ccc(F)c2C1 ZINC001148899545 1049396053 /nfs/dbraw/zinc/39/60/53/1049396053.db2.gz VOUACIYEFTYFOM-UHFFFAOYSA-N -1 3 345.370 4.084 20 0 EIADHM COc1cccc(C(=O)N(Cc2ccccc2)c2ccccc2)c1[O-] ZINC001136346314 1049518254 /nfs/dbraw/zinc/51/82/54/1049518254.db2.gz FPUZCMVLTPYAPP-UHFFFAOYSA-N -1 3 333.387 4.248 20 0 EIADHM CC(C)c1ccc(S(=O)(=O)[N-]c2cnc(Cl)cc2Cl)cc1 ZINC000820799574 1049560686 /nfs/dbraw/zinc/56/06/86/1049560686.db2.gz WPWWRVDTWKFBOZ-UHFFFAOYSA-N -1 3 345.251 4.313 20 0 EIADHM Cc1nc2ccccc2c(-c2ccccc2)c1CC(=O)[N-]OC1CCC1 ZINC000812790526 1049577380 /nfs/dbraw/zinc/57/73/80/1049577380.db2.gz WJGFVTBDXGAFCZ-UHFFFAOYSA-N -1 3 346.430 4.353 20 0 EIADHM O=C(Cc1cccc(OCc2cccc(Cl)c2)c1)[N-]OC1CCC1 ZINC000812796562 1049593983 /nfs/dbraw/zinc/59/39/83/1049593983.db2.gz VJOZJXUOWCWXIR-UHFFFAOYSA-N -1 3 345.826 4.062 20 0 EIADHM CSc1ccc([O-])c(C(=O)N2CC[C@@H](c3cccc(Cl)c3)C2)c1 ZINC000615288639 1049621641 /nfs/dbraw/zinc/62/16/41/1049621641.db2.gz KJLRFPNGDRNLQM-CYBMUJFWSA-N -1 3 347.867 4.397 20 0 EIADHM Cc1ccc(O)cc1NC(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC001171479111 1049730825 /nfs/dbraw/zinc/73/08/25/1049730825.db2.gz QQMQPCKVMPIWJL-UHFFFAOYSA-N -1 3 335.359 4.451 20 0 EIADHM O=c1cc(CNC2(c3ccccc3F)CCC2)nc(-c2ccccc2)[n-]1 ZINC001171521352 1049748048 /nfs/dbraw/zinc/74/80/48/1049748048.db2.gz GHNLHFOPCBFQTR-UHFFFAOYSA-N -1 3 349.409 4.157 20 0 EIADHM Cc1cccc([O-])c1C(=O)NCC1(c2cccc(C(F)(F)F)c2)CC1 ZINC001136587437 1049764119 /nfs/dbraw/zinc/76/41/19/1049764119.db2.gz SJDZGTJACVRZIM-UHFFFAOYSA-N -1 3 349.352 4.181 20 0 EIADHM Cc1ccc2cccc(NC(=O)c3cc4c(cc3[O-])CCCC4)c2n1 ZINC001136600826 1049774044 /nfs/dbraw/zinc/77/40/44/1049774044.db2.gz FZYRMXDYKYGQOP-UHFFFAOYSA-N -1 3 332.403 4.380 20 0 EIADHM CO[C@H](C)CC(=O)Nc1ccc([O-])c(-c2nc3ccccc3s2)c1 ZINC000179934137 1049802131 /nfs/dbraw/zinc/80/21/31/1049802131.db2.gz VCYKAQBHMYKNAT-LLVKDONJSA-N -1 3 342.420 4.032 20 0 EIADHM COc1ccc([C@H](C)CCNC(=O)c2cc([O-])c3ccccc3c2)cc1 ZINC001136784562 1049879388 /nfs/dbraw/zinc/87/93/88/1049879388.db2.gz WZHNFNDYYWFUML-OAHLLOKOSA-N -1 3 349.430 4.478 20 0 EIADHM C[C@@H]1C[C@H]1N(Cc1cc(=O)[n-]c(-c2ccccc2)n1)c1ccccc1 ZINC001171047562 1049901977 /nfs/dbraw/zinc/90/19/77/1049901977.db2.gz GBOWTSLRTWZIIW-DNVCBOLYSA-N -1 3 331.419 4.264 20 0 EIADHM CSc1ccc([O-])c(C(=O)N2CC[C@](C)(c3cccc(F)c3)C2)c1 ZINC000616516689 1049903310 /nfs/dbraw/zinc/90/33/10/1049903310.db2.gz NCEONYLYDRXDFO-IBGZPJMESA-N -1 3 345.439 4.057 20 0 EIADHM CSc1ccc([O-])c(C(=O)N2CC3(CCCC3)[C@@H]2c2ccco2)c1 ZINC000617920909 1050129161 /nfs/dbraw/zinc/12/91/61/1050129161.db2.gz KSXGBWWTBPHUDM-KRWDZBQOSA-N -1 3 343.448 4.465 20 0 EIADHM [O-]c1cncc(-c2nc(-c3ccc(Oc4ccccc4)cc3)no2)c1 ZINC001212708662 1050329429 /nfs/dbraw/zinc/32/94/29/1050329429.db2.gz NVIUZILTTXZKAS-UHFFFAOYSA-N -1 3 331.331 4.297 20 0 EIADHM CC(C)n1cc(Cl)c(NC(=O)c2cc3sccc3c([O-])c2)n1 ZINC001178198251 1050402516 /nfs/dbraw/zinc/40/25/16/1050402516.db2.gz DXAYFHNNFGZQKQ-UHFFFAOYSA-N -1 3 335.816 4.290 20 0 EIADHM Cc1cc(-c2ccc(CC(=O)Nc3ccc(F)c([O-])c3)cc2)ccn1 ZINC001178380212 1050449427 /nfs/dbraw/zinc/44/94/27/1050449427.db2.gz YSVBTGSTBWOIBK-UHFFFAOYSA-N -1 3 336.366 4.083 20 0 EIADHM CC[C@H]1CCC[C@@H]([N-]S(=O)(=O)c2cccc(Cl)c2Cl)C1 ZINC001187137853 1050490165 /nfs/dbraw/zinc/49/01/65/1050490165.db2.gz KIPVWYMCGLQMNT-WDEREUQCSA-N -1 3 336.284 4.241 20 0 EIADHM O=C(Nc1cc(F)cc(F)c1)Nc1cc(Br)ccc1[O-] ZINC001187570847 1050575112 /nfs/dbraw/zinc/57/51/12/1050575112.db2.gz DERPJJHQWXNKFY-UHFFFAOYSA-N -1 3 343.127 4.077 20 0 EIADHM CCc1ccccc1NC(=O)Nc1c([O-])cccc1Br ZINC001187636881 1050584898 /nfs/dbraw/zinc/58/48/98/1050584898.db2.gz USVPWTRCGQXUSK-UHFFFAOYSA-N -1 3 335.201 4.361 20 0 EIADHM COc1ccc(Nc2cc(Br)cc(F)c2[O-])c(C)c1 ZINC001174023856 1050709046 /nfs/dbraw/zinc/70/90/46/1050709046.db2.gz MRDMUTBJXXRINN-UHFFFAOYSA-N -1 3 326.165 4.354 20 0 EIADHM CC(=O)c1c(F)cccc1NC(=O)c1c(C)ccc(C(C)C)c1[O-] ZINC001188182176 1050716671 /nfs/dbraw/zinc/71/66/71/1050716671.db2.gz XPXGEAXMIRZFSG-UHFFFAOYSA-N -1 3 329.371 4.418 20 0 EIADHM CCCC[C@H]([N-]S(=O)(=O)c1cc(F)ccc1Cl)C1CCC1 ZINC001188239105 1050723701 /nfs/dbraw/zinc/72/37/01/1050723701.db2.gz NLKHHNGWBCOYGF-AWEZNQCLSA-N -1 3 333.856 4.116 20 0 EIADHM CCc1cccc(C(=O)N2CCC[C@]2(C)Cc2cccs2)c1[O-] ZINC001179558587 1050724300 /nfs/dbraw/zinc/72/43/00/1050724300.db2.gz VBDWOSMVQYOSNZ-LJQANCHMSA-N -1 3 329.465 4.254 20 0 EIADHM O=C(c1ccc(Nc2cccc([O-])c2Cl)cc1)N1CCCCC1 ZINC001174071574 1050743437 /nfs/dbraw/zinc/74/34/37/1050743437.db2.gz QDWHQBZJHAAEIE-UHFFFAOYSA-N -1 3 330.815 4.415 20 0 EIADHM COc1ccc(NC(=O)[N-]c2cc(-c3ccccn3)no2)cc1Cl ZINC001188442624 1050769968 /nfs/dbraw/zinc/76/99/68/1050769968.db2.gz CIHCMOWMEFJVDD-UHFFFAOYSA-N -1 3 344.758 4.043 20 0 EIADHM O=C(/C=C/c1cccc(OC(F)(F)F)c1)Nc1ccc(F)c([O-])c1 ZINC001179945512 1050829006 /nfs/dbraw/zinc/82/90/06/1050829006.db2.gz JKGGVSHQXNIKIQ-QPJJXVBHSA-N -1 3 341.260 4.082 20 0 EIADHM CC1CCN(C(=O)c2cccc(Nc3cc([O-])c(F)cc3F)c2)CC1 ZINC001174204127 1050838616 /nfs/dbraw/zinc/83/86/16/1050838616.db2.gz LTAAJBICONZYOC-UHFFFAOYSA-N -1 3 346.377 4.286 20 0 EIADHM [O-]c1c(Cl)cc(Br)cc1Nc1ccc2nccn2c1 ZINC001174280836 1050862902 /nfs/dbraw/zinc/86/29/02/1050862902.db2.gz XZNUIXGLJCQKEZ-UHFFFAOYSA-N -1 3 338.592 4.199 20 0 EIADHM C[C@@H]1CC[C@H]([N-]S(=O)(=O)c2cc(Cl)ccc2Cl)C[C@H]1C ZINC001189050159 1050894825 /nfs/dbraw/zinc/89/48/25/1050894825.db2.gz ZTBHBUVRZHTHAX-FOGDFJRCSA-N -1 3 336.284 4.096 20 0 EIADHM O=S(=O)(CCc1ccc(Cl)cc1)[N-]c1ccccc1C(F)F ZINC001189100755 1050910099 /nfs/dbraw/zinc/91/00/99/1050910099.db2.gz NFYILMFZMDCMNZ-UHFFFAOYSA-N -1 3 345.798 4.262 20 0 EIADHM Cc1cc(NCc2ccc([O-])c(F)c2)cnc1N1CCCC[C@H]1C ZINC001180301164 1050945341 /nfs/dbraw/zinc/94/53/41/1050945341.db2.gz JXHFHFQRFXBEBS-CQSZACIVSA-N -1 3 329.419 4.226 20 0 EIADHM O=S(=O)(Cc1ccc(F)c(F)c1)[N-]c1cccc2sccc21 ZINC001189319096 1050964564 /nfs/dbraw/zinc/96/45/64/1050964564.db2.gz YQFOPYRSRRHPDN-UHFFFAOYSA-N -1 3 339.388 4.121 20 0 EIADHM CCCc1ccc(C(=O)Nc2cc(Br)ccc2[O-])s1 ZINC001189513853 1051004717 /nfs/dbraw/zinc/00/47/17/1051004717.db2.gz ZXNZLEAXVSZHOX-UHFFFAOYSA-N -1 3 340.242 4.421 20 0 EIADHM COc1cc(Nc2cccc([O-])c2Br)cc(F)c1F ZINC001174587128 1051071655 /nfs/dbraw/zinc/07/16/55/1051071655.db2.gz JXSYYDDRQWNAMQ-UHFFFAOYSA-N -1 3 330.128 4.185 20 0 EIADHM CC(C)(C)C1CCN(C(=O)c2cccc(OC(F)(F)F)c2[O-])CC1 ZINC001189747954 1051049957 /nfs/dbraw/zinc/04/99/57/1051049957.db2.gz AAKHBKSQNCAFMK-UHFFFAOYSA-N -1 3 345.361 4.189 20 0 EIADHM COc1c(F)ccc(F)c1Nc1cc(Br)cc(F)c1[O-] ZINC001174664843 1051133185 /nfs/dbraw/zinc/13/31/85/1051133185.db2.gz LWHHKLVNKQEMRZ-UHFFFAOYSA-N -1 3 348.118 4.324 20 0 EIADHM Cc1noc(-c2ccccc2)c1NC(=O)Nc1ccc(F)c([O-])c1 ZINC001190369449 1051170382 /nfs/dbraw/zinc/17/03/82/1051170382.db2.gz RPJOQLBGFAFLBY-UHFFFAOYSA-N -1 3 327.315 4.139 20 0 EIADHM CN1CCN(c2ccc(Nc3cc(Cl)ccc3[S-])cc2)CC1 ZINC001174814625 1051182403 /nfs/dbraw/zinc/18/24/03/1051182403.db2.gz JHDSMQNFCOOANU-UHFFFAOYSA-N -1 3 333.888 4.124 20 0 EIADHM O=C(Nc1ccc(Cl)cc1[O-])c1c(F)cccc1Br ZINC000153629001 1051207287 /nfs/dbraw/zinc/20/72/87/1051207287.db2.gz DDBBQZMPRKPQMN-UHFFFAOYSA-N -1 3 344.567 4.200 20 0 EIADHM O=c1ccoc2ccc(Nc3cccc([O-])c3Br)cc12 ZINC001174946493 1051267023 /nfs/dbraw/zinc/26/70/23/1051267023.db2.gz RWVWSFCYORCMFC-UHFFFAOYSA-N -1 3 332.153 4.005 20 0 EIADHM COc1cc(C(=O)Nc2cc([O-])cc(Cl)c2)ccc1C(F)(F)F ZINC001190807268 1051280947 /nfs/dbraw/zinc/28/09/47/1051280947.db2.gz RVTRDJYIELTOGP-UHFFFAOYSA-N -1 3 345.704 4.325 20 0 EIADHM C[C@H](c1cccc2ccccc21)N(C)C(=O)c1ccc(=O)[n-]c1Cl ZINC001190910998 1051309094 /nfs/dbraw/zinc/30/90/94/1051309094.db2.gz ZQGCOHNZWYWJMC-GFCCVEGCSA-N -1 3 340.810 4.427 20 0 EIADHM Cc1cc(Nc2ccc(C(N)=O)c([O-])c2)ccc1OCc1ccccc1 ZINC001175034860 1051327214 /nfs/dbraw/zinc/32/72/14/1051327214.db2.gz DJXDTZJCTWZEOL-UHFFFAOYSA-N -1 3 348.402 4.122 20 0 EIADHM [O-]c1cc(F)c(Nc2cc(F)c(F)c(Br)c2)c(F)c1 ZINC001175099481 1051345286 /nfs/dbraw/zinc/34/52/86/1051345286.db2.gz IPWCBZWMYTXFKT-UHFFFAOYSA-N -1 3 336.082 4.455 20 0 EIADHM CC(=O)Nc1ccc(Nc2c(F)cc([O-])cc2F)c(C(F)(F)F)c1 ZINC001175099613 1051345763 /nfs/dbraw/zinc/34/57/63/1051345763.db2.gz PLRPRSWCQKQQOL-UHFFFAOYSA-N -1 3 346.255 4.391 20 0 EIADHM [O-]c1cc(F)c(Nc2ccc(OC[C@@H]3CCCO3)c(F)c2)c(F)c1 ZINC001175100362 1051346907 /nfs/dbraw/zinc/34/69/07/1051346907.db2.gz QXGHMOSVIDRVAR-LBPRGKRZSA-N -1 3 339.313 4.111 20 0 EIADHM O=C([N-]c1cc(-c2ccccn2)no1)c1nc(-c2ccccc2)cs1 ZINC001191040710 1051347462 /nfs/dbraw/zinc/34/74/62/1051347462.db2.gz ZMSQMRILQMXEQO-UHFFFAOYSA-N -1 3 348.387 4.112 20 0 EIADHM CCOC(=O)c1coc2cc(Nc3c(F)cc([O-])cc3F)ccc12 ZINC001175102529 1051350123 /nfs/dbraw/zinc/35/01/23/1051350123.db2.gz NVDYCNUVMBHRMJ-UHFFFAOYSA-N -1 3 333.290 4.337 20 0 EIADHM COc1ccc(-c2ccccc2Nc2c(F)cc([O-])cc2F)nc1 ZINC001175102499 1051350388 /nfs/dbraw/zinc/35/03/88/1051350388.db2.gz MTKIHMBIBNMUIL-UHFFFAOYSA-N -1 3 328.318 4.485 20 0 EIADHM COc1cc(Nc2c(F)cc([O-])cc2F)ccc1Br ZINC001175097701 1051379557 /nfs/dbraw/zinc/37/95/57/1051379557.db2.gz UXPQJQNPDHVRDQ-UHFFFAOYSA-N -1 3 330.128 4.185 20 0 EIADHM CCCCc1ccc(S(=O)(=O)[N-]c2ccc(F)c(C(C)=O)c2)cc1 ZINC001191249590 1051394617 /nfs/dbraw/zinc/39/46/17/1051394617.db2.gz WMJAIIXRTYSQLQ-UHFFFAOYSA-N -1 3 349.427 4.172 20 0 EIADHM [O-]c1ccc(F)c(Nc2ccc(I)cc2)c1F ZINC001175268479 1051504658 /nfs/dbraw/zinc/50/46/58/1051504658.db2.gz QCFPQDDTFXYPLZ-UHFFFAOYSA-N -1 3 347.102 4.019 20 0 EIADHM COc1ccc(Br)c(Nc2c(F)ccc([O-])c2F)c1 ZINC001175266342 1051505143 /nfs/dbraw/zinc/50/51/43/1051505143.db2.gz XOMCEYDPOYKMFE-UHFFFAOYSA-N -1 3 330.128 4.185 20 0 EIADHM COC(=O)c1cc2cccc(Nc3c(F)ccc([O-])c3F)c2s1 ZINC001175269634 1051506932 /nfs/dbraw/zinc/50/69/32/1051506932.db2.gz IMWBVFLICUSLDX-UHFFFAOYSA-N -1 3 335.331 4.415 20 0 EIADHM O=C(Nc1ccc(F)c([O-])c1)[C@H]1C[C@@H]1c1ccccc1C(F)(F)F ZINC001182363097 1051524558 /nfs/dbraw/zinc/52/45/58/1051524558.db2.gz LKQPRKZMBFBFJY-NEPJUHHUSA-N -1 3 339.288 4.292 20 0 EIADHM CC(=O)c1cccc([O-])c1NC(=O)c1ccnc(Oc2ccccc2)c1 ZINC001191803361 1051554633 /nfs/dbraw/zinc/55/46/33/1051554633.db2.gz BPRXWHYNCLEVRP-UHFFFAOYSA-N -1 3 348.358 4.034 20 0 EIADHM FC(F)(F)Sc1ccc(Nc2ccc(-c3nn[n-]n3)cc2)cc1 ZINC001175428980 1051588034 /nfs/dbraw/zinc/58/80/34/1051588034.db2.gz DNDBKKBOLOXFBN-UHFFFAOYSA-N -1 3 337.330 4.222 20 0 EIADHM CC(C)(Cc1ccccc1)C(=O)Nc1cc(Br)ccc1[O-] ZINC001182605674 1051658554 /nfs/dbraw/zinc/65/85/54/1051658554.db2.gz JOKRLMRCLBRHDC-UHFFFAOYSA-N -1 3 348.240 4.362 20 0 EIADHM Cc1cc(S(=O)(=O)[N-]c2c(F)cccc2C(C)C)cnc1Cl ZINC001192579921 1051768899 /nfs/dbraw/zinc/76/88/99/1051768899.db2.gz SEXXMVKPJOIFJM-UHFFFAOYSA-N -1 3 342.823 4.107 20 0 EIADHM Brc1nnc([N-]c2ccc(-c3ccccc3)nc2)s1 ZINC001175832622 1051794176 /nfs/dbraw/zinc/79/41/76/1051794176.db2.gz HYJAWIARAZPBQC-UHFFFAOYSA-N -1 3 333.214 4.106 20 0 EIADHM O=C(N[C@@H]1CCc2ccc(-c3ccccc3)cc21)c1c([O-])cccc1O ZINC001183240154 1051813213 /nfs/dbraw/zinc/81/32/13/1051813213.db2.gz YCYJALCXXHSBJY-GOSISDBHSA-N -1 3 345.398 4.182 20 0 EIADHM CCc1ccc(OC)c(S(=O)(=O)[N-]c2cc(C)ccc2Cl)c1 ZINC001192821601 1051813731 /nfs/dbraw/zinc/81/37/31/1051813731.db2.gz QMFUWZUGRZBVNZ-UHFFFAOYSA-N -1 3 339.844 4.020 20 0 EIADHM CCCCc1nnc([N-]C(=O)c2cscc2C(F)(F)F)s1 ZINC000621404600 1051856649 /nfs/dbraw/zinc/85/66/49/1051856649.db2.gz YOHMYVGZGSROGS-UHFFFAOYSA-N -1 3 335.376 4.213 20 0 EIADHM CCCCOc1ccc(C(=O)N(C)Cc2ccc(C)c(C)c2)c([O-])c1 ZINC001183695474 1051883700 /nfs/dbraw/zinc/88/37/00/1051883700.db2.gz WKDQSCOOJSTOCJ-UHFFFAOYSA-N -1 3 341.451 4.460 20 0 EIADHM COc1cccc2[nH]c(Nc3cccc([O-])c3Br)cc21 ZINC001176066122 1051901356 /nfs/dbraw/zinc/90/13/56/1051901356.db2.gz WYEQAKDSJXTKHH-UHFFFAOYSA-N -1 3 333.185 4.388 20 0 EIADHM O=C([N-]c1cc(-c2cccs2)on1)c1nc(Cl)ccc1Cl ZINC001183913541 1051924141 /nfs/dbraw/zinc/92/41/41/1051924141.db2.gz DXGQQCZGHYFWHE-UHFFFAOYSA-N -1 3 340.191 4.357 20 0 EIADHM CC(=O)c1ccc(OCc2ccccc2)c(NC(=O)OC(C)C)c1[O-] ZINC001193496751 1051932520 /nfs/dbraw/zinc/93/25/20/1051932520.db2.gz SFVWPMRWSNNVJM-UHFFFAOYSA-N -1 3 343.379 4.131 20 0 EIADHM O=C(c1ccc(F)c([N-]c2nc3ccc(F)cc3o2)c1)N1CCCC1 ZINC001176206437 1051954092 /nfs/dbraw/zinc/95/40/92/1051954092.db2.gz UNRLIBFUJVREIS-UHFFFAOYSA-N -1 3 343.333 4.086 20 0 EIADHM Cc1cccc(C2(NC(=O)c3ccc([O-])cc3C(F)(F)F)CC2)c1 ZINC001193759077 1051990793 /nfs/dbraw/zinc/99/07/93/1051990793.db2.gz LQHOILNJOUEKAA-UHFFFAOYSA-N -1 3 335.325 4.139 20 0 EIADHM O=C(Nc1ccc2ccncc2c1)c1ccc([O-])cc1C(F)(F)F ZINC001193745879 1051992323 /nfs/dbraw/zinc/99/23/23/1051992323.db2.gz MUURLHZNKCZXOY-UHFFFAOYSA-N -1 3 332.281 4.212 20 0 EIADHM CCN(Cc1nnc(-c2ccccc2[O-])o1)c1ccc(Cl)c(F)c1 ZINC001193826794 1052007210 /nfs/dbraw/zinc/00/72/10/1052007210.db2.gz HSYKLOFBGDFFSI-UHFFFAOYSA-N -1 3 347.777 4.261 20 0 EIADHM [O-]c1ccc(Nc2cccc3c2cnn3[C@H]2CCCCO2)c(F)c1F ZINC001176314797 1052019629 /nfs/dbraw/zinc/01/96/29/1052019629.db2.gz CYBSLTACXCEZOB-MRXNPFEDSA-N -1 3 345.349 4.463 20 0 EIADHM O=c1cc(Nc2cc(F)cc(N3CCCC3)c2)[n-]n1-c1ccccc1 ZINC001176421531 1052072044 /nfs/dbraw/zinc/07/20/44/1052072044.db2.gz PSTXACMBFHPEMD-UHFFFAOYSA-N -1 3 338.386 4.061 20 0 EIADHM CCCOC(=O)Nc1c([O-])c(C(C)=O)ccc1OCc1ccccc1 ZINC001194131146 1052078868 /nfs/dbraw/zinc/07/88/68/1052078868.db2.gz YKJQNYPMFSFHKB-UHFFFAOYSA-N -1 3 343.379 4.132 20 0 EIADHM CCN(CC)C(=O)c1cc(Nc2cc([O-])c(F)cc2F)ccc1F ZINC001176518097 1052105444 /nfs/dbraw/zinc/10/54/44/1052105444.db2.gz GPNGGCRLDRUVEO-UHFFFAOYSA-N -1 3 338.329 4.035 20 0 EIADHM O=S(=O)([N-]c1ccccc1F)c1ccc2c(Cl)cccc2c1 ZINC001194215608 1052108823 /nfs/dbraw/zinc/10/88/23/1052108823.db2.gz JZGQMRNYJHCYRT-UHFFFAOYSA-N -1 3 335.787 4.433 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2ccc(C3CCCCC3)cc2)cc1N ZINC001176730976 1052176212 /nfs/dbraw/zinc/17/62/12/1052176212.db2.gz QWPQWGVQDDYUDV-UHFFFAOYSA-N -1 3 344.480 4.426 20 0 EIADHM CCc1ccc(C(=O)N(C)Cc2ccc(C(F)(F)F)cc2)c([O-])c1 ZINC000622278556 1052177019 /nfs/dbraw/zinc/17/70/19/1052177019.db2.gz AQKZIMZWSLKLBK-UHFFFAOYSA-N -1 3 337.341 4.246 20 0 EIADHM Cc1cccc(C)c1S(=O)(=O)[N-]c1ccc(-c2ccncc2)cc1 ZINC001194637576 1052182333 /nfs/dbraw/zinc/18/23/33/1052182333.db2.gz BGMGLFLRBLTTGU-UHFFFAOYSA-N -1 3 338.432 4.166 20 0 EIADHM CC(C)(C)c1csc(NC(=O)c2cc([O-])cc(C(F)(F)F)c2)n1 ZINC000622324038 1052198245 /nfs/dbraw/zinc/19/82/45/1052198245.db2.gz AACFBNKUONBWKT-UHFFFAOYSA-N -1 3 344.358 4.417 20 0 EIADHM Cc1cc(C)c2c(c1)N(C(=O)CCCc1ccc([O-])c(F)c1)CCC2 ZINC000622349089 1052220835 /nfs/dbraw/zinc/22/08/35/1052220835.db2.gz LBBYPVIEXDQCNX-UHFFFAOYSA-N -1 3 341.426 4.450 20 0 EIADHM C[C@H](CN(C)C(=O)c1cc([O-])cc(C(F)(F)F)c1)c1ccccc1 ZINC000622349042 1052221248 /nfs/dbraw/zinc/22/12/48/1052221248.db2.gz JJJKODSIWOOVBP-GFCCVEGCSA-N -1 3 337.341 4.287 20 0 EIADHM C[C@H](N[C@@H](C)c1cc(Br)cc(F)c1[O-])c1ccccn1 ZINC000184845730 1052254887 /nfs/dbraw/zinc/25/48/87/1052254887.db2.gz DKBZYETYGAZOHL-UWVGGRQHSA-N -1 3 339.208 4.101 20 0 EIADHM Cc1ccc(C(=O)N(CCc2cccc(F)c2)C2CCCC2)c([O-])c1 ZINC000622426933 1052264000 /nfs/dbraw/zinc/26/40/00/1052264000.db2.gz DSIXCFPLWWKJBB-UHFFFAOYSA-N -1 3 341.426 4.467 20 0 EIADHM CCOc1cc(-c2ccccc2)sc1C(=O)Nc1ncccc1[O-] ZINC000622505052 1052304527 /nfs/dbraw/zinc/30/45/27/1052304527.db2.gz MLWZMWDBHDGVGZ-UHFFFAOYSA-N -1 3 340.404 4.167 20 0 EIADHM O=C(NCc1ccc(Cl)cc1F)c1cc([O-])cc(C(F)(F)F)c1 ZINC000622525041 1052315622 /nfs/dbraw/zinc/31/56/22/1052315622.db2.gz PTHYVZHBDVHJIG-UHFFFAOYSA-N -1 3 347.695 4.134 20 0 EIADHM CCOc1ncccc1CN[C@H](C)c1ccc(Cl)c(Cl)c1[O-] ZINC000184985974 1052345574 /nfs/dbraw/zinc/34/55/74/1052345574.db2.gz KSOHSHVHOFICTK-SNVBAGLBSA-N -1 3 341.238 4.344 20 0 EIADHM Cc1ccccc1C(C)(C)NC(=O)c1cc([O-])cc(C(F)(F)F)c1 ZINC000622620549 1052364752 /nfs/dbraw/zinc/36/47/52/1052364752.db2.gz SFFSAVCIWKHTTF-UHFFFAOYSA-N -1 3 337.341 4.385 20 0 EIADHM CC(C)(C)C[C@H]1CCN(C(=O)c2cc([O-])cc(C(F)(F)F)c2)C1 ZINC000622673397 1052383800 /nfs/dbraw/zinc/38/38/00/1052383800.db2.gz MNAMWIAYNFPUND-LLVKDONJSA-N -1 3 329.362 4.309 20 0 EIADHM O=C(N=c1cc(-c2cccc(Cl)c2)[n-][nH]1)c1cc2ccccc2o1 ZINC000622892385 1052524504 /nfs/dbraw/zinc/52/45/04/1052524504.db2.gz MXXQFWHJBSMPCS-UHFFFAOYSA-N -1 3 337.766 4.151 20 0 EIADHM Cc1nc(-c2ccccc2)c(C(=O)Nc2cc(F)ccc2[O-])s1 ZINC000174879053 1052576559 /nfs/dbraw/zinc/57/65/59/1052576559.db2.gz DLRCITMQDPRVGU-UHFFFAOYSA-N -1 3 328.368 4.216 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)N[C@H](C(F)F)C1CCCCC1 ZINC000623046514 1052579503 /nfs/dbraw/zinc/57/95/03/1052579503.db2.gz UJRFDWFWGAOPSO-KRWDZBQOSA-N -1 3 343.389 4.184 20 0 EIADHM Cc1cccc([O-])c1C(=O)N(CCC(F)(F)F)Cc1ccccc1 ZINC000626638566 1052715902 /nfs/dbraw/zinc/71/59/02/1052715902.db2.gz OLGHDVCEDIMRTJ-UHFFFAOYSA-N -1 3 337.341 4.295 20 0 EIADHM Cc1scc(C(=O)Nc2cc(Br)ccc2[O-])c1C ZINC000180489999 1052806162 /nfs/dbraw/zinc/80/61/62/1052806162.db2.gz AVNXCOSIAJLJQD-UHFFFAOYSA-N -1 3 326.215 4.085 20 0 EIADHM [O-]c1cccc(CNCc2ccccc2CC(F)(F)F)c1Cl ZINC000623822028 1052820631 /nfs/dbraw/zinc/82/06/31/1052820631.db2.gz REXDBDWISJBFMN-UHFFFAOYSA-N -1 3 329.749 4.440 20 0 EIADHM C[C@@H](CC(=O)c1ccc(Cl)cc1)C(=O)Nc1cccc([O-])c1F ZINC000184244798 1052996398 /nfs/dbraw/zinc/99/63/98/1052996398.db2.gz BUMFBODESKCXQT-JTQLQIEISA-N -1 3 335.762 4.032 20 0 EIADHM CCCc1cc(=O)[n-]c(C(=Cc2cc(Cl)c(O)c(OC)c2)CC)n1 ZINC000193617234 1053028575 /nfs/dbraw/zinc/02/85/75/1053028575.db2.gz QBFRKFVUUPMVGG-KPKJPENVSA-N -1 3 348.830 4.041 20 0 EIADHM O=C([O-])c1ccc(CN2CCC(Cc3ccccc3Cl)CC2)o1 ZINC000864361726 1053249666 /nfs/dbraw/zinc/24/96/66/1053249666.db2.gz OZUYXCZXXBVZHE-UHFFFAOYSA-N -1 3 333.815 4.086 20 0 EIADHM Cc1ccc([N-]S(=O)(=O)c2c(C)cccc2Cl)c(Cl)c1 ZINC001195268405 1053352933 /nfs/dbraw/zinc/35/29/33/1053352933.db2.gz UCSXYBCVOQGEFI-UHFFFAOYSA-N -1 3 330.236 4.411 20 0 EIADHM Cc1ccc([O-])c(NC(=O)c2ccc(-c3ccccn3)cc2Cl)n1 ZINC001195642675 1053445283 /nfs/dbraw/zinc/44/52/83/1053445283.db2.gz QNSBHFRBRLSXAN-UHFFFAOYSA-N -1 3 339.782 4.063 20 0 EIADHM O=C(Nc1ccc(Cl)cc1[O-])[C@H](O)c1cc(Cl)cc(Cl)c1 ZINC000765221162 1053471889 /nfs/dbraw/zinc/47/18/89/1053471889.db2.gz AEMLWSJNCIRMAU-CYBMUJFWSA-N -1 3 346.597 4.025 20 0 EIADHM CC(C)c1cccc(C(C)C)c1[N-]S(=O)(=O)c1ccc(O)cc1 ZINC001195794907 1053488276 /nfs/dbraw/zinc/48/82/76/1053488276.db2.gz NZZWSOMRLNBAMI-UHFFFAOYSA-N -1 3 333.453 4.440 20 0 EIADHM CC[C@@H](C)CO[N-]C(=O)CCc1ncc(-c2ccc(Cl)cc2)o1 ZINC000794850556 1053548167 /nfs/dbraw/zinc/54/81/67/1053548167.db2.gz DQRGOBBBSHBXTM-GFCCVEGCSA-N -1 3 336.819 4.022 20 0 EIADHM Cc1cc(F)ccc1NC(=S)Nc1nc2c(cccc2[O-])s1 ZINC001196081792 1053575835 /nfs/dbraw/zinc/57/58/35/1053575835.db2.gz PVXRAXJGIWBAED-UHFFFAOYSA-N -1 3 333.413 4.258 20 0 EIADHM COc1ccccc1NC(=S)Nc1ccc(C(F)(F)F)cc1[O-] ZINC001196251841 1053619152 /nfs/dbraw/zinc/61/91/52/1053619152.db2.gz KOMOWWBXKRCSBP-UHFFFAOYSA-N -1 3 342.342 4.229 20 0 EIADHM O=C([N-]c1cc(Cl)cc(Cl)n1)c1snc(Cl)c1Cl ZINC001196334394 1053642774 /nfs/dbraw/zinc/64/27/74/1053642774.db2.gz QEELQJLVIYABTL-UHFFFAOYSA-N -1 3 343.022 4.404 20 0 EIADHM Cc1nc2c(cccc2[N-]C(=O)c2snc(Cl)c2Cl)o1 ZINC001196341274 1053645031 /nfs/dbraw/zinc/64/50/31/1053645031.db2.gz AYSNPUIKWBEXBP-UHFFFAOYSA-N -1 3 328.180 4.152 20 0 EIADHM O=C(Nc1cnc(-c2ccccc2)nc1)c1cc([O-])c2ccccc2c1 ZINC000471709298 1053690835 /nfs/dbraw/zinc/69/08/35/1053690835.db2.gz NMLQTCRHEWEGHH-UHFFFAOYSA-N -1 3 341.370 4.255 20 0 EIADHM O=C(c1cc2sccc2c([O-])c1)N1CCC[C@@H](c2cccnc2)C1 ZINC000869049200 1053958189 /nfs/dbraw/zinc/95/81/89/1053958189.db2.gz SBIYCOWAHBDODE-CQSZACIVSA-N -1 3 338.432 4.022 20 0 EIADHM O=C(c1cc2sccc2c([O-])c1)N1CCC[C@H]([C@H]2CCCCO2)C1 ZINC000855954964 1054001410 /nfs/dbraw/zinc/00/14/10/1054001410.db2.gz NJZVZQRTYAWVDM-SUMWQHHRSA-N -1 3 345.464 4.028 20 0 EIADHM O=C([N-]OCC1CCC1)[C@@H]1CC=CC[C@@H]1c1nc2ccccc2s1 ZINC000856346073 1054061102 /nfs/dbraw/zinc/06/11/02/1054061102.db2.gz NUBOBBHLSLRBHT-CABCVRRESA-N -1 3 342.464 4.194 20 0 EIADHM CC(C)(CNC(=O)c1cc2sccc2c([O-])c1)CC(F)(F)F ZINC000856517746 1054080093 /nfs/dbraw/zinc/08/00/93/1054080093.db2.gz CHVOBCJOIOLXJU-UHFFFAOYSA-N -1 3 331.359 4.315 20 0 EIADHM CC(C)(C)OC1CCC(NC(=O)c2cc3sccc3c([O-])c2)CC1 ZINC000870491130 1054103836 /nfs/dbraw/zinc/10/38/36/1054103836.db2.gz FDHCPPOCPDUZEU-UHFFFAOYSA-N -1 3 347.480 4.463 20 0 EIADHM O=C([O-])CC[C@@H](NCc1cccnc1)c1ccc(Cl)c(Cl)c1 ZINC000871065567 1054149066 /nfs/dbraw/zinc/14/90/66/1054149066.db2.gz HWIHIRZELRNJJN-OAHLLOKOSA-N -1 3 339.222 4.084 20 0 EIADHM CC(C)c1nc(CCNC(=O)c2cc([O-])c3ccccc3c2)cs1 ZINC000472027824 1054209230 /nfs/dbraw/zinc/20/92/30/1054209230.db2.gz BCKIQWDHRFMYAS-UHFFFAOYSA-N -1 3 340.448 4.098 20 0 EIADHM O=C(CCc1ccc(Cl)cc1Cl)[N-]OCc1ccc(F)cc1 ZINC000857484793 1054275052 /nfs/dbraw/zinc/27/50/52/1054275052.db2.gz KWTVTNGPEXUURY-UHFFFAOYSA-N -1 3 342.197 4.313 20 0 EIADHM O=C([O-])C1CC(NCc2c(Cl)cccc2Oc2ccccc2)C1 ZINC000871884066 1054319491 /nfs/dbraw/zinc/31/94/91/1054319491.db2.gz HTYYZCNAKDRXGS-UHFFFAOYSA-N -1 3 331.799 4.085 20 0 EIADHM COc1ccc(S(=O)(=O)[N-]c2c(C)cccc2C(C)(C)C)c(C)c1 ZINC001198950648 1054321719 /nfs/dbraw/zinc/32/17/19/1054321719.db2.gz IOIFKMDZYYEMGZ-UHFFFAOYSA-N -1 3 347.480 4.410 20 0 EIADHM O=C(OCc1coc(-c2cccs2)n1)c1cc(Cl)c(Cl)[n-]1 ZINC000011810170 1054321784 /nfs/dbraw/zinc/32/17/84/1054321784.db2.gz LGRFXBUAEWTILI-UHFFFAOYSA-N -1 3 343.191 4.395 20 0 EIADHM COc1cc(CN[C@@H](C)c2cccc([O-])c2F)ccc1OC(C)C ZINC000872020766 1054334719 /nfs/dbraw/zinc/33/47/19/1054334719.db2.gz KBKKZLJBZBKCQF-ZDUSSCGKSA-N -1 3 333.403 4.178 20 0 EIADHM C[C@H](OC(=O)c1cccc(Cl)c1[O-])c1nc(-c2ccccc2)no1 ZINC000775934301 1054340019 /nfs/dbraw/zinc/34/00/19/1054340019.db2.gz MCLLVBUFUIDHNK-JTQLQIEISA-N -1 3 344.754 4.014 20 0 EIADHM C[C@H](N[C@H]1CCc2ccccc2-n2ccnc21)c1cccc([O-])c1F ZINC000872089006 1054384934 /nfs/dbraw/zinc/38/49/34/1054384934.db2.gz XRKKZVRAUFYCKV-BBRMVZONSA-N -1 3 337.398 4.055 20 0 EIADHM C[C@H](NCc1cc(C(F)(F)F)cc(Cl)n1)c1cccc([O-])c1F ZINC000872118875 1054397363 /nfs/dbraw/zinc/39/73/63/1054397363.db2.gz KPYDPUGQMWZKFM-QMMMGPOBSA-N -1 3 348.727 4.449 20 0 EIADHM Cc1nc2c(s1)[C@@H]([N-]c1nc(-c3ccc(F)cc3)no1)CCC2 ZINC000858477402 1054497408 /nfs/dbraw/zinc/49/74/08/1054497408.db2.gz WOVODDIWHBXOJO-ZDUSSCGKSA-N -1 3 330.388 4.130 20 0 EIADHM CC(C)c1nsc([N-]C(=O)c2c(Cl)cc(F)cc2Cl)n1 ZINC000874694171 1054719634 /nfs/dbraw/zinc/71/96/34/1054719634.db2.gz HJZMPNLSEHYSKG-UHFFFAOYSA-N -1 3 334.203 4.360 20 0 EIADHM C[C@H]1CN(Cc2ccc(-c3ccccc3C(=O)[O-])o2)C[C@H](C)C1(F)F ZINC000859818894 1054737512 /nfs/dbraw/zinc/73/75/12/1054737512.db2.gz XAUMYWLPNUWKFH-STQMWFEESA-N -1 3 349.377 4.368 20 0 EIADHM Cc1ccc(-c2nc(C(=O)[N-]c3nnc(C4CC4)s3)cs2)cc1 ZINC000061046342 1054739147 /nfs/dbraw/zinc/73/91/47/1054739147.db2.gz YZNPIDPUYVIFEC-UHFFFAOYSA-N -1 3 342.449 4.100 20 0 EIADHM CCc1cc2c(nc(-c3nc(OC(C)C)ccc3Cl)[n-]c2=O)s1 ZINC000065278969 1054908847 /nfs/dbraw/zinc/90/88/47/1054908847.db2.gz KOBSEBGZEQAOST-UHFFFAOYSA-N -1 3 349.843 4.050 20 0 EIADHM O=C(OCc1cc(-c2ccccc2)no1)c1cc(Cl)c(Cl)[n-]1 ZINC000021731068 1054934122 /nfs/dbraw/zinc/93/41/22/1054934122.db2.gz ZWYUMBZYOUHDFG-UHFFFAOYSA-N -1 3 337.162 4.334 20 0 EIADHM Cc1oc2ccccc2c1CNCc1cccc([O-])c1Br ZINC001201882814 1054936603 /nfs/dbraw/zinc/93/66/03/1054936603.db2.gz YVSZWTAYIVKNCC-UHFFFAOYSA-N -1 3 346.224 4.499 20 0 EIADHM O=C(Nc1cc(F)ccc1[O-])c1cccc(SC(F)(F)F)c1 ZINC001153467126 1054989094 /nfs/dbraw/zinc/98/90/94/1054989094.db2.gz DCLAHRPXEXPDCK-UHFFFAOYSA-N -1 3 331.290 4.396 20 0 EIADHM COc1ccccc1NC(=O)Nc1c([O-])cccc1C(F)(F)F ZINC001202128031 1055042530 /nfs/dbraw/zinc/04/25/30/1055042530.db2.gz KPTRVRRYIOATSS-UHFFFAOYSA-N -1 3 326.274 4.064 20 0 EIADHM Cc1ccc([O-])c(CN[C@H](C)c2ccc(C(F)(F)F)nc2Cl)n1 ZINC000862379763 1055059460 /nfs/dbraw/zinc/05/94/60/1055059460.db2.gz OGFHTGLZKDKBAV-SECBINFHSA-N -1 3 345.752 4.014 20 0 EIADHM O=C(NCCCCCCc1ccccc1)c1cc(=O)c2ccccc2[n-]1 ZINC000862626546 1055093959 /nfs/dbraw/zinc/09/39/59/1055093959.db2.gz GSPZSYOGCANYEH-UHFFFAOYSA-N -1 3 348.446 4.061 20 0 EIADHM [O-]c1cccc(CN2CCC(c3nc(C4CCC4)no3)CC2)c1Cl ZINC000877736273 1055112387 /nfs/dbraw/zinc/11/23/87/1055112387.db2.gz SMRBAWYCATXPNO-UHFFFAOYSA-N -1 3 347.846 4.076 20 0 EIADHM Cc1ccc(CN(Cc2nnc(-c3ccccc3[O-])o2)C2CC2)cc1C ZINC000878126121 1055191909 /nfs/dbraw/zinc/19/19/09/1055191909.db2.gz OUXLOZTZHJDWTB-UHFFFAOYSA-N -1 3 349.434 4.224 20 0 EIADHM Cc1sc2[n-]c([C@@H](C)OC(=O)CC3CCCCC3)nc(=O)c2c1C ZINC000022617875 1055235084 /nfs/dbraw/zinc/23/50/84/1055235084.db2.gz IYBKVHVZCUEOLM-LLVKDONJSA-N -1 3 348.468 4.176 20 0 EIADHM CC1(C)CN(Cc2nnc(-c3ccccc3[O-])o2)[C@@H]1c1cccs1 ZINC000878621324 1055360457 /nfs/dbraw/zinc/36/04/57/1055360457.db2.gz KGLLXXXRIRRRRA-MRXNPFEDSA-N -1 3 341.436 4.087 20 0 EIADHM C[C@@H](NCc1nnc(-c2ccccc2[O-])o1)c1cccc(C2CC2)c1 ZINC000878660791 1055369245 /nfs/dbraw/zinc/36/92/45/1055369245.db2.gz ZBQGTFOPSYIFTR-CYBMUJFWSA-N -1 3 335.407 4.170 20 0 EIADHM CC[C@H](C)c1nc(C)c(CC(=O)Nc2c([O-])cccc2Cl)c(C)n1 ZINC000655110428 1055477694 /nfs/dbraw/zinc/47/76/94/1055477694.db2.gz VTGXVPPJYAPVBO-JTQLQIEISA-N -1 3 347.846 4.147 20 0 EIADHM Cc1c(C(=O)Nc2c([O-])cccc2Cl)cnn1C1CCCCC1 ZINC000655110412 1055479004 /nfs/dbraw/zinc/47/90/04/1055479004.db2.gz RGGFZLYMWDXPDP-UHFFFAOYSA-N -1 3 333.819 4.308 20 0 EIADHM CC[C@@H](N[C@H](CCO)c1ccco1)c1ccc(Cl)c(Cl)c1[O-] ZINC000186421691 1055560399 /nfs/dbraw/zinc/56/03/99/1055560399.db2.gz VZNICZABIDPZBC-CHWSQXEVSA-N -1 3 344.238 4.456 20 0 EIADHM O=C(Nc1ccccc1SC1CCCC1)c1cccc2n[n-]nc21 ZINC000542821260 1056122533 /nfs/dbraw/zinc/12/25/33/1056122533.db2.gz NEWCYCNMNABCMF-UHFFFAOYSA-N -1 3 338.436 4.245 20 0 EIADHM CCc1ccc([O-])c(C(=O)Nc2cccc(Br)c2F)c1 ZINC001168671438 1056570497 /nfs/dbraw/zinc/57/04/97/1056570497.db2.gz FAWYDULIBXFGDR-UHFFFAOYSA-N -1 3 338.176 4.109 20 0 EIADHM COC(=O)Nc1ccc(C(=O)O[C@@H](C)c2cccc(Cl)c2)cc1[O-] ZINC000745654683 1059861661 /nfs/dbraw/zinc/86/16/61/1059861661.db2.gz WBFUCSYEFBBCRO-JTQLQIEISA-N -1 3 349.770 4.142 20 0 EIADHM [O-]c1ccc(Cl)c(Nc2cc(O)ccc2Br)c1F ZINC001214559926 1060237793 /nfs/dbraw/zinc/23/77/93/1060237793.db2.gz VPNBXPATAMRUKD-UHFFFAOYSA-N -1 3 332.556 4.396 20 0 EIADHM O=C(NCc1ccco1)c1ccc(Nc2ccc(Cl)c([O-])c2)cc1 ZINC001212592276 1060875482 /nfs/dbraw/zinc/87/54/82/1060875482.db2.gz HXBNXNIADUVMOO-UHFFFAOYSA-N -1 3 342.782 4.312 20 0 EIADHM Cc1c(Cl)cc(Br)cc1NCc1ncccc1[O-] ZINC001169733268 1060936833 /nfs/dbraw/zinc/93/68/33/1060936833.db2.gz RTWKMHOVSQSCHZ-UHFFFAOYSA-N -1 3 327.609 4.124 20 0 EIADHM COC(=O)c1cc(Cl)c(Nc2ccc(Cl)c([O-])c2)cc1OC ZINC001212595267 1060992366 /nfs/dbraw/zinc/99/23/66/1060992366.db2.gz LGWKTJBZFPIBSK-UHFFFAOYSA-N -1 3 342.178 4.238 20 0 EIADHM COc1cc(CNc2cccc(Cl)c2)cc(Br)c1[O-] ZINC000019920298 212083988 /nfs/dbraw/zinc/08/39/88/212083988.db2.gz WKHBLDGODCRYIB-UHFFFAOYSA-N -1 3 342.620 4.429 20 0 EIADHM Cc1cc(Cl)ccc1[N-]S(=O)(=O)c1ccc2c(c1)CCCC2 ZINC000005126471 210394392 /nfs/dbraw/zinc/39/43/92/210394392.db2.gz XNQOUWKIZRKERA-UHFFFAOYSA-N -1 3 335.856 4.328 20 0 EIADHM Cc1noc([N-]C(=O)C(F)(F)c2cc(Cl)ccc2Cl)c1C ZINC001126358931 1033552943 /nfs/dbraw/zinc/55/29/43/1033552943.db2.gz NNPCCSGGYFVYQD-UHFFFAOYSA-N -1 3 335.137 4.329 20 0 EIADHM CC(C)Cc1nnc([N-]C(=O)c2ccc(-c3ccccc3F)o2)s1 ZINC000025445209 1032156491 /nfs/dbraw/zinc/15/64/91/1032156491.db2.gz ODXJTRIICHQPLT-UHFFFAOYSA-N -1 3 345.399 4.388 20 0 EIADHM CCCc1cc(=O)[n-]c(C(=Cc2cc3cc(OC)ccc3o2)CC)n1 ZINC000193617532 1032165169 /nfs/dbraw/zinc/16/51/69/1032165169.db2.gz CCFMOGFNTJBNSK-LCYFTJDESA-N -1 3 338.407 4.428 20 0 EIADHM Cc1nc(-c2ccc(NC(=O)N[C@@H](C)CC(C)(C)C)cc2)cc(=O)[n-]1 ZINC000454362087 1032294658 /nfs/dbraw/zinc/29/46/58/1032294658.db2.gz QWAYQWLEQOIVKZ-LBPRGKRZSA-N -1 3 342.443 4.104 20 0 EIADHM O=C([N-]c1nc(-c2ccco2)cs1)c1c(F)c(F)cc(F)c1F ZINC000175647858 1032432818 /nfs/dbraw/zinc/43/28/18/1032432818.db2.gz PGPNKFDWSCHMKW-UHFFFAOYSA-N -1 3 342.273 4.212 20 0 EIADHM Cc1ccc(C(=O)Nc2cc(Br)ccc2[O-])c(C(C)C)n1 ZINC000450403500 1032483458 /nfs/dbraw/zinc/48/34/58/1032483458.db2.gz MEWVEGCRTAQYFG-UHFFFAOYSA-N -1 3 349.228 4.234 20 0 EIADHM O=C(Cc1ccc([O-])c(F)c1)NC1CCC(c2ccc(F)cc2)CC1 ZINC000450529025 1032546809 /nfs/dbraw/zinc/54/68/09/1032546809.db2.gz LWNOBXLGGUGNIW-UHFFFAOYSA-N -1 3 345.389 4.056 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(NC[C@H]3CCCCC3(F)F)nc2)n1 ZINC000450578551 1032565126 /nfs/dbraw/zinc/56/51/26/1032565126.db2.gz AUSIQSFTLALFJD-CYBMUJFWSA-N -1 3 348.397 4.044 20 0 EIADHM CC(C)c1cc(Cl)ccc1NC(=O)c1cc(=O)[n-]c(C2CC2)n1 ZINC000529850834 1032636080 /nfs/dbraw/zinc/63/60/80/1032636080.db2.gz BLNMPNVTUQDYAX-UHFFFAOYSA-N -1 3 331.803 4.089 20 0 EIADHM COc1cc(C)c(S(=O)(=O)[N-]c2cc(C)ccc2C)cc1Cl ZINC000432777195 1032765068 /nfs/dbraw/zinc/76/50/68/1032765068.db2.gz UDDVAFZWPLMDSP-UHFFFAOYSA-N -1 3 339.844 4.075 20 0 EIADHM C[C@@]1(CNC(=O)c2cc3sccc3c([O-])c2)CCOC2(CCC2)C1 ZINC000924285524 1018796963 /nfs/dbraw/zinc/79/69/63/1018796963.db2.gz CIYGWKRTEIUGDY-GOSISDBHSA-N -1 3 345.464 4.076 20 0 EIADHM O=C1CCCCC[C@@H]1Sc1nnc([N-]c2ccccc2F)s1 ZINC000029328631 1019018213 /nfs/dbraw/zinc/01/82/13/1019018213.db2.gz IMYDOUUZNAXNGO-ZDUSSCGKSA-N -1 3 337.445 4.415 20 0 EIADHM C[C@@H](CCC[C@H](C)C(=O)[O-])NCc1c(Cl)cccc1OC(F)F ZINC000683170301 1019083721 /nfs/dbraw/zinc/08/37/21/1019083721.db2.gz JDVXVQBTXLLWMR-QWRGUYRKSA-N -1 3 349.805 4.311 20 0 EIADHM CC(=O)c1cccc(NC(=O)c2ccc(OC(C)(C)C)cc2)c1[O-] ZINC000147608538 1019168371 /nfs/dbraw/zinc/16/83/71/1019168371.db2.gz GVEPIHQCGJYVLC-UHFFFAOYSA-N -1 3 327.380 4.024 20 0 EIADHM CC[C@@H]([N-]S(=O)(=O)c1c(F)cccc1F)c1ccc(Cl)cc1 ZINC000021871555 1032829731 /nfs/dbraw/zinc/82/97/31/1032829731.db2.gz GQCSLRGQUDOUCM-CQSZACIVSA-N -1 3 345.798 4.048 20 0 EIADHM CC(=O)c1ccc(C(=O)N(Cc2cccc(C)c2)CC(C)C)cc1[O-] ZINC001625818087 1019860724 /nfs/dbraw/zinc/86/07/24/1019860724.db2.gz PNLMOBOJFGZPEB-UHFFFAOYSA-N -1 3 339.435 4.202 20 0 EIADHM CCN(C(=O)c1cc2sccc2c([O-])c1)c1ccccc1OC ZINC001625821559 1019878798 /nfs/dbraw/zinc/87/87/98/1019878798.db2.gz SFKZPGVIUYFDMC-UHFFFAOYSA-N -1 3 327.405 4.282 20 0 EIADHM Cc1nc(-c2ccc(CNC(=O)c3cc([O-])ccc3Cl)o2)cs1 ZINC000339878586 1020005855 /nfs/dbraw/zinc/00/58/55/1020005855.db2.gz LLOHLQRMZQRTKO-UHFFFAOYSA-N -1 3 348.811 4.001 20 0 EIADHM CCCOCc1nc(=O)c2c([n-]1)sc(C)c2-c1ccc(F)cc1 ZINC000060090495 1020022027 /nfs/dbraw/zinc/02/20/27/1020022027.db2.gz RESHCOHCPCNHNM-UHFFFAOYSA-N -1 3 332.400 4.026 20 0 EIADHM O=C(N[C@H]1CC[C@@H](c2ccc(F)cc2)C1)c1cc([O-])ccc1Cl ZINC000510154991 1020028733 /nfs/dbraw/zinc/02/87/33/1020028733.db2.gz SSQUHONJEKDJCA-OCCSQVGLSA-N -1 3 333.790 4.251 20 0 EIADHM Cc1cc(S(=O)(=O)[N-]c2c(C)cccc2F)c(Cl)cc1F ZINC000180743272 1020173862 /nfs/dbraw/zinc/17/38/62/1020173862.db2.gz JWTORTJWKAZGHG-UHFFFAOYSA-N -1 3 331.771 4.036 20 0 EIADHM CCCCCCOc1ccc(C(=O)Nc2ncccc2[O-])cc1OC ZINC000021901755 1020189757 /nfs/dbraw/zinc/18/97/57/1020189757.db2.gz OJMBJVROOIZLTF-UHFFFAOYSA-N -1 3 344.411 4.007 20 0 EIADHM CCc1cc(=O)[n-]c(CN(Cc2ccc3ccccc3c2)C2CC2)n1 ZINC001167164791 1020448161 /nfs/dbraw/zinc/44/81/61/1020448161.db2.gz WAUYXVLJHRIZKX-UHFFFAOYSA-N -1 3 333.435 4.062 20 0 EIADHM Cc1ccc2c(c1)CC[C@H]2[N-]C(=O)C(F)(F)c1cc(F)cc(F)c1 ZINC001125351788 1020731083 /nfs/dbraw/zinc/73/10/83/1020731083.db2.gz MIZHZPIYVPOBBC-MRXNPFEDSA-N -1 3 337.316 4.169 20 0 EIADHM CCc1cccc(C(=O)N2CC[C@H](CSc3ccccc3)C2)c1[O-] ZINC000530957658 1021174305 /nfs/dbraw/zinc/17/43/05/1021174305.db2.gz AUJMPJCSJGSWLR-HNNXBMFYSA-N -1 3 341.476 4.209 20 0 EIADHM CC(=O)c1ccc(C(=O)N2C[C@H](c3ccccc3)C3(CCC3)C2)cc1[O-] ZINC000412679805 1021250439 /nfs/dbraw/zinc/25/04/39/1021250439.db2.gz RXTAMLYGXZAUNX-LJQANCHMSA-N -1 3 349.430 4.005 20 0 EIADHM Cc1cc(C(=O)Nc2cc(Cl)ccc2[O-])c(C)n1C1CCOCC1 ZINC000612754448 1021343910 /nfs/dbraw/zinc/34/39/10/1021343910.db2.gz MDRLRYNNDKNLSE-UHFFFAOYSA-N -1 3 348.830 4.068 20 0 EIADHM O=c1cc(C(F)(F)F)nc(C=Cc2cnc(C3CCC3)s2)[n-]1 ZINC000656106035 1021548859 /nfs/dbraw/zinc/54/88/59/1021548859.db2.gz IVNJGEDVDSLWQX-SNAWJCMRSA-N -1 3 327.331 4.095 20 0 EIADHM CC(=O)Nc1ccc([O-])c(C(=O)N2CC[C@H](CC(C)(C)C)C2(C)C)c1 ZINC000413980869 1021564858 /nfs/dbraw/zinc/56/48/58/1021564858.db2.gz DYNYTFJJSFTJCO-CQSZACIVSA-N -1 3 346.471 4.028 20 0 EIADHM Cc1nc(-c2ccc(NC(=O)N(C)[C@@H](C)C(C)(C)C)cc2)cc(=O)[n-]1 ZINC000613041769 1021656212 /nfs/dbraw/zinc/65/62/12/1021656212.db2.gz ZIRHSHJTDMBDCE-LBPRGKRZSA-N -1 3 342.443 4.056 20 0 EIADHM O=C([N-]c1nnc(/C=C\c2ccco2)s1)c1ccc(Cl)s1 ZINC000255208132 1021775395 /nfs/dbraw/zinc/77/53/95/1021775395.db2.gz MQFYGUKTSHTRHV-UTCJRWHESA-N -1 3 337.813 4.269 20 0 EIADHM Fc1c(F)c([N-]c2nccs2)c(F)c(F)c1Br ZINC001210992007 1021903647 /nfs/dbraw/zinc/90/36/47/1021903647.db2.gz NBMNOBLIGNNNJB-UHFFFAOYSA-N -1 3 327.100 4.206 20 0 EIADHM C[C@@H](c1ccccc1Br)N1CCC[C@H](CCC(=O)[O-])C1 ZINC000086809573 1021979511 /nfs/dbraw/zinc/97/95/11/1021979511.db2.gz CTKQASCBTLOYRI-QWHCGFSZSA-N -1 3 340.261 4.087 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)C1CCC(c2ccccc2)CC1 ZINC000174210047 1022030523 /nfs/dbraw/zinc/03/05/23/1022030523.db2.gz PCMLRQOTUJHXBZ-UHFFFAOYSA-N -1 3 327.399 4.122 20 0 EIADHM Cc1ccc(OC[C@@H](C)NC(=O)c2ccc(C(C)C)cc2[O-])cc1 ZINC001625865969 1022160559 /nfs/dbraw/zinc/16/05/59/1022160559.db2.gz LFNRYYJDQLFYMO-OAHLLOKOSA-N -1 3 327.424 4.021 20 0 EIADHM CCCc1cc(=O)[n-]c(C(=Cc2cc3c(c(Cl)c2)OCO3)CC)n1 ZINC000684033489 1022398427 /nfs/dbraw/zinc/39/84/27/1022398427.db2.gz NIPDVIIBBKUACX-SDQBBNPISA-N -1 3 346.814 4.055 20 0 EIADHM [O-]c1cc(F)cc(CNCc2nc(-c3ccccc3F)cs2)c1 ZINC000378131276 1022403576 /nfs/dbraw/zinc/40/35/76/1022403576.db2.gz UWUMZKDCNDYVHK-UHFFFAOYSA-N -1 3 332.375 4.084 20 0 EIADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)C(C)(C)C(C)C)c2)n1 ZINC000275948476 1022454504 /nfs/dbraw/zinc/45/45/04/1022454504.db2.gz UDDHSVDMVDAMPW-UHFFFAOYSA-N -1 3 327.428 4.032 20 0 EIADHM CCCCCC[C@@](C)(CCC)C(=O)N1CCCc2c(=O)[n-]cnc21 ZINC000893215527 1022764306 /nfs/dbraw/zinc/76/43/06/1022764306.db2.gz HWZOJAOKXTZMIR-LJQANCHMSA-N -1 3 333.476 4.238 20 0 EIADHM O=C(Nc1cccc([O-])c1F)c1cc2cc(Br)ccc2[nH]1 ZINC000128210790 1022832019 /nfs/dbraw/zinc/83/20/19/1022832019.db2.gz OVJALQLGBSYYSD-UHFFFAOYSA-N -1 3 349.159 4.027 20 0 EIADHM O=C(Nc1nc(C(F)(F)F)cs1)c1cc([O-])c2ccccc2c1 ZINC000581159966 1022860446 /nfs/dbraw/zinc/86/04/46/1022860446.db2.gz FSDSIGFLHZAHIM-UHFFFAOYSA-N -1 3 338.310 4.273 20 0 EIADHM C[C@H](NC(=O)c1cc([O-])ccc1Cl)c1ccc(OC(F)F)cc1 ZINC000431894709 1022942342 /nfs/dbraw/zinc/94/23/42/1022942342.db2.gz SUSSXCNWAMQFNO-VIFPVBQESA-N -1 3 341.741 4.138 20 0 EIADHM O=C(CSc1ccc2ccccc2c1)Nc1cccc([O-])c1F ZINC000128708195 1023008250 /nfs/dbraw/zinc/00/82/50/1023008250.db2.gz SKANBCAURJOOQM-UHFFFAOYSA-N -1 3 327.380 4.415 20 0 EIADHM CCC(C)(C)OCc1ccccc1NCc1cc(=O)[n-]c(C2CC2)n1 ZINC000417020145 1023112080 /nfs/dbraw/zinc/11/20/80/1023112080.db2.gz FESJMAZENIOXIE-UHFFFAOYSA-N -1 3 341.455 4.377 20 0 EIADHM O=S(=O)([N-]c1ccc(-c2ccccc2)cc1F)c1cccc(F)c1 ZINC000031721653 1023180313 /nfs/dbraw/zinc/18/03/13/1023180313.db2.gz XMQXHYTVMUPJFC-UHFFFAOYSA-N -1 3 345.370 4.433 20 0 EIADHM C[C@@H]1C[C@H]1c1ccc(CN2CCC(C(=O)c3ccc([O-])cc3)CC2)o1 ZINC000124039022 1023193306 /nfs/dbraw/zinc/19/33/06/1023193306.db2.gz ZQGNLVIWDMHNHY-AUUYWEPGSA-N -1 3 339.435 4.204 20 0 EIADHM Cc1cccc(-c2noc(C=C([O-])c3ccccc3Cl)n2)c1C ZINC001211647481 1023227609 /nfs/dbraw/zinc/22/76/09/1023227609.db2.gz RKKYLMDKNINHFX-UHFFFAOYSA-N -1 3 326.783 4.432 20 0 EIADHM O=C(c1ccc(O)cc1[O-])N1CCCCC[C@@H]1/C=C/c1cccs1 ZINC000180922201 1023230610 /nfs/dbraw/zinc/23/06/10/1023230610.db2.gz OSPFHHVUXDMMSL-RCQQVGEISA-N -1 3 343.448 4.258 20 0 EIADHM Cc1ccc(OC2CCN(Cc3cccc(C(=O)[O-])c3)CC2)cc1C ZINC000414634008 1023306968 /nfs/dbraw/zinc/30/69/68/1023306968.db2.gz ANLRHNNAVXTUAC-UHFFFAOYSA-N -1 3 339.435 4.045 20 0 EIADHM COc1cccc([C@@H](CC(=O)[O-])NCc2ccc(C3CCC3)cc2)c1 ZINC000417580440 1023363711 /nfs/dbraw/zinc/36/37/11/1023363711.db2.gz FCYZZVZNGHBISD-HXUWFJFHSA-N -1 3 339.435 4.268 20 0 EIADHM COc1ccc([C@H](CCC(=O)[O-])NCc2sccc2Cl)cc1 ZINC000417582275 1023364103 /nfs/dbraw/zinc/36/41/03/1023364103.db2.gz VAYOFTYIEXOFQH-AWEZNQCLSA-N -1 3 339.844 4.106 20 0 EIADHM COc1ccc2oc(CN[C@@H](CCC(=O)[O-])c3ccccc3)cc2c1 ZINC000417605085 1023368915 /nfs/dbraw/zinc/36/89/15/1023368915.db2.gz XCYLXCNQKKHMQD-SFHVURJKSA-N -1 3 339.391 4.137 20 0 EIADHM CC(C)=CCSC[C@@H](NCc1cccc(Cl)c1Cl)C(=O)[O-] ZINC000417625765 1023386325 /nfs/dbraw/zinc/38/63/25/1023386325.db2.gz MSXYWZMIINJPSR-CYBMUJFWSA-N -1 3 348.295 4.236 20 0 EIADHM O=C([O-])[C@@H]1C[C@@H](NCc2cscc2C(F)(F)F)c2ccccc21 ZINC000417626046 1023386451 /nfs/dbraw/zinc/38/64/51/1023386451.db2.gz MNUDYOFJKVKBLS-TZMCWYRMSA-N -1 3 341.354 4.170 20 0 EIADHM COc1cccc(Cl)c1CNCCC1(CC(=O)[O-])CCCCC1 ZINC000417644665 1023394669 /nfs/dbraw/zinc/39/46/69/1023394669.db2.gz CNWDZSHSWKVEJY-UHFFFAOYSA-N -1 3 339.863 4.254 20 0 EIADHM Cc1cc(CNCc2cccc(OCC(C)C)c2)ccc1C(=O)[O-] ZINC000417674313 1023403916 /nfs/dbraw/zinc/40/39/16/1023403916.db2.gz YUXOOZOOPRNLAQ-UHFFFAOYSA-N -1 3 327.424 4.018 20 0 EIADHM CC(C)O[C@H](CN1CC[C@H](C(=O)[O-])[C@@H]2CCCC[C@@H]21)c1ccccc1 ZINC000656767169 1023506855 /nfs/dbraw/zinc/50/68/55/1023506855.db2.gz RRLLQTNHKAQFJW-LWYYNNOASA-N -1 3 345.483 4.118 20 0 EIADHM O=C([O-])[C@@H]1CCN(Cc2csc(C3CCCC3)n2)[C@H]2CCCC[C@H]12 ZINC000656767370 1023507533 /nfs/dbraw/zinc/50/75/33/1023507533.db2.gz UXDIXJOHNNXXCB-ZACQAIPSSA-N -1 3 348.512 4.266 20 0 EIADHM CC(C)O[C@H](CN1CC[C@H](C(=O)[O-])[C@H]2CCCC[C@H]21)c1ccccc1 ZINC000656767167 1023507581 /nfs/dbraw/zinc/50/75/81/1023507581.db2.gz RRLLQTNHKAQFJW-IYWMVGAKSA-N -1 3 345.483 4.118 20 0 EIADHM Cc1cc(CN2CC[C@H](C(=O)[O-])[C@@H]3CCCC[C@H]32)c2ccccc2n1 ZINC000656766101 1023510323 /nfs/dbraw/zinc/51/03/23/1023510323.db2.gz QCLKCVNRZJFVMK-CMKODMSKSA-N -1 3 338.451 4.009 20 0 EIADHM Cc1cc(F)cc2c(=O)c(C(=O)Nc3cccc(C(F)F)c3)c[n-]c12 ZINC000341301737 1023552081 /nfs/dbraw/zinc/55/20/81/1023552081.db2.gz ZCFDJMVSRJUAFP-UHFFFAOYSA-N -1 3 346.308 4.166 20 0 EIADHM CC(C)c1ccc2cc(C(=O)Nc3n[n-]c(-c4ccccn4)n3)[nH]c2c1 ZINC000053527469 1023606414 /nfs/dbraw/zinc/60/64/14/1023606414.db2.gz QLCPEZNYXNEWBR-UHFFFAOYSA-N -1 3 346.394 4.108 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2ccc(COC(C)C)cc2)cc1C ZINC000511712076 1023836646 /nfs/dbraw/zinc/83/66/46/1023836646.db2.gz LDVSSEPBGMEXAH-UHFFFAOYSA-N -1 3 333.453 4.029 20 0 EIADHM O=C(N[C@H]1C[C@H](c2cccc(Cl)c2)C1)c1cc([O-])ccc1Cl ZINC000511723603 1023838592 /nfs/dbraw/zinc/83/85/92/1023838592.db2.gz QXEYUKQUTFGCBW-AULYBMBSSA-N -1 3 336.218 4.375 20 0 EIADHM CC(C)(C(=O)Nc1ccc(Br)cc1[O-])c1ccccc1 ZINC000642323265 1023994151 /nfs/dbraw/zinc/99/41/51/1023994151.db2.gz APTUJHHPQNKCGM-UHFFFAOYSA-N -1 3 334.213 4.071 20 0 EIADHM O=[S@@](Cc1coc(-c2ccc(Cl)cc2)n1)c1ccc([O-])cc1 ZINC000341746860 1024571450 /nfs/dbraw/zinc/57/14/50/1024571450.db2.gz ZDVHJCFLZHWNNA-QFIPXVFZSA-N -1 3 333.796 4.008 20 0 EIADHM C[C@@H](c1ccc(Cl)cc1)[C@H](C)N(C)Cc1nc(C(=O)[O-])cs1 ZINC000652429382 1024826158 /nfs/dbraw/zinc/82/61/58/1024826158.db2.gz NMIRGJPJIFWECU-MNOVXSKESA-N -1 3 338.860 4.119 20 0 EIADHM Cc1cc([C@@H](C)N2C[C@]3(C[C@@H]4CC[C@H]3C4)OC(C)(C)C2)oc1C(=O)[O-] ZINC000652447108 1024837147 /nfs/dbraw/zinc/83/71/47/1024837147.db2.gz PUOJRSWMEXYAIL-ZOZBEKFXSA-N -1 3 347.455 4.017 20 0 EIADHM CC[C@H](c1ccc(Cl)cc1)N1CCC(n2cc(C(=O)[O-])cn2)CC1 ZINC000652505966 1024859482 /nfs/dbraw/zinc/85/94/82/1024859482.db2.gz YUHLOXJUDKMEJN-QGZVFWFLSA-N -1 3 347.846 4.023 20 0 EIADHM COc1cccc([O-])c1C(=O)NCCc1cccc(-c2ccccc2)c1 ZINC001167788075 1024881164 /nfs/dbraw/zinc/88/11/64/1024881164.db2.gz YVVAKVFXLBJZLS-UHFFFAOYSA-N -1 3 347.414 4.040 20 0 EIADHM CC1(C)CC[C@@H](NC(=O)Cc2ccc([O-])c(F)c2)c2ccccc21 ZINC001625907330 1025057519 /nfs/dbraw/zinc/05/75/19/1025057519.db2.gz FONLUNRZOSGGPL-QGZVFWFLSA-N -1 3 327.399 4.003 20 0 EIADHM CCc1ccc([O-])c(C(=O)N(C)c2ccc(-c3nccs3)cc2)c1 ZINC001625915939 1025607772 /nfs/dbraw/zinc/60/77/72/1025607772.db2.gz ITKCLULAXYLSNQ-UHFFFAOYSA-N -1 3 338.432 4.355 20 0 EIADHM O=C(c1ccccc1[O-])N1CCC(c2c[nH]c3cc(F)ccc32)CC1 ZINC000111632536 1025725823 /nfs/dbraw/zinc/72/58/23/1025725823.db2.gz CNWXMYXMIMHUSS-UHFFFAOYSA-N -1 3 338.382 4.032 20 0 EIADHM CCS[C@@H]1CCCCN(C(=O)c2cc([O-])c3ccccc3c2)C1 ZINC000472091422 1025744697 /nfs/dbraw/zinc/74/46/97/1025744697.db2.gz ZFWGSWHCMRCQOC-MRXNPFEDSA-N -1 3 329.465 4.293 20 0 EIADHM O=S(=O)([N-]c1ccc(C(F)(F)F)cc1Cl)c1ccsc1 ZINC000506812997 1025807607 /nfs/dbraw/zinc/80/76/07/1025807607.db2.gz DMKFMCZQGAUFKC-UHFFFAOYSA-N -1 3 341.763 4.221 20 0 EIADHM O=C(c1ccc([O-])cc1)C1CCN(Cc2ccc(Cl)cc2)CC1 ZINC000261369327 1025823098 /nfs/dbraw/zinc/82/30/98/1025823098.db2.gz JYVWRZDQLTWLJJ-UHFFFAOYSA-N -1 3 329.827 4.141 20 0 EIADHM C[C@H]1SCCN(Cc2c(C(=O)[O-])sc3cccc(F)c32)[C@@H]1C ZINC000317238055 1025843305 /nfs/dbraw/zinc/84/33/05/1025843305.db2.gz VXAKGLRJEZMYJT-NXEZZACHSA-N -1 3 339.457 4.064 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2ccc(Cl)cc2F)cc1Cl ZINC000048653029 1026028645 /nfs/dbraw/zinc/02/86/45/1026028645.db2.gz QPVZFYDAFJQTBH-UHFFFAOYSA-N -1 3 334.199 4.242 20 0 EIADHM CCOc1ccc2cc(C(=O)Nc3cc(Cl)ccc3[O-])[nH]c2c1 ZINC000111210735 1026098327 /nfs/dbraw/zinc/09/83/27/1026098327.db2.gz AIQBRWFSZHANPM-UHFFFAOYSA-N -1 3 330.771 4.178 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1c[nH]nc1-c1ccc(Cl)cc1 ZINC000111210522 1026098591 /nfs/dbraw/zinc/09/85/91/1026098591.db2.gz RLZQMEOSVDFVGT-UHFFFAOYSA-N -1 3 348.189 4.341 20 0 EIADHM CC1(C)[C@H](Oc2ccccc2)C[C@@H]1NC(=O)c1cc([O-])ccc1Cl ZINC000519560992 1026254738 /nfs/dbraw/zinc/25/47/38/1026254738.db2.gz PVPGDVAETALFMM-DLBZAZTESA-N -1 3 345.826 4.022 20 0 EIADHM O=C([O-])c1ccc(CN2CCC(Cc3ccccc3F)CC2)c(F)c1 ZINC000563282318 1026328900 /nfs/dbraw/zinc/32/89/00/1026328900.db2.gz JBLGKNNKICBRPY-UHFFFAOYSA-N -1 3 345.389 4.118 20 0 EIADHM CO[C@H](c1ccccc1Cl)[C@@H](C)NCc1c(F)ccc([O-])c1F ZINC000512216081 1026489697 /nfs/dbraw/zinc/48/96/97/1026489697.db2.gz ADUDVOGXVIOVFR-QGHHPUGFSA-N -1 3 341.785 4.190 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)N[C@H]1CCSc2ccccc21 ZINC000344704164 1026547569 /nfs/dbraw/zinc/54/75/69/1026547569.db2.gz LZDNFSDQLWQKAJ-INIZCTEOSA-N -1 3 345.439 4.207 20 0 EIADHM CN(Cc1ccc(Br)cc1)Cc1c(F)ccc([O-])c1F ZINC000506966761 1026565812 /nfs/dbraw/zinc/56/58/12/1026565812.db2.gz YYZVNSRZDGGBFX-UHFFFAOYSA-N -1 3 342.183 4.065 20 0 EIADHM CCOc1cccc(CN[C@H](CC(=O)[O-])c2cccc(Cl)c2)c1 ZINC000426803707 1026571679 /nfs/dbraw/zinc/57/16/79/1026571679.db2.gz OQVKPYHDKUGSJB-QGZVFWFLSA-N -1 3 333.815 4.044 20 0 EIADHM CC(C)Oc1ccc(CN[C@H](CC(=O)[O-])c2cccc(Cl)c2)cc1 ZINC000426820703 1026579212 /nfs/dbraw/zinc/57/92/12/1026579212.db2.gz MQAUSDGEDUOTMQ-GOSISDBHSA-N -1 3 347.842 4.433 20 0 EIADHM O=C([O-])[C@H](NCc1ccc(Cl)c(Cl)c1)c1cccc(F)c1 ZINC000426820114 1026579401 /nfs/dbraw/zinc/57/94/01/1026579401.db2.gz YAUHFUPHANNJJR-CQSZACIVSA-N -1 3 328.170 4.048 20 0 EIADHM [O-]c1cccc(CN2CCC[C@H]2c2ccc3c(c2)OCCO3)c1Cl ZINC000506995645 1026581671 /nfs/dbraw/zinc/58/16/71/1026581671.db2.gz VNESZZLRBVZYAW-HNNXBMFYSA-N -1 3 345.826 4.154 20 0 EIADHM COc1cc(NCc2c(F)ccc([O-])c2F)cc(OC)c1C(C)C ZINC000512251576 1026583856 /nfs/dbraw/zinc/58/38/56/1026583856.db2.gz HNWFYLKNPYUSHG-UHFFFAOYSA-N -1 3 337.366 4.423 20 0 EIADHM COc1ccc([C@@H]2CCCN2Cc2c(F)ccc([O-])c2F)c(OC)c1 ZINC000507025651 1026594967 /nfs/dbraw/zinc/59/49/67/1026594967.db2.gz JUUPPQVICVXLQQ-INIZCTEOSA-N -1 3 349.377 4.025 20 0 EIADHM C[C@H](c1nc2ccccc2s1)N(C)Cc1c(F)ccc([O-])c1F ZINC000507022295 1026600747 /nfs/dbraw/zinc/60/07/47/1026600747.db2.gz NNIVZUSXDYRJFN-SNVBAGLBSA-N -1 3 334.391 4.473 20 0 EIADHM [O-]c1cc2ccccc2cc1-c1nc(Cc2c(F)cccc2F)no1 ZINC000436887430 1026653073 /nfs/dbraw/zinc/65/30/73/1026653073.db2.gz JTHQYYQQPRUILW-UHFFFAOYSA-N -1 3 338.313 4.464 20 0 EIADHM COc1c(Br)cc(F)cc1Nc1ccc([O-])c(F)c1F ZINC001211712606 1026728413 /nfs/dbraw/zinc/72/84/13/1026728413.db2.gz PIPWNXSSDDRBSG-UHFFFAOYSA-N -1 3 348.118 4.324 20 0 EIADHM CC(C)[C@@H]1C[C@@H](NC(=O)c2cc(=O)c3ccccc3[n-]2)c2ccccc21 ZINC000344983576 1026736407 /nfs/dbraw/zinc/73/64/07/1026736407.db2.gz QRJFLTHGIVHZLT-PKOBYXMFSA-N -1 3 346.430 4.143 20 0 EIADHM O=c1ccnc(C(=Cc2ccc(F)cc2Cl)Cc2ccccc2)[n-]1 ZINC000432699391 1026789821 /nfs/dbraw/zinc/78/98/21/1026789821.db2.gz YBHZOKFMXJSERI-PTNGSMBKSA-N -1 3 340.785 4.346 20 0 EIADHM CCC[C@@H]1CCCCN1Cc1coc(-c2ccc(C(=O)[O-])cc2)n1 ZINC000582612228 1026858211 /nfs/dbraw/zinc/85/82/11/1026858211.db2.gz RGIMZVZKAGDIEX-QGZVFWFLSA-N -1 3 328.412 4.194 20 0 EIADHM O=C(c1ccccc1[O-])N(Cc1cccs1)Cc1cccs1 ZINC000013831427 1027479151 /nfs/dbraw/zinc/47/91/51/1027479151.db2.gz HTWHVNLIQARKRA-UHFFFAOYSA-N -1 3 329.446 4.358 20 0 EIADHM COc1ccc(CCCCCC(=O)[N-]OCc2ccccc2)cc1 ZINC000303202453 1027511965 /nfs/dbraw/zinc/51/19/65/1027511965.db2.gz OWHPPMAEOIKRJR-UHFFFAOYSA-N -1 3 327.424 4.046 20 0 EIADHM CCc1ccccc1[N-]S(=O)(=O)c1ccc(OC(C)C)c(C)c1 ZINC000614752756 1027532538 /nfs/dbraw/zinc/53/25/38/1027532538.db2.gz SXOKAWZAHSDEOD-UHFFFAOYSA-N -1 3 333.453 4.145 20 0 EIADHM CC(C)[C@@H]1C[C@H](CC(=O)Nc2ccc([O-])c(C(F)(F)F)c2)CCO1 ZINC000330809623 1027888073 /nfs/dbraw/zinc/88/80/73/1027888073.db2.gz LHAIQIUCLNSKLF-ABAIWWIYSA-N -1 3 345.361 4.191 20 0 EIADHM O=C(c1cc(CCc2ccccc2)ccc1[O-])N1CCCC12CCC2 ZINC000444617147 1027889808 /nfs/dbraw/zinc/88/98/08/1027889808.db2.gz FZKIFPSKGDPJKR-UHFFFAOYSA-N -1 3 335.447 4.336 20 0 EIADHM [O-]c1cccc(CN[C@H](c2ccccc2)C2(CO)CC=CC2)c1Cl ZINC000648068947 1027960918 /nfs/dbraw/zinc/96/09/18/1027960918.db2.gz JKIMQLQMJVVWSY-LJQANCHMSA-N -1 3 343.854 4.205 20 0 EIADHM Cc1cc(=O)[n-]c(-c2ccc(NC(=O)CC3(C)CCCCC3)cc2)n1 ZINC000127067734 1028017029 /nfs/dbraw/zinc/01/70/29/1028017029.db2.gz WDZRHNHWLVMLDU-UHFFFAOYSA-N -1 3 339.439 4.044 20 0 EIADHM O=C([O-])c1ccc(Cl)c(CN2CCC[C@@H]2Cc2cccc(F)c2)c1 ZINC000583147822 1028088836 /nfs/dbraw/zinc/08/88/36/1028088836.db2.gz QMQCQZCCPHZYPD-QGZVFWFLSA-N -1 3 347.817 4.384 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)N[C@H]1CCCC[C@@H]1c1ccccc1 ZINC000523462697 1028132801 /nfs/dbraw/zinc/13/28/01/1028132801.db2.gz JTJPPFUEUUAJNA-AEFFLSMTSA-N -1 3 342.414 4.057 20 0 EIADHM CCc1ccc([C@@H](NC(=O)NCc2ccc([O-])c(F)c2)C(C)C)cc1 ZINC000523470860 1028136365 /nfs/dbraw/zinc/13/63/65/1028136365.db2.gz QTLLZQRFMYPCEM-IBGZPJMESA-N -1 3 344.430 4.290 20 0 EIADHM CCSc1ccc(-c2noc(-c3cc(OC)ccc3[O-])n2)cc1 ZINC000324199080 1028190477 /nfs/dbraw/zinc/19/04/77/1028190477.db2.gz QDAWQFZXNFNWNV-UHFFFAOYSA-N -1 3 328.393 4.230 20 0 EIADHM CC1(C)C[C@H](NC(=O)c2cc([O-])ccc2Cl)c2ccc(F)cc2O1 ZINC000343099228 1028207255 /nfs/dbraw/zinc/20/72/55/1028207255.db2.gz NAAKEBPWZGVKED-HNNXBMFYSA-N -1 3 349.789 4.217 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)N[C@@H]1CCCc2sccc21 ZINC000346261251 1028354554 /nfs/dbraw/zinc/35/45/54/1028354554.db2.gz YXKNLUOWPCYRDS-OAHLLOKOSA-N -1 3 333.428 4.109 20 0 EIADHM O=S(=O)([N-]c1cc(Cl)ccc1F)c1ccc(F)c(Cl)c1 ZINC000016123504 1028660222 /nfs/dbraw/zinc/66/02/22/1028660222.db2.gz NBULBCNFJCOTKY-UHFFFAOYSA-N -1 3 338.162 4.072 20 0 EIADHM O=S(=O)([N-]c1cc(F)ccc1F)c1ccc(Cl)c(Cl)c1 ZINC000016129378 1028785232 /nfs/dbraw/zinc/78/52/32/1028785232.db2.gz KOANSENXRSZJOT-UHFFFAOYSA-N -1 3 338.162 4.072 20 0 EIADHM Cc1ccc(-c2nc(Cn3c4ccccc4nc3C(C)C)no2)c([O-])c1 ZINC000445655375 1028830134 /nfs/dbraw/zinc/83/01/34/1028830134.db2.gz FREBQSFSPZPKCH-UHFFFAOYSA-N -1 3 348.406 4.272 20 0 EIADHM O=C(Nc1cnn(-c2ccc(Cl)cc2)c1)c1cc([O-])ccc1Cl ZINC000347182314 1028908039 /nfs/dbraw/zinc/90/80/39/1028908039.db2.gz KQITZZBLAGOLFD-UHFFFAOYSA-N -1 3 348.189 4.137 20 0 EIADHM O=c1nc([C@H]2CSc3ccccc3O2)[n-]c2sc3c(c21)CCC3 ZINC000685189908 1029091938 /nfs/dbraw/zinc/09/19/38/1029091938.db2.gz ZXOXCBYZLMVDEL-LLVKDONJSA-N -1 3 342.445 4.111 20 0 EIADHM C[C@@H](Oc1cccc2ccccc21)C(=O)Nc1cc(F)ccc1[O-] ZINC000444330302 1029382251 /nfs/dbraw/zinc/38/22/51/1029382251.db2.gz RLWOQQHKZIIQFI-GFCCVEGCSA-N -1 3 325.339 4.091 20 0 EIADHM Cc1ccc(C(=O)Nc2ccc(OC(F)F)c(Cl)c2)c([O-])c1 ZINC000216576793 1029521898 /nfs/dbraw/zinc/52/18/98/1029521898.db2.gz CTEFKMHMNBNRGP-UHFFFAOYSA-N -1 3 327.714 4.208 20 0 EIADHM CC(C)[C@H](CC1CCCCC1)C(=O)Nc1nnc(C(F)(F)F)[n-]1 ZINC000525235675 1029537127 /nfs/dbraw/zinc/53/71/27/1029537127.db2.gz UACJQZMQIPHGHV-NSHDSACASA-N -1 3 332.370 4.005 20 0 EIADHM CC(C)[C@H](CC1CCCCC1)C(=O)Nc1nc(C(F)(F)F)n[n-]1 ZINC000525235675 1029537146 /nfs/dbraw/zinc/53/71/46/1029537146.db2.gz UACJQZMQIPHGHV-NSHDSACASA-N -1 3 332.370 4.005 20 0 EIADHM Cc1ccc2c(CCC(=O)Nc3cc(Cl)ccc3[O-])c[nH]c2c1 ZINC000525309507 1029568193 /nfs/dbraw/zinc/56/81/93/1029568193.db2.gz BGIAGXZTLDEYGF-UHFFFAOYSA-N -1 3 328.799 4.407 20 0 EIADHM Cc1ccc(Cl)c([N-]S(=O)(=O)c2ccccc2Cl)c1C ZINC000446971992 1029661624 /nfs/dbraw/zinc/66/16/24/1029661624.db2.gz QBAVVEKDPPENEB-UHFFFAOYSA-N -1 3 330.236 4.411 20 0 EIADHM [O-]c1cc(Cl)c(CN2CCCC(F)(F)[C@@H](F)C2)c(Cl)c1 ZINC001142106037 1029674208 /nfs/dbraw/zinc/67/42/08/1029674208.db2.gz XCYRBADUUGGHOH-LBPRGKRZSA-N -1 3 328.161 4.268 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(NC[C@@H]3CCCC[C@H]3C)nc2)n1 ZINC000301183064 1029682618 /nfs/dbraw/zinc/68/26/18/1029682618.db2.gz RBEOGYOFTRDDFF-KGLIPLIRSA-N -1 3 326.444 4.045 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(NC[C@H]3CCC[C@H](C)C3)nc2)n1 ZINC000301191730 1029683839 /nfs/dbraw/zinc/68/38/39/1029683839.db2.gz ZXZCFIGSUJOOSE-KBPBESRZSA-N -1 3 326.444 4.045 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@@H]3C[C@@H]3C3CCCCC3)nc2)n1 ZINC000301377125 1029720446 /nfs/dbraw/zinc/72/04/46/1029720446.db2.gz XZKZORNCRAPYBP-IAGOWNOFSA-N -1 3 338.455 4.187 20 0 EIADHM C[C@H]1CN(Cc2csc(-c3cccc(C(=O)[O-])c3)n2)C(C)(C)C1 ZINC000584297186 1029722135 /nfs/dbraw/zinc/72/21/35/1029722135.db2.gz ZJZYFHAEAAMTOS-GFCCVEGCSA-N -1 3 330.453 4.129 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N(C)[C@@H](C)c3ccc(C)cc3)nc2)n1 ZINC000301545800 1029756041 /nfs/dbraw/zinc/75/60/41/1029756041.db2.gz TZOTWFIQXAONHC-HNNXBMFYSA-N -1 3 348.450 4.312 20 0 EIADHM CCc1cccc(C(=O)N2CCCCC[C@H]2[C@@H]2CCCCC2=O)c1[O-] ZINC000092429856 1029906589 /nfs/dbraw/zinc/90/65/89/1029906589.db2.gz YBBZURBJLVSSCQ-WMZOPIPTSA-N -1 3 343.467 4.099 20 0 EIADHM CC(=O)c1cc(F)c([N-]C(=O)c2ccc(Cl)nc2Cl)c(F)c1 ZINC000760189441 1029921628 /nfs/dbraw/zinc/92/16/28/1029921628.db2.gz NMSKDRWWLWGZAG-UHFFFAOYSA-N -1 3 345.132 4.122 20 0 EIADHM C[C@H]1CC(F)(F)CCN1C(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000530009477 1030030485 /nfs/dbraw/zinc/03/04/85/1030030485.db2.gz BSUZHPBQRKTQQX-ZDUSSCGKSA-N -1 3 347.361 4.444 20 0 EIADHM Cc1ccc(-c2csc(CN3[C@@H](C)CC(C(=O)[O-])C[C@@H]3C)n2)cc1 ZINC000530173737 1030194049 /nfs/dbraw/zinc/19/40/49/1030194049.db2.gz GZWDOAVMBUTSSZ-KBPBESRZSA-N -1 3 344.480 4.192 20 0 EIADHM C[C@@H]1C[C@@H](C(=O)[O-])C[C@H](C)N1CCc1cc(Cl)ccc1Cl ZINC000530172821 1030194278 /nfs/dbraw/zinc/19/42/78/1030194278.db2.gz AVWZUTHZDIJDCQ-PTEHBNRSSA-N -1 3 330.255 4.110 20 0 EIADHM C[C@@H]1C[C@@H](C(=O)[O-])C[C@H](C)N1Cc1coc(-c2cccc(Cl)c2)n1 ZINC000530178212 1030199681 /nfs/dbraw/zinc/19/96/81/1030199681.db2.gz HNQVOAZOPULLKO-DABQJJPHSA-N -1 3 348.830 4.069 20 0 EIADHM CC(C)(CCNCc1csc(-c2ccccc2)n1)CCC(=O)[O-] ZINC000321227047 1030213349 /nfs/dbraw/zinc/21/33/49/1030213349.db2.gz RFODULXYNLMYPG-UHFFFAOYSA-N -1 3 332.469 4.181 20 0 EIADHM Cc1csc(S(=O)(=O)[N-][C@H](CC(F)(F)F)c2ccccc2)c1 ZINC000451087731 1030230224 /nfs/dbraw/zinc/23/02/24/1030230224.db2.gz JCPMLVSHQZJWOJ-GFCCVEGCSA-N -1 3 349.399 4.029 20 0 EIADHM C[C@@H]1CCN(C(=O)CCCc2ccc([O-])c(F)c2)[C@H]2CCCC[C@H]12 ZINC000530332006 1030304919 /nfs/dbraw/zinc/30/49/19/1030304919.db2.gz QQNWSGIAZAZXOB-KYJSFNMBSA-N -1 3 333.447 4.281 20 0 EIADHM [O-]c1cccnc1CNCc1ccc(-c2cccc(C(F)(F)F)c2)o1 ZINC000526992186 1030388500 /nfs/dbraw/zinc/38/85/00/1030388500.db2.gz NHZGCXHDQAQHRA-UHFFFAOYSA-N -1 3 348.324 4.356 20 0 EIADHM CCc1ccc(C(=O)N2CCC(OCC3CCCCC3)CC2)c([O-])c1 ZINC000527045645 1030427114 /nfs/dbraw/zinc/42/71/14/1030427114.db2.gz QCRMUBNJNKBRGU-UHFFFAOYSA-N -1 3 345.483 4.156 20 0 EIADHM Cc1cc(=O)[n-]c([C@H](C)N[C@H](c2ccc(F)c(Cl)c2)C2CC2)n1 ZINC000451354030 1030428502 /nfs/dbraw/zinc/42/85/02/1030428502.db2.gz MBLQQMPQPLYUAA-QFYYESIMSA-N -1 3 335.810 4.085 20 0 EIADHM O=C(Cc1ccc([O-])c(F)c1)N1CCC(c2cccc(Cl)c2)CC1 ZINC000451365601 1030435453 /nfs/dbraw/zinc/43/54/53/1030435453.db2.gz FQFGKCAXIJJKLJ-UHFFFAOYSA-N -1 3 347.817 4.133 20 0 EIADHM Cc1ccc(Cl)c2sc([N-]C(=O)c3c(F)ccnc3F)nc21 ZINC001271935643 1030515386 /nfs/dbraw/zinc/51/53/86/1030515386.db2.gz PAYNDXYGQNIUHR-UHFFFAOYSA-N -1 3 339.754 4.184 20 0 EIADHM Cc1ccc([C@H]2C[C@@H](C)N(Cc3nc(=O)c4sccc4[n-]3)C2)cc1 ZINC000278782638 1030712508 /nfs/dbraw/zinc/71/25/08/1030712508.db2.gz XLKHWNIEIWCMBR-HIFRSBDPSA-N -1 3 339.464 4.083 20 0 EIADHM C[C@@H]([N-]S(=O)(=O)c1c(F)cccc1F)c1cccc2ccccc21 ZINC000007308752 1030784012 /nfs/dbraw/zinc/78/40/12/1030784012.db2.gz HRKXCQITPOQAHA-GFCCVEGCSA-N -1 3 347.386 4.158 20 0 EIADHM COc1cc([C@@H](C)NCc2cccc(C(=O)[O-])c2)ccc1OC(C)C ZINC000263513662 1030910128 /nfs/dbraw/zinc/91/01/28/1030910128.db2.gz ZQODGURIRVMDEC-CQSZACIVSA-N -1 3 343.423 4.031 20 0 EIADHM O=C([O-])[C@@]12CCC[C@H]1CN(Cc1cc(C(F)(F)F)ccc1Cl)C2 ZINC000263524697 1030916001 /nfs/dbraw/zinc/91/60/01/1030916001.db2.gz SRZQDMDQQVLUCR-SWLSCSKDSA-N -1 3 347.764 4.046 20 0 EIADHM CCCC[C@@H](CC)CN1C[C@H]2C[C@@H](C1)N2C(=O)c1ccccc1[S-] ZINC001272014245 1031038590 /nfs/dbraw/zinc/03/85/90/1031038590.db2.gz YSKJCBMUCGXPTG-ZACQAIPSSA-N -1 3 346.540 4.090 20 0 EIADHM O=C(Nc1ccc(Oc2ccccc2)cn1)c1cc([O-])ccc1Cl ZINC000685708096 1031054071 /nfs/dbraw/zinc/05/40/71/1031054071.db2.gz RPICNQOAHRMWMS-UHFFFAOYSA-N -1 3 340.766 4.485 20 0 EIADHM CCSc1ccc([C@@H](C)NC(=O)Cc2ccc([O-])c(F)c2)cc1 ZINC000448915894 1031241003 /nfs/dbraw/zinc/24/10/03/1031241003.db2.gz VKGGQPXOSWTNRO-GFCCVEGCSA-N -1 3 333.428 4.063 20 0 EIADHM CCc1oc(C(=O)Nc2c([O-])ccc(Br)c2C)cc1C ZINC000452756198 1031304936 /nfs/dbraw/zinc/30/49/36/1031304936.db2.gz OSXOFJRNQGHIJP-UHFFFAOYSA-N -1 3 338.201 4.179 20 0 EIADHM O=C(N[C@@H](c1ccccc1)[C@@H]1CCOC1)c1cc([O-])c2ccccc2c1 ZINC000375921199 1031517813 /nfs/dbraw/zinc/51/78/13/1031517813.db2.gz QLAGJSVUQNLYQB-UTKZUKDTSA-N -1 3 347.414 4.053 20 0 EIADHM COc1ccc([O-])c(C(=O)N2CCc3cc(-c4ccccc4)ccc32)c1 ZINC000531762585 1031564889 /nfs/dbraw/zinc/56/48/89/1031564889.db2.gz UDKHWTJYUNFWPR-UHFFFAOYSA-N -1 3 345.398 4.271 20 0 EIADHM C[C@@H](c1ccccc1)n1ccc(NC(=O)c2cc([O-])ccc2Cl)n1 ZINC000685784234 1031657376 /nfs/dbraw/zinc/65/73/76/1031657376.db2.gz UKWXAEHCRZCRNQ-LBPRGKRZSA-N -1 3 341.798 4.104 20 0 EIADHM CCOc1cc([N-]S(=O)(=O)c2ccc(C(C)C)cc2)ccc1OC ZINC000614838796 1031998927 /nfs/dbraw/zinc/99/89/27/1031998927.db2.gz JVQRYUHNJPFUJX-UHFFFAOYSA-N -1 3 349.452 4.018 20 0 EIADHM Cc1ccc([O-])c(C(=O)Nc2ccc(C)c(NC(=O)C(C)(C)C)c2)c1 ZINC000110463227 1033324061 /nfs/dbraw/zinc/32/40/61/1033324061.db2.gz FNBSHHGQAQRXIY-UHFFFAOYSA-N -1 3 340.423 4.246 20 0 EIADHM Cc1cc(-c2nc3ccc(Cl)cc3c(=O)[n-]2)ccc1Br ZINC000614116008 1033401178 /nfs/dbraw/zinc/40/11/78/1033401178.db2.gz XGNXYABXNCPLOC-UHFFFAOYSA-N -1 3 349.615 4.314 20 0 EIADHM CCCN(Cc1c(F)ccc([O-])c1F)[C@H]1CCCc2cccnc21 ZINC000512667730 1033671140 /nfs/dbraw/zinc/67/11/40/1033671140.db2.gz FQGJRHVZXBCYOO-INIZCTEOSA-N -1 3 332.394 4.355 20 0 EIADHM CC(C)[C@H](NCc1cccc([O-])c1Cl)c1ccc2c(c1)OCCO2 ZINC000645143030 1033835133 /nfs/dbraw/zinc/83/51/33/1033835133.db2.gz FTTTUIVDJIAJLH-IBGZPJMESA-N -1 3 347.842 4.304 20 0 EIADHM Cc1cc(S(=O)(=O)[N-]c2ccc(OC(C)C)cc2F)c(C)s1 ZINC000052025499 1034377408 /nfs/dbraw/zinc/37/74/08/1034377408.db2.gz LNIGJJKPFWXKLN-UHFFFAOYSA-N -1 3 343.445 4.092 20 0 EIADHM CCC(C)(C)NC(=O)c1ccc(NCc2c(F)ccc([O-])c2F)cc1 ZINC000513429068 1034937017 /nfs/dbraw/zinc/93/70/17/1034937017.db2.gz BKJMCEWROSTWGB-UHFFFAOYSA-N -1 3 348.393 4.201 20 0 EIADHM [O-]c1ccc(F)c(CN2CC[C@H](C(F)(F)F)C3(CCC3)C2)c1F ZINC000513547190 1035028417 /nfs/dbraw/zinc/02/84/17/1035028417.db2.gz AFNOPEKMENHOLD-ZDUSSCGKSA-N -1 3 335.316 4.225 20 0 EIADHM CCOc1ccc(OCCCC(=O)Nc2cc(Cl)ccc2[O-])cc1 ZINC000490692992 1035605105 /nfs/dbraw/zinc/60/51/05/1035605105.db2.gz GLIKJLSHMIQMNA-UHFFFAOYSA-N -1 3 349.814 4.242 20 0 EIADHM Cc1cccc(C(=O)Nc2nnc(-c3cc4ccccc4o3)[n-]2)c1C ZINC000485105295 1035694256 /nfs/dbraw/zinc/69/42/56/1035694256.db2.gz JHNNCAPCIZCSOV-UHFFFAOYSA-N -1 3 332.363 4.087 20 0 EIADHM Cc1cccc(C(=O)Nc2n[n-]c(-c3cc4ccccc4o3)n2)c1C ZINC000485105295 1035694290 /nfs/dbraw/zinc/69/42/90/1035694290.db2.gz JHNNCAPCIZCSOV-UHFFFAOYSA-N -1 3 332.363 4.087 20 0 EIADHM [O-]c1cccc(CN2CCC(c3ccco3)CC2)c1Br ZINC000668463135 1035828292 /nfs/dbraw/zinc/82/82/92/1035828292.db2.gz MRLJSCQIXWMYNJ-UHFFFAOYSA-N -1 3 336.229 4.127 20 0 EIADHM C[C@@H](C(=O)N=c1cc(-c2cccc(Cl)c2)[n-][nH]1)c1ccccc1F ZINC000596316215 1035850960 /nfs/dbraw/zinc/85/09/60/1035850960.db2.gz SYJLCWBLPWCLAE-LLVKDONJSA-N -1 3 343.789 4.033 20 0 EIADHM CSCC1CCN(Cc2ccc(-c3ccccc3C(=O)[O-])o2)CC1 ZINC000905737576 1035879416 /nfs/dbraw/zinc/87/94/16/1035879416.db2.gz IKBRVQQEIMZBSP-UHFFFAOYSA-N -1 3 345.464 4.220 20 0 EIADHM Cc1ccc(C)c(C2CCN(Cc3ccc(/C=C\C(=O)[O-])o3)CC2)c1 ZINC000905811558 1035903829 /nfs/dbraw/zinc/90/38/29/1035903829.db2.gz XEAOFGHSKVIHNY-FPLPWBNLSA-N -1 3 339.435 4.374 20 0 EIADHM O=C([O-])c1ccccc1CN1CCC(Oc2ccccc2Cl)CC1 ZINC000571930028 1036325554 /nfs/dbraw/zinc/32/55/54/1036325554.db2.gz MKIWVFXFFMLZHW-UHFFFAOYSA-N -1 3 345.826 4.082 20 0 EIADHM O=C(OCc1ccc(OCC2CC2)cc1)c1cccc(Cl)c1[O-] ZINC001269124950 1036334444 /nfs/dbraw/zinc/33/44/44/1036334444.db2.gz YOKATVVMTNHJDL-UHFFFAOYSA-N -1 3 332.783 4.191 20 0 EIADHM CCC[C@]1(C)CCCN(CCOc2ccc(C(=O)[O-])cc2Cl)C1 ZINC000572008732 1036407904 /nfs/dbraw/zinc/40/79/04/1036407904.db2.gz YZXGXRQNHRTQRM-GOSISDBHSA-N -1 3 339.863 4.319 20 0 EIADHM Cc1ccccc1-c1cc(=NC(=O)C[C@@H](C)c2ccccc2F)[nH][n-]1 ZINC000588698918 1036414113 /nfs/dbraw/zinc/41/41/13/1036414113.db2.gz HQENZTWLYQTSFB-CQSZACIVSA-N -1 3 337.398 4.078 20 0 EIADHM O=c1cc(C=Cc2ccc(Cl)cc2Cl)nc(-c2ccncc2)[n-]1 ZINC000486003417 1036416832 /nfs/dbraw/zinc/41/68/32/1036416832.db2.gz SAOBWFYIKONUHW-RQOWECAXSA-N -1 3 344.201 4.309 20 0 EIADHM CSc1ccc([O-])c(C(=O)N2CC[C@H](c3ccc(Cl)cc3)C2)c1 ZINC000668591147 1036500449 /nfs/dbraw/zinc/50/04/49/1036500449.db2.gz ZCTIRIXJCKSVJQ-ZDUSSCGKSA-N -1 3 347.867 4.397 20 0 EIADHM CSc1ccc([O-])c(C(=O)N(C)[C@@H]2CCCc3nc(C)sc32)c1 ZINC000668600650 1036605906 /nfs/dbraw/zinc/60/59/06/1036605906.db2.gz XPGANMOJDDEJSF-CQSZACIVSA-N -1 3 348.493 4.029 20 0 EIADHM CCc1ccc(-c2csc([N-]c3ncnc4ncccc34)n2)cc1 ZINC000502747813 1036614413 /nfs/dbraw/zinc/61/44/13/1036614413.db2.gz RFFQIXMWARCRKW-UHFFFAOYSA-N -1 3 333.420 4.454 20 0 EIADHM CCSCC[C@H](C)N(C)C(=O)c1cc([O-])cc(C(F)(F)F)c1 ZINC000598688194 1036747608 /nfs/dbraw/zinc/74/76/08/1036747608.db2.gz GPVRYRCEDNXABM-JTQLQIEISA-N -1 3 335.391 4.015 20 0 EIADHM COc1ccc(Cl)cc1S(=O)(=O)[N-]c1c(C)cccc1Cl ZINC000486577061 1036775509 /nfs/dbraw/zinc/77/55/09/1036775509.db2.gz SKXUSIJAZNZXBA-UHFFFAOYSA-N -1 3 346.235 4.111 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1cc2cc(Cl)sc2[nH]1 ZINC000486982277 1036932144 /nfs/dbraw/zinc/93/21/44/1036932144.db2.gz UBJZAWOSRIAQND-UHFFFAOYSA-N -1 3 327.192 4.494 20 0 EIADHM Cc1c([O-])ccc2c(CNc3ccc4scnc4c3)cc(=O)oc12 ZINC000171116819 1037124336 /nfs/dbraw/zinc/12/43/36/1037124336.db2.gz SXGWHBNAHCZWBJ-UHFFFAOYSA-N -1 3 338.388 4.029 20 0 EIADHM Cc1ccc(C(C)(C)C(=O)Nc2ccc(Br)cc2[O-])cc1 ZINC000590701497 1037149425 /nfs/dbraw/zinc/14/94/25/1037149425.db2.gz YEIQAZFNWJYPSI-UHFFFAOYSA-N -1 3 348.240 4.379 20 0 EIADHM COc1ccc2c(c1)CCCN(C(=O)c1ccc(C(C)C)cc1[O-])C2 ZINC000590816526 1037183466 /nfs/dbraw/zinc/18/34/66/1037183466.db2.gz ZZNSCKFUCDZTQN-UHFFFAOYSA-N -1 3 339.435 4.113 20 0 EIADHM Cc1ccccc1CCC(=O)Nc1ccc(Br)cc1[O-] ZINC000590905833 1037201974 /nfs/dbraw/zinc/20/19/74/1037201974.db2.gz NFLGTYLOQZCKGV-UHFFFAOYSA-N -1 3 334.213 4.034 20 0 EIADHM O=C(Nc1ccc(Br)cc1[O-])c1cccc(C(F)F)c1 ZINC000591132385 1037289993 /nfs/dbraw/zinc/28/99/93/1037289993.db2.gz ITHQKLKEBXBQFS-UHFFFAOYSA-N -1 3 342.139 4.345 20 0 EIADHM CC(C)(C(=O)[O-])[C@H]1CCCN(Cc2ccc(Cl)cc2Cl)C1 ZINC000157989954 1037352096 /nfs/dbraw/zinc/35/20/96/1037352096.db2.gz DKDATFFPVOVKLS-LBPRGKRZSA-N -1 3 330.255 4.316 20 0 EIADHM CC(C)(C)c1nsc([N-]C(=O)c2scnc2C2CCCC2)n1 ZINC000273728085 1037563532 /nfs/dbraw/zinc/56/35/32/1037563532.db2.gz SWIYGBNTMZDLHZ-UHFFFAOYSA-N -1 3 336.486 4.202 20 0 EIADHM CCCCN(CCCC)Cn1c(Cc2cccs2)n[n-]c1=S ZINC000058205628 1037585655 /nfs/dbraw/zinc/58/56/55/1037585655.db2.gz OGWNRUKNTVAKCU-UHFFFAOYSA-N -1 3 338.546 4.453 20 0 EIADHM O=C(OCc1csc(C2CCCC2)n1)c1cc(-c2ccco2)[n-]n1 ZINC000058309280 1037726383 /nfs/dbraw/zinc/72/63/83/1037726383.db2.gz GZJHIPOIXIXEHD-UHFFFAOYSA-N -1 3 343.408 4.141 20 0 EIADHM O=C(OCc1csc(C2CCCC2)n1)c1cc(-c2ccco2)n[n-]1 ZINC000058309280 1037726403 /nfs/dbraw/zinc/72/64/03/1037726403.db2.gz GZJHIPOIXIXEHD-UHFFFAOYSA-N -1 3 343.408 4.141 20 0 EIADHM Cc1cccc2c1[C@H](C)C[C@@H]2CC(=O)NCc1ccc([O-])c(F)c1 ZINC000488990222 1037826786 /nfs/dbraw/zinc/82/67/86/1037826786.db2.gz YCJBPWSKJXNXJH-UKRRQHHQSA-N -1 3 327.399 4.137 20 0 EIADHM O=C(Nc1cc(Br)ccc1[O-])c1cccn1C1CCCC1 ZINC000489173395 1037887320 /nfs/dbraw/zinc/88/73/20/1037887320.db2.gz GJGLRXSXIFTRMV-UHFFFAOYSA-N -1 3 349.228 4.324 20 0 EIADHM Cc1c(C(=O)NCc2ccc([O-])c(F)c2)oc2c1c(C)ccc2C ZINC000606536937 1038150205 /nfs/dbraw/zinc/15/02/05/1038150205.db2.gz GFDOZTJUZFVVSO-UHFFFAOYSA-N -1 3 327.355 4.133 20 0 EIADHM Cc1ccc(C(C)C)cc1O[C@@H](C)C(=O)NCc1ccc([O-])c(F)c1 ZINC000606537265 1038152346 /nfs/dbraw/zinc/15/23/46/1038152346.db2.gz NLNABXDTBMNFLX-AWEZNQCLSA-N -1 3 345.414 4.047 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)N[C@@H](c1ccccc1)C1CCCC1 ZINC000606646963 1038205652 /nfs/dbraw/zinc/20/56/52/1038205652.db2.gz DTBMDVUIIRACGZ-IBGZPJMESA-N -1 3 342.414 4.262 20 0 EIADHM CC(C)C[C@@H](NC(=O)NCc1ccc([O-])c(F)c1)c1cccs1 ZINC000606649576 1038207539 /nfs/dbraw/zinc/20/75/39/1038207539.db2.gz BAIPYYLJEVTQAX-CQSZACIVSA-N -1 3 336.432 4.179 20 0 EIADHM Cc1ccc([C@H](C)N(C)C(=O)NCc2ccc([O-])c(F)c2)c(C)c1 ZINC000606715021 1038229180 /nfs/dbraw/zinc/22/91/80/1038229180.db2.gz NJIAKBFFHRNBPP-AWEZNQCLSA-N -1 3 330.403 4.051 20 0 EIADHM CCCN(C(=O)NCc1ccc([O-])c(F)c1)[C@H]1CCc2ccccc21 ZINC000606720318 1038229479 /nfs/dbraw/zinc/22/94/79/1038229479.db2.gz QHYRKFXDBXUXJY-SFHVURJKSA-N -1 3 342.414 4.140 20 0 EIADHM Cc1oc([C@@H](C)N(C)CCOc2ccc(Cl)cc2)cc1C(=O)[O-] ZINC000515659942 1038230184 /nfs/dbraw/zinc/23/01/84/1038230184.db2.gz FSTNXHPPVNDOKW-LLVKDONJSA-N -1 3 337.803 4.011 20 0 EIADHM Cc1cccc([C@@H](C)C(=O)Nc2ccc(Br)cc2[O-])c1 ZINC000606832244 1038267050 /nfs/dbraw/zinc/26/70/50/1038267050.db2.gz POQQBTFCIPWRHE-LLVKDONJSA-N -1 3 334.213 4.205 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@H]3C[C@H](C)C[C@H](C)C3)nc2)n1 ZINC000606895485 1038286501 /nfs/dbraw/zinc/28/65/01/1038286501.db2.gz IQKGOBXPEKPMOW-VIKVFOODSA-N -1 3 326.444 4.043 20 0 EIADHM O=C([O-])c1coc(CN2CCCCC[C@H]2/C=C\c2cccs2)c1 ZINC000574578233 1038298674 /nfs/dbraw/zinc/29/86/74/1038298674.db2.gz NQHSXMMNOQOKDE-LZNQSLFOSA-N -1 3 331.437 4.497 20 0 EIADHM C[C@@H](CS(=O)(=O)[N-]c1ccccc1C(F)F)c1ccccc1 ZINC000424069429 1038461042 /nfs/dbraw/zinc/46/10/42/1038461042.db2.gz PQARCUQTIVXWFC-LBPRGKRZSA-N -1 3 325.380 4.170 20 0 EIADHM O=C(Nc1cc(F)ccc1[O-])[C@@H](Oc1ccccc1)c1ccccc1 ZINC000533971363 1038744469 /nfs/dbraw/zinc/74/44/69/1038744469.db2.gz WMGORLBJOLSQFS-IBGZPJMESA-N -1 3 337.350 4.290 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2ccc(OC(C)C)c(Cl)c2)cc1 ZINC000031721560 1038861072 /nfs/dbraw/zinc/86/10/72/1038861072.db2.gz PFXVEAVEXKCPHC-UHFFFAOYSA-N -1 3 339.844 4.236 20 0 EIADHM Cc1ccc(-n2cc(NC(=O)c3cc([O-])ccc3Cl)cn2)c(C)c1 ZINC000505179603 1039078786 /nfs/dbraw/zinc/07/87/86/1039078786.db2.gz KFZKSLHWVXDOQE-UHFFFAOYSA-N -1 3 341.798 4.100 20 0 EIADHM Cc1nc(C(C)C)ccc1C(=O)Nc1ccc(Br)cc1[O-] ZINC000559032689 1039108367 /nfs/dbraw/zinc/10/83/67/1039108367.db2.gz KVJNURRWQASQFQ-UHFFFAOYSA-N -1 3 349.228 4.234 20 0 EIADHM Cc1ccc(CN(Cc2ccco2)C(=O)c2ccccc2[O-])s1 ZINC000121528540 1039386758 /nfs/dbraw/zinc/38/67/58/1039386758.db2.gz AHCHICZNEPNFMV-UHFFFAOYSA-N -1 3 327.405 4.198 20 0 EIADHM Cc1cc(OCC(=O)Nc2c([O-])cccc2Cl)ccc1Cl ZINC000552432673 1039509541 /nfs/dbraw/zinc/50/95/41/1039509541.db2.gz WORVTMSZALVFHF-UHFFFAOYSA-N -1 3 326.179 4.025 20 0 EIADHM O=C(N[C@@H](c1ccccc1)C(F)(F)F)c1cc([O-])ccc1Cl ZINC000555739581 1039573269 /nfs/dbraw/zinc/57/32/69/1039573269.db2.gz ZQAVWEGEIBZBBE-ZDUSSCGKSA-N -1 3 329.705 4.079 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)NCc1ccc(C2CC2)cc1F ZINC000552676335 1039747639 /nfs/dbraw/zinc/74/76/39/1039747639.db2.gz RDVDHWITXSHRHP-UHFFFAOYSA-N -1 3 345.389 4.187 20 0 EIADHM CCOc1ccc(F)c([N-]C(=O)c2csc(CC(C)C)n2)c1F ZINC000534769469 1039773356 /nfs/dbraw/zinc/77/33/56/1039773356.db2.gz RXQVUDXUQYEOAF-UHFFFAOYSA-N -1 3 340.395 4.271 20 0 EIADHM O=C(CSc1nccc2ccccc21)Nc1c([O-])cccc1Cl ZINC000552783129 1039819264 /nfs/dbraw/zinc/81/92/64/1039819264.db2.gz FAWMYHJBXSXHMU-UHFFFAOYSA-N -1 3 344.823 4.325 20 0 EIADHM CCc1c([N-]C(=O)c2cc([C@@H](C)CC)no2)onc1C(F)(F)F ZINC000476744641 1039853712 /nfs/dbraw/zinc/85/37/12/1039853712.db2.gz JVPNRCQPBIBHSY-ZETCQYMHSA-N -1 3 331.294 4.010 20 0 EIADHM O=C(Nc1cccc(O)c1F)c1cc(Cc2ccccc2)ccc1[O-] ZINC000537664070 1039870073 /nfs/dbraw/zinc/87/00/73/1039870073.db2.gz WKBRRBGLVQQRRL-UHFFFAOYSA-N -1 3 337.350 4.080 20 0 EIADHM O=C(Cc1csc2ccc(Cl)cc12)NCc1ccc([O-])c(F)c1 ZINC000505571668 1039928341 /nfs/dbraw/zinc/92/83/41/1039928341.db2.gz CDBMFBBIMUISJN-UHFFFAOYSA-N -1 3 349.814 4.258 20 0 EIADHM COc1ccc(C(=O)Nc2cc(F)ccc2[O-])c(OC2CCCC2)c1 ZINC000478859224 1039970547 /nfs/dbraw/zinc/97/05/47/1039970547.db2.gz SIECASAYRBTGGL-UHFFFAOYSA-N -1 3 345.370 4.114 20 0 EIADHM Cc1ccc(-c2nc(-c3cccnc3OC3CCCC3)no2)c([O-])c1 ZINC000514696588 1040145729 /nfs/dbraw/zinc/14/57/29/1040145729.db2.gz KEDYMGMGMGNDSI-UHFFFAOYSA-N -1 3 337.379 4.134 20 0 EIADHM O=c1[n-]c(-c2ccc3c(c2)CCCCC3=O)nc2cc(Cl)ccc12 ZINC000479177098 1040182626 /nfs/dbraw/zinc/18/26/26/1040182626.db2.gz KUNJKBBPVBJCNM-UHFFFAOYSA-N -1 3 338.794 4.153 20 0 EIADHM Cc1c2nc(NC(=O)c3cc([O-])ccc3Cl)sc2ccc1F ZINC000514803996 1040250994 /nfs/dbraw/zinc/25/09/94/1040250994.db2.gz RUJFGLPGSGIESB-UHFFFAOYSA-N -1 3 336.775 4.355 20 0 EIADHM CCCc1cc(=O)[n-]c(C(=Cc2ccc(OC)c(Cl)c2)CC)n1 ZINC000435337485 1040290570 /nfs/dbraw/zinc/29/05/70/1040290570.db2.gz WRRNHUAMWNNNGK-LCYFTJDESA-N -1 3 332.831 4.335 20 0 EIADHM CCCOc1cccc(C=C(CC)c2nc(CCC)cc(=O)[n-]2)c1 ZINC000435340793 1040294646 /nfs/dbraw/zinc/29/46/46/1040294646.db2.gz NGTHMYNUCQQCEX-VBKFSLOCSA-N -1 3 326.440 4.462 20 0 EIADHM Cc1ccc([C@@H](C)NCc2cccc([O-])c2Br)cc1F ZINC000315318090 1040300550 /nfs/dbraw/zinc/30/05/50/1040300550.db2.gz HEQCRSVITVKSSE-LLVKDONJSA-N -1 3 338.220 4.453 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@@H]3CC[C@@H]3c3ccccc3)nc2)n1 ZINC000664488196 1040387677 /nfs/dbraw/zinc/38/76/77/1040387677.db2.gz NVHFXKNAAUTZFU-QZTJIDSGSA-N -1 3 346.434 4.165 20 0 EIADHM O=C(Nc1ccc(Br)cc1[O-])c1ccc(Cl)s1 ZINC000515078369 1040465693 /nfs/dbraw/zinc/46/56/93/1040465693.db2.gz BCEOXYCDEJUNLC-UHFFFAOYSA-N -1 3 332.606 4.122 20 0 EIADHM O=c1[n-]c(NCc2cccc3c2OC(F)(F)O3)c(Cl)cc1Cl ZINC001168357433 1040526464 /nfs/dbraw/zinc/52/64/64/1040526464.db2.gz MGSMJDGPPSNRBZ-UHFFFAOYSA-N -1 3 349.120 4.028 20 0 EIADHM COc1ccc([O-])c(C(=O)Nc2ccc(OC(C)C)c(Cl)c2)c1 ZINC000515194405 1040543681 /nfs/dbraw/zinc/54/36/81/1040543681.db2.gz DEQRTWVQUUYLCP-UHFFFAOYSA-N -1 3 335.787 4.094 20 0 EIADHM Cc1cc(CCNC(=O)CCCc2ccc([O-])c(F)c2)ccc1Cl ZINC000462448748 1040613046 /nfs/dbraw/zinc/61/30/46/1040613046.db2.gz AKKULCXWSLYXLJ-UHFFFAOYSA-N -1 3 349.833 4.175 20 0 EIADHM Cc1oc(C(C)C)cc1C(=O)Nc1ccc(Br)cc1[O-] ZINC000551920145 1040703678 /nfs/dbraw/zinc/70/36/78/1040703678.db2.gz IWLRHJIUYNYUDQ-UHFFFAOYSA-N -1 3 338.201 4.432 20 0 EIADHM C[C@H](C(=O)Nc1ccc(Cl)cc1[O-])c1cn(C)c2ccccc12 ZINC000477690184 1040724969 /nfs/dbraw/zinc/72/49/69/1040724969.db2.gz DXYZVERJEXPONU-NSHDSACASA-N -1 3 328.799 4.280 20 0 EIADHM O=C(NC1(c2ccccc2)CCCCC1)c1cc(=O)c2ccccc2[n-]1 ZINC000505742588 1040805473 /nfs/dbraw/zinc/80/54/73/1040805473.db2.gz UNXYTQHIRDIVEJ-UHFFFAOYSA-N -1 3 346.430 4.118 20 0 EIADHM C[C@H](Cc1ccccc1)n1cccc1C(=O)Nc1cccc([O-])c1F ZINC000537998853 1040997944 /nfs/dbraw/zinc/99/79/44/1040997944.db2.gz UVDOVCOUZIHKMH-CQSZACIVSA-N -1 3 338.382 4.389 20 0 EIADHM CSc1ccc([O-])c(C(=O)N2CCC(n3c(C)ccc3C)CC2)c1 ZINC000667654414 1041192177 /nfs/dbraw/zinc/19/21/77/1041192177.db2.gz ACECGHVLXSXHMM-UHFFFAOYSA-N -1 3 344.480 4.010 20 0 EIADHM CC(C)(CC(=O)Nc1ccc([O-])c(C(F)(F)F)c1)C(F)(F)F ZINC000480324713 1041224259 /nfs/dbraw/zinc/22/42/59/1041224259.db2.gz GZMJOZKIXFISNT-UHFFFAOYSA-N -1 3 329.240 4.328 20 0 EIADHM O=C(c1ccccc1[O-])N1CCC[C@@H]1Cc1c(F)cccc1Cl ZINC000436484631 1041283924 /nfs/dbraw/zinc/28/39/24/1041283924.db2.gz HICHSSUTSFUZIC-GFCCVEGCSA-N -1 3 333.790 4.032 20 0 EIADHM Cc1ccc(C(=O)Nc2ccc3[nH]c(C(F)F)nc3c2)c([O-])c1C ZINC000436510963 1041297419 /nfs/dbraw/zinc/29/74/19/1041297419.db2.gz FWPRYEYJTXMMON-UHFFFAOYSA-N -1 3 331.322 4.075 20 0 EIADHM COc1cccc2cc(CN[C@H](CC(=O)[O-])c3cccc(C)c3)oc21 ZINC000904042545 1041299158 /nfs/dbraw/zinc/29/91/58/1041299158.db2.gz GAROSJOTCDJQTA-QGZVFWFLSA-N -1 3 339.391 4.055 20 0 EIADHM CCC(=O)Nc1ccc(Cl)c(NC(=O)c2ccc(C)c(C)c2[O-])c1 ZINC000436549654 1041325640 /nfs/dbraw/zinc/32/56/40/1041325640.db2.gz UWMNHCBAPXOTPV-UHFFFAOYSA-N -1 3 346.814 4.263 20 0 EIADHM CCCN(C(=O)c1ccc(C)cc1[O-])[C@H](C)c1ccccc1OC ZINC000436540502 1041332648 /nfs/dbraw/zinc/33/26/48/1041332648.db2.gz PCXUUQXJYRICEC-OAHLLOKOSA-N -1 3 327.424 4.323 20 0 EIADHM CSCC[C@H](C)N(C)C(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436539080 1041333945 /nfs/dbraw/zinc/33/39/45/1041333945.db2.gz SFNNKZYUFBFRTF-AWEZNQCLSA-N -1 3 345.464 4.398 20 0 EIADHM COc1ccc(C(=O)N(C)[C@@H]2CCC[C@@H]2c2ccc(C)cc2)c([O-])c1 ZINC000436591719 1041351029 /nfs/dbraw/zinc/35/10/29/1041351029.db2.gz RDQARSDKHGXNDB-IEBWSBKVSA-N -1 3 339.435 4.118 20 0 EIADHM CC(C)c1ccc(C(=O)NC[C@@H]2CCO[C@@H]2c2ccccc2)c([O-])c1 ZINC000436586172 1041363495 /nfs/dbraw/zinc/36/34/95/1041363495.db2.gz ATZJDGVCCLGLSS-FXAWDEMLSA-N -1 3 339.435 4.023 20 0 EIADHM C[C@H](c1ccccc1)N(CC1CCC1)C(=O)c1ccc(O)cc1[O-] ZINC000436619991 1041365606 /nfs/dbraw/zinc/36/56/06/1041365606.db2.gz RKJYLTJIXXGXEY-CQSZACIVSA-N -1 3 325.408 4.101 20 0 EIADHM C[C@@H](c1ccccc1)N(CC1CCC1)C(=O)c1ccc(O)cc1[O-] ZINC000436619990 1041366225 /nfs/dbraw/zinc/36/62/25/1041366225.db2.gz RKJYLTJIXXGXEY-AWEZNQCLSA-N -1 3 325.408 4.101 20 0 EIADHM CC(C)c1ccc(C(=O)N(Cc2ccc(O)cc2)CC2CC2)c([O-])c1 ZINC000436602344 1041368926 /nfs/dbraw/zinc/36/89/26/1041368926.db2.gz LGEOISMIMOMZBQ-UHFFFAOYSA-N -1 3 339.435 4.274 20 0 EIADHM CCCN(C(=O)c1ccc(O)cc1[O-])[C@@H](C)c1cc2ccccc2o1 ZINC000436612909 1041372200 /nfs/dbraw/zinc/37/22/00/1041372200.db2.gz ZUVJOZCRBCOHRM-ZDUSSCGKSA-N -1 3 339.391 4.457 20 0 EIADHM COc1ccc(C(=O)N2C[C@@H](C)CC[C@@H]2c2ccccc2)c([O-])c1 ZINC000436657299 1041413631 /nfs/dbraw/zinc/41/36/31/1041413631.db2.gz LDMUSYVCIGNSQM-KBXCAEBGSA-N -1 3 325.408 4.014 20 0 EIADHM COc1cc(-c2nc(-c3cccc4ccccc43)no2)cc(OC)c1[O-] ZINC000436688295 1041423020 /nfs/dbraw/zinc/42/30/20/1041423020.db2.gz KUGXHACWWGVBEQ-UHFFFAOYSA-N -1 3 348.358 4.280 20 0 EIADHM CCOCCOc1ccc(Cl)cc1NC(=O)c1cccc(C)c1[O-] ZINC000436708205 1041425238 /nfs/dbraw/zinc/42/52/38/1041425238.db2.gz WTDDFSYLFBZGCY-UHFFFAOYSA-N -1 3 349.814 4.022 20 0 EIADHM O=C(OCc1ccccc1)c1ccc(-c2nc(C3CCCC3)no2)[n-]1 ZINC000904352954 1041447767 /nfs/dbraw/zinc/44/77/67/1041447767.db2.gz DNXOFABLIWJVLL-UHFFFAOYSA-N -1 3 337.379 4.079 20 0 EIADHM Cc1sc(C(=O)[O-])cc1CN1CC=C(c2ccc(F)cc2)CC1 ZINC000568639922 1041447881 /nfs/dbraw/zinc/44/78/81/1041447881.db2.gz VRGRRYQOZPYZQF-UHFFFAOYSA-N -1 3 331.412 4.183 20 0 EIADHM CCC1(C(=O)NCc2ccc([O-])c(Br)c2)CCCCC1 ZINC000461452572 1041461306 /nfs/dbraw/zinc/46/13/06/1041461306.db2.gz VPJNNAZZZCJJIQ-UHFFFAOYSA-N -1 3 340.261 4.131 20 0 EIADHM CCc1ccc(-c2nc(-c3ccc(OC(C)(C)C)cn3)no2)c([O-])c1 ZINC000436782002 1041474001 /nfs/dbraw/zinc/47/40/01/1041474001.db2.gz AHQMNDCORFIKML-UHFFFAOYSA-N -1 3 339.395 4.244 20 0 EIADHM COc1ccc(C(=O)N([C@H](C)c2ccc(Cl)cc2)C2CC2)c([O-])c1 ZINC000436800124 1041478934 /nfs/dbraw/zinc/47/89/34/1041478934.db2.gz SXMZTIILWGQJLA-GFCCVEGCSA-N -1 3 345.826 4.420 20 0 EIADHM CCc1ccc(C(=O)N2CC=C(c3ccc(F)cc3)CC2)c([O-])c1 ZINC000436803694 1041489072 /nfs/dbraw/zinc/48/90/72/1041489072.db2.gz QODJTXPZZWQKIY-UHFFFAOYSA-N -1 3 325.383 4.023 20 0 EIADHM Cc1ccc(C(=O)N2CC[C@@H](Sc3cccc(Cl)c3)C2)c([O-])c1 ZINC000436846504 1041515821 /nfs/dbraw/zinc/51/58/21/1041515821.db2.gz XWJHAFQIJCMYMM-OAHLLOKOSA-N -1 3 347.867 4.361 20 0 EIADHM CCC(=O)Nc1cccc(-c2noc(-c3ccc(CC)cc3[O-])n2)c1 ZINC000436849228 1041516024 /nfs/dbraw/zinc/51/60/24/1041516024.db2.gz YPVOWRRASXIWFE-UHFFFAOYSA-N -1 3 337.379 4.020 20 0 EIADHM COc1ccc([O-])c(C(=O)Nc2ccccc2-c2cccs2)c1 ZINC000538746681 1041521639 /nfs/dbraw/zinc/52/16/39/1041521639.db2.gz SQDUYUYYIKOLAC-UHFFFAOYSA-N -1 3 325.389 4.382 20 0 EIADHM COc1ccccc1[C@H]1CC[C@H](C)CN1C(=O)c1ccccc1[O-] ZINC000436857686 1041534285 /nfs/dbraw/zinc/53/42/85/1041534285.db2.gz BRDZOWUCKBBGEP-WMLDXEAASA-N -1 3 325.408 4.014 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@H]3CC[C@H](CC)CC3)nc2)n1 ZINC000436911892 1041549948 /nfs/dbraw/zinc/54/99/48/1041549948.db2.gz RXFSDTRHWLCCLF-SAZUREKKSA-N -1 3 326.444 4.187 20 0 EIADHM Cc1ccc(-c2nc(-c3ccccc3OC(F)(F)F)no2)c([O-])c1 ZINC000436896491 1041551749 /nfs/dbraw/zinc/55/17/49/1041551749.db2.gz ZBGPDSOVYYOEQR-UHFFFAOYSA-N -1 3 336.269 4.316 20 0 EIADHM Cc1oc([C@H](C)N2CCC(Cc3ccccc3F)CC2)cc1C(=O)[O-] ZINC000520416439 1041552422 /nfs/dbraw/zinc/55/24/22/1041552422.db2.gz CPSQTGRZKURXLR-ZDUSSCGKSA-N -1 3 345.414 4.441 20 0 EIADHM CC1(c2cccc(Cl)c2)CCN(C(=O)c2ccccc2[O-])CC1 ZINC000436918288 1041556092 /nfs/dbraw/zinc/55/60/92/1041556092.db2.gz FYBREPRLYHVATD-UHFFFAOYSA-N -1 3 329.827 4.240 20 0 EIADHM CN(Cc1ccccc1)C(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436950250 1041564047 /nfs/dbraw/zinc/56/40/47/1041564047.db2.gz BFACBWUKTQNEFE-UHFFFAOYSA-N -1 3 333.387 4.457 20 0 EIADHM CCOC(=O)c1ccc(NC(=O)c2cc3sccc3s2)c([O-])c1 ZINC000538873337 1041568277 /nfs/dbraw/zinc/56/82/77/1041568277.db2.gz OGMCEMXLLLWSTO-UHFFFAOYSA-N -1 3 347.417 4.097 20 0 EIADHM COc1ccc([O-])c(-c2nc(-c3ccc(SC)cc3Cl)no2)c1 ZINC000436947777 1041570489 /nfs/dbraw/zinc/57/04/89/1041570489.db2.gz HPTZBJVBFPFYKC-UHFFFAOYSA-N -1 3 348.811 4.493 20 0 EIADHM COc1cccc(C(=O)Nc2ccc(CNc3ccccc3)cc2)c1[O-] ZINC000436975486 1041579722 /nfs/dbraw/zinc/57/97/22/1041579722.db2.gz APWWRKMWDIFRDC-UHFFFAOYSA-N -1 3 348.402 4.265 20 0 EIADHM [O-]c1ccccc1-c1nc(Cc2csc(-c3ccccc3)n2)no1 ZINC000436997593 1041586004 /nfs/dbraw/zinc/58/60/04/1041586004.db2.gz NNMNNTHKTWMTQU-UHFFFAOYSA-N -1 3 335.388 4.157 20 0 EIADHM O=C(Nc1nc(-c2ccccc2)cs1)c1c[n-]c2ccccc2c1=O ZINC000302958621 1042203479 /nfs/dbraw/zinc/20/34/79/1042203479.db2.gz GCSHYPGFRUNIOQ-UHFFFAOYSA-N -1 3 347.399 4.316 20 0 EIADHM O=C(Nc1c([O-])cccc1Cl)c1cc(F)cc(C(F)(F)F)c1 ZINC000560822734 1042211198 /nfs/dbraw/zinc/21/11/98/1042211198.db2.gz WGUPDFVCDDEEHH-UHFFFAOYSA-N -1 3 333.668 4.456 20 0 EIADHM CCn1cc(CC(=O)Nc2cc(Cl)ccc2[O-])c2ccccc21 ZINC000303061850 1042279963 /nfs/dbraw/zinc/27/99/63/1042279963.db2.gz YNJBFGKVFXKARZ-UHFFFAOYSA-N -1 3 328.799 4.201 20 0 EIADHM CC1(C)CN(C(=O)c2cc([O-])ccc2Cl)CC[C@H]1C(F)(F)F ZINC000506328424 1042316204 /nfs/dbraw/zinc/31/62/04/1042316204.db2.gz YCFITMYWOWYBEI-GFCCVEGCSA-N -1 3 335.753 4.096 20 0 EIADHM CC1(C)CN(C(=O)c2cc([O-])ccc2Cl)CC[C@@H]1C(F)(F)F ZINC000506328425 1042316557 /nfs/dbraw/zinc/31/65/57/1042316557.db2.gz YCFITMYWOWYBEI-LBPRGKRZSA-N -1 3 335.753 4.096 20 0 EIADHM COc1ccccc1C[C@@H](C)CC(=O)Nc1cc(Cl)ccc1[O-] ZINC000303361332 1042413850 /nfs/dbraw/zinc/41/38/50/1042413850.db2.gz ZTBJBKJUHREBJX-GFCCVEGCSA-N -1 3 333.815 4.262 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)c1ccccc1OC1CCCCC1 ZINC000439504683 1042669960 /nfs/dbraw/zinc/66/99/60/1042669960.db2.gz VUJYLAZBGGJBAX-UHFFFAOYSA-N -1 3 343.398 4.173 20 0 EIADHM CC(C)(C)c1noc2ncc(C(=O)Nc3cc(Cl)ccc3[O-])cc21 ZINC000518796372 1042701350 /nfs/dbraw/zinc/70/13/50/1042701350.db2.gz DGTYCDVLISRGIQ-UHFFFAOYSA-N -1 3 345.786 4.132 20 0 EIADHM CCO[C@H](C)c1ncc(C(=O)[N-]c2cc(Cl)cc(F)c2F)s1 ZINC000441567471 1042886575 /nfs/dbraw/zinc/88/65/75/1042886575.db2.gz OKETYLFXCVATGI-SSDOTTSWSA-N -1 3 346.786 4.425 20 0 EIADHM O=C(COc1ccc2ccccc2c1)Nc1cc(Cl)ccc1[O-] ZINC000007045208 1042918682 /nfs/dbraw/zinc/91/86/82/1042918682.db2.gz QKNALGGFCPOJBK-UHFFFAOYSA-N -1 3 327.767 4.216 20 0 EIADHM Cc1nscc1C(=O)[N-]c1nc(Sc2ccc(C)cc2)ns1 ZINC000183218948 1043040564 /nfs/dbraw/zinc/04/05/64/1043040564.db2.gz NSHSHULHZOSGLE-UHFFFAOYSA-N -1 3 348.478 4.015 20 0 EIADHM CCOc1cc(/C=C(\C#N)c2nc(-c3ccc(C)cc3)no2)ccc1[O-] ZINC000007212300 1043089515 /nfs/dbraw/zinc/08/95/15/1043089515.db2.gz KMCLVLRHFKMHGH-MHWRWJLKSA-N -1 3 347.374 4.214 20 0 EIADHM CCc1ccc([O-])c(C(=O)N2CC=C(c3c[nH]c4ccccc43)CC2)c1 ZINC000076949298 1043185481 /nfs/dbraw/zinc/18/54/81/1043185481.db2.gz WAUYEWIJJIPZIU-UHFFFAOYSA-N -1 3 346.430 4.365 20 0 EIADHM [O-]c1cc(F)cc(CNc2cccc(OCc3cscn3)c2)c1 ZINC000185594291 1043201002 /nfs/dbraw/zinc/20/10/02/1043201002.db2.gz CQBQKYGQXCTGFW-UHFFFAOYSA-N -1 3 330.384 4.179 20 0 EIADHM CCOCCOc1c(Cl)cccc1NCc1cc([O-])cc(F)c1 ZINC000185590506 1043201691 /nfs/dbraw/zinc/20/16/91/1043201691.db2.gz YSXUUQPDPHDGEZ-UHFFFAOYSA-N -1 3 339.794 4.212 20 0 EIADHM COc1cccc(C2CCN(Cc3c(F)ccc([O-])c3F)CC2)c1 ZINC000507968208 1043210194 /nfs/dbraw/zinc/21/01/94/1043210194.db2.gz WFPGGHWNOXRTCK-UHFFFAOYSA-N -1 3 333.378 4.059 20 0 EIADHM COc1ccc(CNC(=O)c2cc([O-])c3ccccc3c2)cc1Cl ZINC000525926054 1043234513 /nfs/dbraw/zinc/23/45/13/1043234513.db2.gz HLLKXCOLQJKGFC-UHFFFAOYSA-N -1 3 341.794 4.137 20 0 EIADHM O=C(NC[C@H]1CCO[C@H]1c1ccccc1)c1cc([O-])c2ccccc2c1 ZINC000527183954 1043252301 /nfs/dbraw/zinc/25/23/01/1043252301.db2.gz RNVURHPSGLVHLO-UTKZUKDTSA-N -1 3 347.414 4.053 20 0 EIADHM C[C@@H](c1cc2ccccc2o1)N(C)C(=O)NCc1ccc([O-])c(F)c1 ZINC000163690518 1043258498 /nfs/dbraw/zinc/25/84/98/1043258498.db2.gz ADNAMIGEBWWWHF-LBPRGKRZSA-N -1 3 342.370 4.180 20 0 EIADHM C[C@H]1CO[C@@H](c2ccccc2)CN1C(=O)c1cc([O-])c2ccccc2c1 ZINC000527449294 1043260712 /nfs/dbraw/zinc/26/07/12/1043260712.db2.gz XXDORCKWLWIVIH-YCRPNKLZSA-N -1 3 347.414 4.148 20 0 EIADHM CCOc1cc(NC(=O)c2cc([O-])c3ccccc3c2)ccc1OC ZINC000527448054 1043261362 /nfs/dbraw/zinc/26/13/62/1043261362.db2.gz QRIMDLGTDOKGMM-UHFFFAOYSA-N -1 3 337.375 4.205 20 0 EIADHM O=C(CCc1cccc(OC2CCCC2)c1)[N-]OCc1ccccc1 ZINC000727672642 1043265081 /nfs/dbraw/zinc/26/50/81/1043265081.db2.gz KWHWDABNWYHVGH-UHFFFAOYSA-N -1 3 339.435 4.189 20 0 EIADHM Cc1nonc1[N-]C(=O)c1sc2cccc(Cl)c2c1Cl ZINC000727709769 1043275558 /nfs/dbraw/zinc/27/55/58/1043275558.db2.gz MQWKGMZMQRMQNL-UHFFFAOYSA-N -1 3 328.180 4.152 20 0 EIADHM C[C@H](C(=O)[N-][C@@H](c1ccc(F)c(Cl)c1)C(F)(F)F)C(C)(F)F ZINC000508175416 1043303207 /nfs/dbraw/zinc/30/32/07/1043303207.db2.gz WGWWYWUMZRONPR-LDWIPMOCSA-N -1 3 347.686 4.490 20 0 EIADHM [O-]c1c(F)cc(F)cc1Nc1ncccc1OCc1ccccc1 ZINC001212475679 1043389469 /nfs/dbraw/zinc/38/94/69/1043389469.db2.gz OEMOOSZPDGYFAM-UHFFFAOYSA-N -1 3 328.318 4.388 20 0 EIADHM CC[C@@H](C)c1ccc(S(=O)(=O)[N-]c2cccc(F)c2F)cc1 ZINC000521414504 1043757373 /nfs/dbraw/zinc/75/73/73/1043757373.db2.gz PXLMUZKELTVBJC-LLVKDONJSA-N -1 3 325.380 4.279 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2ccc(COC(C)(C)C)cc2)c(C)c1 ZINC000674648186 1043819434 /nfs/dbraw/zinc/81/94/34/1043819434.db2.gz AXHQOHHIKXWOJE-UHFFFAOYSA-N -1 3 347.480 4.419 20 0 EIADHM O=C(c1ccc([O-])cc1)C1CCN(c2ccnc3ccsc32)CC1 ZINC000682463936 1043820841 /nfs/dbraw/zinc/82/08/41/1043820841.db2.gz ANRDQHNKNSMDRQ-UHFFFAOYSA-N -1 3 338.432 4.101 20 0 EIADHM O=C(CCOc1ccccc1)[N-]OCc1ccc(Cl)c(Cl)c1 ZINC000731841798 1043835463 /nfs/dbraw/zinc/83/54/63/1043835463.db2.gz PYZCRQTVHGGBPG-UHFFFAOYSA-N -1 3 340.206 4.010 20 0 EIADHM Cc1sc2[n-]c([C@H](C)OC(=O)/C=C/C(C)(C)C)nc(=O)c2c1C ZINC000732401426 1043915666 /nfs/dbraw/zinc/91/56/66/1043915666.db2.gz GEICICHGHMWWQT-JARNTUPDSA-N -1 3 334.441 4.220 20 0 EIADHM CSc1nc(NC(=O)c2ccc3c(c2)C(C)(C)CCC3(C)C)n[n-]1 ZINC001626106637 1043995126 /nfs/dbraw/zinc/99/51/26/1043995126.db2.gz QEORYMGMAXPHOI-UHFFFAOYSA-N -1 3 344.484 4.128 20 0 EIADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)[C@H]3CC[C@H](C)CC3)c2)n1 ZINC000521882432 1044042453 /nfs/dbraw/zinc/04/24/53/1044042453.db2.gz IENQFEBQHTWNPE-HDJSIYSDSA-N -1 3 339.439 4.176 20 0 EIADHM Cc1nc2c(s1)[C@@H](N(C)Cc1cc(C(=O)[O-])sc1C)CCC2 ZINC000522007585 1044152139 /nfs/dbraw/zinc/15/21/39/1044152139.db2.gz GCGITVREPYPXRG-ZDUSSCGKSA-N -1 3 336.482 4.029 20 0 EIADHM Cc1nonc1C(=O)[N-]c1cc(Cl)ccc1Oc1cccc(C)c1 ZINC000733909906 1044419422 /nfs/dbraw/zinc/41/94/22/1044419422.db2.gz ALHPYZZOCDXYEN-UHFFFAOYSA-N -1 3 343.770 4.384 20 0 EIADHM CCCOc1ccc(S(=O)(=O)[N-]c2cc(Cl)ccc2C)cc1 ZINC000029046658 1044677471 /nfs/dbraw/zinc/67/74/71/1044677471.db2.gz HCZJBKGXJHYBQJ-UHFFFAOYSA-N -1 3 339.844 4.238 20 0 EIADHM CC[C@@H]1CCCN(Cn2c(Cc3cccs3)n[n-]c2=S)CC1 ZINC000153335626 1044724447 /nfs/dbraw/zinc/72/44/47/1044724447.db2.gz WVKAHECKLLDWQO-CYBMUJFWSA-N -1 3 336.530 4.063 20 0 EIADHM O=S(=O)([N-]c1ccc(F)c(F)c1F)c1cccc2ccccc21 ZINC000033935129 1044769702 /nfs/dbraw/zinc/76/97/02/1044769702.db2.gz CGXPOEPLWGYYLS-UHFFFAOYSA-N -1 3 337.322 4.058 20 0 EIADHM S=c1nc(-c2ccccn2)[n-]n1CN1CCC2(CCCCC2)CC1 ZINC000735297568 1044788896 /nfs/dbraw/zinc/78/88/96/1044788896.db2.gz GDVGESDAKIXXOX-UHFFFAOYSA-N -1 3 343.500 4.006 20 0 EIADHM Cc1cc(=O)[n-]c([C@@H](C)Sc2ccc(Br)cc2)n1 ZINC000469807148 1044831918 /nfs/dbraw/zinc/83/19/18/1044831918.db2.gz FPIDTMAVZVGVLC-SECBINFHSA-N -1 3 325.231 4.106 20 0 EIADHM C[C@@H](OC(=O)c1cc2ccsc2[n-]1)c1nnc(-c2ccccc2)o1 ZINC000914890120 1044852874 /nfs/dbraw/zinc/85/28/74/1044852874.db2.gz CCQRXOINUFGSSJ-SNVBAGLBSA-N -1 3 339.376 4.197 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)Nc1ccc(-c2ncco2)cc1 ZINC000469812172 1044879430 /nfs/dbraw/zinc/87/94/30/1044879430.db2.gz XNYKKWYTTVRXQI-UHFFFAOYSA-N -1 3 340.354 4.148 20 0 EIADHM CCCCOc1ccc(CN[C@H](CC(=O)[O-])c2cccs2)cc1 ZINC000319709529 1045090093 /nfs/dbraw/zinc/09/00/93/1045090093.db2.gz NWBLSWSHSLOZDI-MRXNPFEDSA-N -1 3 333.453 4.233 20 0 EIADHM CC(C)(C(=O)[O-])[C@H]1CCCN(Cc2cccc(Cl)c2Cl)C1 ZINC000135042288 1045195610 /nfs/dbraw/zinc/19/56/10/1045195610.db2.gz SNIAOHACGSCVEF-LBPRGKRZSA-N -1 3 330.255 4.316 20 0 EIADHM O=C(Nc1ccc(Br)cc1[O-])c1ccc(F)cc1Cl ZINC000075664722 1045200637 /nfs/dbraw/zinc/20/06/37/1045200637.db2.gz GCKJRVTXCJVMJH-UHFFFAOYSA-N -1 3 344.567 4.200 20 0 EIADHM CCc1nc(C)c([C@@H](C)OC(=O)c2cc(-c3ccc(C)o3)[n-]n2)s1 ZINC000741138113 1045276245 /nfs/dbraw/zinc/27/62/45/1045276245.db2.gz SFWBXYKBPPPYSU-LLVKDONJSA-N -1 3 345.424 4.223 20 0 EIADHM CCc1nc(C)c([C@@H](C)OC(=O)c2cc(-c3ccc(C)o3)n[n-]2)s1 ZINC000741138113 1045276249 /nfs/dbraw/zinc/27/62/49/1045276249.db2.gz SFWBXYKBPPPYSU-LLVKDONJSA-N -1 3 345.424 4.223 20 0 EIADHM CCCCCCSc1nc2c(cnn2-c2ccccc2)c(=O)[n-]1 ZINC000915791419 1045465871 /nfs/dbraw/zinc/46/58/71/1045465871.db2.gz HDKHZJRKILUYLF-UHFFFAOYSA-N -1 3 328.441 4.194 20 0 EIADHM Cc1cc([N-]S(=O)(=O)c2ccc(C3CCCCC3)cc2)ccn1 ZINC000074934708 1045519348 /nfs/dbraw/zinc/51/93/48/1045519348.db2.gz UYRFHKNDGKSEOP-UHFFFAOYSA-N -1 3 330.453 4.239 20 0 EIADHM CCOc1ccc([N-]S(=O)(=O)c2c(C)cc(C)cc2C)c(C)c1 ZINC000614867543 1045569183 /nfs/dbraw/zinc/56/91/83/1045569183.db2.gz JNNVLMVCFNJNSF-UHFFFAOYSA-N -1 3 333.453 4.120 20 0 EIADHM Cc1c(C(=O)Nc2ccc(Cl)cc2[O-])cnn1-c1cccc(C)c1 ZINC000533618411 1045639991 /nfs/dbraw/zinc/63/99/91/1045639991.db2.gz IRMSWOKJIYYNOM-UHFFFAOYSA-N -1 3 341.798 4.100 20 0 EIADHM CC(C)(C)OC(=O)c1ccsc1[N-]C(=O)c1nc(Cl)cs1 ZINC000790999024 1045652104 /nfs/dbraw/zinc/65/21/04/1045652104.db2.gz UZSZJIOBYAVQDI-UHFFFAOYSA-N -1 3 344.845 4.066 20 0 EIADHM O=c1nc(CN2CCC[C@H](c3ccccc3)CC2)[n-]c2ccsc21 ZINC000066898676 1045733208 /nfs/dbraw/zinc/73/32/08/1045733208.db2.gz QRMRTECCBWZSKB-HNNXBMFYSA-N -1 3 339.464 4.167 20 0 EIADHM Cc1cc(=O)[n-]c(CSCc2csc(-c3cccs3)n2)n1 ZINC000763210434 1045749815 /nfs/dbraw/zinc/74/98/15/1045749815.db2.gz ZDIQTGVBPSMZPW-UHFFFAOYSA-N -1 3 335.479 4.109 20 0 EIADHM Cc1cc(=O)[n-]c(CS[C@H](C)c2ccccc2Br)n1 ZINC000763209323 1045749867 /nfs/dbraw/zinc/74/98/67/1045749867.db2.gz FKEHQCRKMYEWCF-SNVBAGLBSA-N -1 3 339.258 4.248 20 0 EIADHM Cc1cc(C)cc([C@H](C)NCc2nc3c4ccccc4oc3c(=O)[n-]2)c1 ZINC000107071927 1045757906 /nfs/dbraw/zinc/75/79/06/1045757906.db2.gz GNCLBVOXFDGEEX-AWEZNQCLSA-N -1 3 347.418 4.137 20 0 EIADHM COc1cc(Br)cc(Nc2ccc([O-])c(F)c2F)c1 ZINC001212011131 1045831705 /nfs/dbraw/zinc/83/17/05/1045831705.db2.gz UIESTWSBEWLLSX-UHFFFAOYSA-N -1 3 330.128 4.185 20 0 EIADHM O=C([O-])[C@@H]1CCN(Cc2ccc(Cl)cc2Cl)[C@H]2CCC[C@@H]21 ZINC000629373030 1045855635 /nfs/dbraw/zinc/85/56/35/1045855635.db2.gz IWHVDFYMMOBKRM-NFAWXSAZSA-N -1 3 328.239 4.069 20 0 EIADHM CC(C)n1cc2c(n1)[C@@H](NC(=O)c1cc([O-])c3ccccc3c1)CCC2 ZINC000792308043 1045887860 /nfs/dbraw/zinc/88/78/60/1045887860.db2.gz UPOPDHYBNTXYCV-SFHVURJKSA-N -1 3 349.434 4.130 20 0 EIADHM CCC[C@@H](NC(=O)c1cc([O-])c2ccccc2c1)[C@@H](O)c1ccccc1 ZINC000792560749 1045934582 /nfs/dbraw/zinc/93/45/82/1045934582.db2.gz MVBMTQIWFVWWQK-CTNGQTDRSA-N -1 3 349.430 4.178 20 0 EIADHM CC[C@H](C)Oc1ccccc1/C=C/C(=O)NCc1ccc([O-])c(F)c1 ZINC000769554784 1046019685 /nfs/dbraw/zinc/01/96/85/1046019685.db2.gz LUGKQKYLTVJNIE-MARXPDLDSA-N -1 3 343.398 4.038 20 0 EIADHM CCc1ccc([O-])c(C(=O)N2CC[C@H](c3cccc(Cl)c3)C2)c1 ZINC000496866997 1046085962 /nfs/dbraw/zinc/08/59/62/1046085962.db2.gz IMMKMPGFVHCQOH-HNNXBMFYSA-N -1 3 329.827 4.238 20 0 EIADHM O=C(Cc1cccc2ccccc21)[N-]OCc1ccc2ncccc2c1 ZINC000769830546 1046087903 /nfs/dbraw/zinc/08/79/03/1046087903.db2.gz RASNNSGBQQUWTP-UHFFFAOYSA-N -1 3 342.398 4.179 20 0 EIADHM O=C([O-])c1ccc(CNC2(c3cccc(C(F)(F)F)c3)CC2)cc1 ZINC000263393315 1046280556 /nfs/dbraw/zinc/28/05/56/1046280556.db2.gz FUZJIXWIXJCEPM-UHFFFAOYSA-N -1 3 335.325 4.183 20 0 EIADHM O=C([O-])[C@@H]1C[C@H]2CCCC[C@H]2N1Cc1csc(Cl)c1Cl ZINC000263454820 1046291842 /nfs/dbraw/zinc/29/18/42/1046291842.db2.gz ANPWSXLAYGWPLK-IEBDPFPHSA-N -1 3 334.268 4.273 20 0 EIADHM COc1cccc(C=C2CCN(Cc3ccc(C(=O)[O-])cc3)CC2)c1 ZINC000263508813 1046300798 /nfs/dbraw/zinc/30/07/98/1046300798.db2.gz YCSYFJGHZUBKBD-UHFFFAOYSA-N -1 3 337.419 4.073 20 0 EIADHM CCCCCC[C@@H](C)CC(=O)Nc1nc2c(cccc2C(=O)OC)[n-]1 ZINC001127418018 1046340044 /nfs/dbraw/zinc/34/00/44/1046340044.db2.gz FCCOCDJHWSNZEP-CYBMUJFWSA-N -1 3 345.443 4.285 20 0 EIADHM C[C@@H](C(=O)Nc1cc(Br)ccc1[O-])c1cccc(F)c1 ZINC000126683775 1046514604 /nfs/dbraw/zinc/51/46/04/1046514604.db2.gz TZPGEXHBFLOHEV-SECBINFHSA-N -1 3 338.176 4.036 20 0 EIADHM O=C(Cc1ccccc1Cl)[N-]OCc1ccc(C(F)(F)F)cc1 ZINC000746522890 1046552963 /nfs/dbraw/zinc/55/29/63/1046552963.db2.gz QDTNNUXERREFSM-UHFFFAOYSA-N -1 3 343.732 4.149 20 0 EIADHM Cc1ccc2c(c1)CC[C@H]2NCc1cccc([O-])c1Br ZINC000459396023 1046615567 /nfs/dbraw/zinc/61/55/67/1046615567.db2.gz QCXIQOFFUPDTJJ-OAHLLOKOSA-N -1 3 332.241 4.240 20 0 EIADHM CC(C)c1ncc(C(=O)Nc2ccc([O-])c(C(F)(F)F)c2)s1 ZINC000127161820 1046623067 /nfs/dbraw/zinc/62/30/67/1046623067.db2.gz ICZUIDDGAFAXPM-UHFFFAOYSA-N -1 3 330.331 4.243 20 0 EIADHM C[C@@H](NCc1cc(=O)[n-]c(C2CC2)n1)c1cc(Cl)ccc1Cl ZINC000459423168 1046654344 /nfs/dbraw/zinc/65/43/44/1046654344.db2.gz GLXXCCPIGQMSDE-SECBINFHSA-N -1 3 338.238 4.217 20 0 EIADHM Cc1cccc(-c2nnc([C@@H](C)OC(=O)c3cc4occc4[n-]3)o2)c1 ZINC000786033285 1046803579 /nfs/dbraw/zinc/80/35/79/1046803579.db2.gz YMGYQMYWWWOOTE-LLVKDONJSA-N -1 3 337.335 4.037 20 0 EIADHM O=C(OCc1ccc(OCc2ccccn2)cc1)c1cc2occc2[n-]1 ZINC000786031687 1046803694 /nfs/dbraw/zinc/80/36/94/1046803694.db2.gz OCBDNZHBIIXCDO-UHFFFAOYSA-N -1 3 348.358 4.092 20 0 EIADHM O=C(OCc1csc(-c2ccccc2F)n1)c1cc2occc2[n-]1 ZINC000786031958 1046804209 /nfs/dbraw/zinc/80/42/09/1046804209.db2.gz VTFHAAGINHNGQB-UHFFFAOYSA-N -1 3 342.351 4.381 20 0 EIADHM CCOc1cc(CN2CC(C)(CC(F)(F)F)C2)cc(Cl)c1[O-] ZINC000459640266 1046829420 /nfs/dbraw/zinc/82/94/20/1046829420.db2.gz PUMZQMSRTZQTKL-UHFFFAOYSA-N -1 3 337.769 4.219 20 0 EIADHM C[C@H](C(=O)Nc1cccc([O-])c1F)c1ccc(Br)s1 ZINC000128434531 1046866614 /nfs/dbraw/zinc/86/66/14/1046866614.db2.gz FAZPIFROANPOFQ-ZETCQYMHSA-N -1 3 344.205 4.098 20 0 EIADHM O=S(=O)([N-]c1c(F)cc(Cl)cc1F)c1cc2ccccc2o1 ZINC000536991390 1046882353 /nfs/dbraw/zinc/88/23/53/1046882353.db2.gz MMMBIVVLODQOOV-UHFFFAOYSA-N -1 3 343.738 4.165 20 0 EIADHM Cc1ccccc1-c1cc(=NC(=O)c2c(Cl)cccc2Cl)[nH][n-]1 ZINC000537119532 1046949128 /nfs/dbraw/zinc/94/91/28/1046949128.db2.gz RVDDGWOXAMKXNR-UHFFFAOYSA-N -1 3 346.217 4.366 20 0 EIADHM COc1cc(Cl)ccc1NC(=O)CCCc1ccc([O-])c(F)c1 ZINC000787299160 1046987320 /nfs/dbraw/zinc/98/73/20/1046987320.db2.gz GQOXMQXOLNFULO-UHFFFAOYSA-N -1 3 337.778 4.155 20 0 EIADHM C[C@H](Cc1ccc(C(F)(F)F)cc1)C(=O)Nc1cccc([O-])c1F ZINC000128671483 1047011969 /nfs/dbraw/zinc/01/19/69/1047011969.db2.gz OIUFGUQBAGVRTG-SNVBAGLBSA-N -1 3 341.304 4.367 20 0 EIADHM CCc1nc(C(C)C)ccc1C(=O)N=c1cc(-c2ccccc2C)[n-][nH]1 ZINC000497732608 1047037161 /nfs/dbraw/zinc/03/71/61/1047037161.db2.gz MVCHQCGCXJTURJ-UHFFFAOYSA-N -1 3 348.450 4.140 20 0 EIADHM CC(C)COc1ccccc1[N-]S(=O)(=O)/C=C/c1ccccc1 ZINC000917756602 1047095895 /nfs/dbraw/zinc/09/58/95/1047095895.db2.gz GZPUFCCFBGFJMZ-OUKQBFOZSA-N -1 3 331.437 4.134 20 0 EIADHM O=C(NCCc1cc2ccccc2o1)c1cc2sccc2c([O-])c1 ZINC000788308083 1047153812 /nfs/dbraw/zinc/15/38/12/1047153812.db2.gz UIDREERYAGXKHQ-UHFFFAOYSA-N -1 3 337.400 4.326 20 0 EIADHM Cc1ccc(-c2cnc(CCC(=O)Nc3cccc([O-])c3F)o2)cc1 ZINC000129046615 1047257687 /nfs/dbraw/zinc/25/76/87/1047257687.db2.gz LTRRRUIJRNLDKF-UHFFFAOYSA-N -1 3 340.354 4.066 20 0 EIADHM CC(C)(C)OCCCCO[N-]C(=O)Cc1cccc2ccccc21 ZINC000788786124 1047314268 /nfs/dbraw/zinc/31/42/68/1047314268.db2.gz GOCPCKRHGKJXLH-UHFFFAOYSA-N -1 3 329.440 4.025 20 0 EIADHM O=C(CCOc1ccc(Cl)c(Cl)c1)Nc1cccc([O-])c1F ZINC000129289489 1047345477 /nfs/dbraw/zinc/34/54/77/1047345477.db2.gz HNOCQUNSUPBWFA-UHFFFAOYSA-N -1 3 344.169 4.246 20 0 EIADHM O=C(CCCOc1ccccc1)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000476143005 1047370063 /nfs/dbraw/zinc/37/00/63/1047370063.db2.gz HAESYMMYJXUUNG-UHFFFAOYSA-N -1 3 339.313 4.209 20 0 EIADHM CS[C@@H](C(=O)Nc1ccc([O-])c(C(F)(F)F)c1)c1ccccc1 ZINC000476157802 1047389967 /nfs/dbraw/zinc/38/99/67/1047389967.db2.gz NFISFDGTAASKHJ-CQSZACIVSA-N -1 3 341.354 4.454 20 0 EIADHM Cc1cccc(OCCC(=O)Nc2ccc([O-])c(C(F)(F)F)c2)c1 ZINC000476166666 1047395178 /nfs/dbraw/zinc/39/51/78/1047395178.db2.gz PZBMLUZEPCNNNZ-UHFFFAOYSA-N -1 3 339.313 4.127 20 0 EIADHM Cc1ccc(-c2nc(C)c(C(=O)Nc3cccc([O-])c3F)s2)o1 ZINC000129499745 1047407210 /nfs/dbraw/zinc/40/72/10/1047407210.db2.gz GILHNVRCEDVWLE-UHFFFAOYSA-N -1 3 332.356 4.117 20 0 EIADHM O=C(Nc1cccc([O-])c1F)c1cc2c(cccc2Br)[nH]1 ZINC000129540819 1047422941 /nfs/dbraw/zinc/42/29/41/1047422941.db2.gz ZRYPNFWGICGZCW-UHFFFAOYSA-N -1 3 349.159 4.027 20 0 EIADHM CCOc1ccccc1OCCCC(=O)Nc1cc(Cl)ccc1[O-] ZINC000069693167 1047450188 /nfs/dbraw/zinc/45/01/88/1047450188.db2.gz UIRSQWPSNWUEGX-UHFFFAOYSA-N -1 3 349.814 4.242 20 0 EIADHM O=C(/C=C/c1ccc(Br)s1)Nc1cccc([O-])c1F ZINC000129660479 1047458020 /nfs/dbraw/zinc/45/80/20/1047458020.db2.gz WAQAAKSWQWNNEF-FNORWQNLSA-N -1 3 342.189 4.007 20 0 EIADHM CCCOc1cc(OC)ccc1C(=O)Nc1ccc(Cl)cc1[O-] ZINC000476338516 1047473122 /nfs/dbraw/zinc/47/31/22/1047473122.db2.gz YETGLRZHRYNDDK-UHFFFAOYSA-N -1 3 335.787 4.095 20 0 EIADHM O=C(Nc1cccc([O-])c1F)c1cnc(-c2ccccc2F)s1 ZINC000129721534 1047491339 /nfs/dbraw/zinc/49/13/39/1047491339.db2.gz JRDKIVBDJMDZIF-UHFFFAOYSA-N -1 3 332.331 4.046 20 0 EIADHM CC(C)[C@@H](OC(=O)c1cc(Cl)c(Cl)[n-]1)C(=O)c1ccccc1 ZINC000919046255 1047739632 /nfs/dbraw/zinc/73/96/32/1047739632.db2.gz HZPNHYQHPCWGHB-CQSZACIVSA-N -1 3 340.206 4.386 20 0 EIADHM CC(C)c1ccc(C(=O)NC[C@@H](C)Oc2ccc(Cl)cc2)c([O-])c1 ZINC001136978730 1048021123 /nfs/dbraw/zinc/02/11/23/1048021123.db2.gz OCDOQQLNAKUGRS-CYBMUJFWSA-N -1 3 347.842 4.366 20 0 EIADHM CC(C)c1ccc(C(=O)NC[C@H](C)Oc2ccc(Cl)cc2)c([O-])c1 ZINC001136978731 1048022208 /nfs/dbraw/zinc/02/22/08/1048022208.db2.gz OCDOQQLNAKUGRS-ZDUSSCGKSA-N -1 3 347.842 4.366 20 0 EIADHM CC[C@H](NCc1cccnc1OC)c1ccc(Cl)c(Cl)c1[O-] ZINC000155081844 1048053652 /nfs/dbraw/zinc/05/36/52/1048053652.db2.gz FXDDOKABEGBNJE-ZDUSSCGKSA-N -1 3 341.238 4.344 20 0 EIADHM CC(C)c1cnc(SCc2cc(=O)[n-]c(C3CC3)n2)n1C(C)C ZINC000556840295 1048054554 /nfs/dbraw/zinc/05/45/54/1048054554.db2.gz NDUFFZMZHODTBR-UHFFFAOYSA-N -1 3 332.473 4.253 20 0 EIADHM CCCCCC[C@H](C)CC(=O)NCc1cc(=O)[n-]c(C2CCC2)n1 ZINC000825298558 1048066583 /nfs/dbraw/zinc/06/65/83/1048066583.db2.gz UUNFLWWGVDKGHG-AWEZNQCLSA-N -1 3 333.476 4.063 20 0 EIADHM C[C@H](NCc1nnc(-c2ccccc2[O-])o1)c1ccc(F)cc1Cl ZINC001170572101 1048230932 /nfs/dbraw/zinc/23/09/32/1048230932.db2.gz LVBBWZUYSFAZBB-JTQLQIEISA-N -1 3 347.777 4.086 20 0 EIADHM CCc1ccc(-c2nc(Cc3c[nH]c4cc(C)ccc34)no2)c([O-])c1 ZINC000809370575 1048341076 /nfs/dbraw/zinc/34/10/76/1048341076.db2.gz GAOMHBKMUOBDMT-UHFFFAOYSA-N -1 3 333.391 4.385 20 0 EIADHM CC(C)(C)[C@@H]1CCCC[C@H]1CNC(=O)c1cc(=O)c2ccccc2[n-]1 ZINC000920043550 1048394552 /nfs/dbraw/zinc/39/45/52/1048394552.db2.gz RZACEXPFRIMYJZ-GOEBONIOSA-N -1 3 340.467 4.110 20 0 EIADHM CSCCc1ccccc1NC(=O)c1cc2c(cc1[O-])CCCC2 ZINC001170591632 1048575647 /nfs/dbraw/zinc/57/56/47/1048575647.db2.gz AHZVMKPFCGNHJG-UHFFFAOYSA-N -1 3 341.476 4.429 20 0 EIADHM Cc1sc2[n-]c([C@H](C)OC(=O)[C@@H]3C[C@H]3C3CCC3)nc(=O)c2c1C ZINC000845222545 1048616317 /nfs/dbraw/zinc/61/63/17/1048616317.db2.gz FGBBETIFOUHWPW-TVYUQYBPSA-N -1 3 346.452 4.054 20 0 EIADHM CC(F)(F)C(=O)Nc1ccc([O-])c(-c2nc3ccccc3s2)c1 ZINC000815850214 1048623813 /nfs/dbraw/zinc/62/38/13/1048623813.db2.gz CATTYTKVFNUNGB-UHFFFAOYSA-N -1 3 334.347 4.263 20 0 EIADHM O=C(CCC(=O)c1ccc(Cl)cc1)Nc1cc(Cl)ccc1[O-] ZINC000075288817 1048715401 /nfs/dbraw/zinc/71/54/01/1048715401.db2.gz FTYHMAPCDABQKN-UHFFFAOYSA-N -1 3 338.190 4.301 20 0 EIADHM COc1cccc([C@H]2CCCN(Cc3c(F)cc([O-])cc3F)C2)c1 ZINC001144561975 1048730768 /nfs/dbraw/zinc/73/07/68/1048730768.db2.gz SFYNXSHEMUYVRH-AWEZNQCLSA-N -1 3 333.378 4.059 20 0 EIADHM CCC/C(C)=C\C(=O)O[C@@H](C)c1nc(=O)c2c(C)c(C)sc2[n-]1 ZINC000920694118 1048750688 /nfs/dbraw/zinc/75/06/88/1048750688.db2.gz UTCMBFHLMPVUCV-IQQGHNRFSA-N -1 3 334.441 4.364 20 0 EIADHM CCN(Cc1sccc1C(=O)[O-])Cc1cccc(C(F)(F)F)c1 ZINC001144680834 1048800728 /nfs/dbraw/zinc/80/07/28/1048800728.db2.gz WKZOYZUVCYSKSJ-UHFFFAOYSA-N -1 3 343.370 4.487 20 0 EIADHM [O-]c1ccc(F)c(CN2CCC[C@@H](c3nc4ccccc4o3)C2)c1F ZINC000816484950 1048812579 /nfs/dbraw/zinc/81/25/79/1048812579.db2.gz ULMOUWISMVCANL-GFCCVEGCSA-N -1 3 344.361 4.191 20 0 EIADHM O=C(Cc1ccc(C2CC2)cc1)Nc1cc(Br)ccc1[O-] ZINC001144719450 1048818155 /nfs/dbraw/zinc/81/81/55/1048818155.db2.gz JKOMRDVTOWUGJI-UHFFFAOYSA-N -1 3 346.224 4.213 20 0 EIADHM O=C([N-][C@H]1CCc2cc(F)ccc21)C(F)(F)c1cccc(Cl)c1 ZINC000921007796 1048838314 /nfs/dbraw/zinc/83/83/14/1048838314.db2.gz YQXITHMXMCETAB-HNNXBMFYSA-N -1 3 339.744 4.375 20 0 EIADHM CC(=O)c1cccc(COC(=O)c2cc3cc(Cl)sc3[n-]2)c1 ZINC000810641655 1048839297 /nfs/dbraw/zinc/83/92/97/1048839297.db2.gz FEGJPNATFXKCAX-UHFFFAOYSA-N -1 3 333.796 4.442 20 0 EIADHM Cc1ccccc1[C@@H](O)C1CCN(Cc2cccc([O-])c2Cl)CC1 ZINC000816609006 1048843624 /nfs/dbraw/zinc/84/36/24/1048843624.db2.gz PUWDXZOKBFVROV-FQEVSTJZSA-N -1 3 345.870 4.300 20 0 EIADHM CC1(C)CCc2sc([N-]C(=O)c3snc(Cl)c3Cl)nc21 ZINC000846265369 1048851678 /nfs/dbraw/zinc/85/16/78/1048851678.db2.gz JYAZYUMAXODHCO-UHFFFAOYSA-N -1 3 348.280 4.383 20 0 EIADHM O=C(OCc1csc(Cl)n1)c1cc2cc(Cl)sc2[n-]1 ZINC000810698174 1048852711 /nfs/dbraw/zinc/85/27/11/1048852711.db2.gz WWWFEOZYSHPRBK-UHFFFAOYSA-N -1 3 333.221 4.350 20 0 EIADHM O=C(Nc1c([O-])cccc1Cl)c1cc2ccccc2c(Cl)n1 ZINC000816768726 1048856456 /nfs/dbraw/zinc/85/64/56/1048856456.db2.gz DCFUDBDSYCFKCL-UHFFFAOYSA-N -1 3 333.174 4.500 20 0 EIADHM Cc1ccc(C(=O)COC(=O)c2cc3cc(Cl)sc3[n-]2)cc1 ZINC000811394448 1049051011 /nfs/dbraw/zinc/05/10/11/1049051011.db2.gz DECAFIRXODERRG-UHFFFAOYSA-N -1 3 333.796 4.231 20 0 EIADHM O=C(COC(=O)c1cc2cc(Cl)sc2[n-]1)c1ccc(F)cc1 ZINC000811393223 1049051090 /nfs/dbraw/zinc/05/10/90/1049051090.db2.gz AAMOMYXCSINWSZ-UHFFFAOYSA-N -1 3 337.759 4.062 20 0 EIADHM O=C(c1cc2sccc2c([O-])c1)N1CC[C@@H](c2ccccc2F)C1 ZINC000818027313 1049082918 /nfs/dbraw/zinc/08/29/18/1049082918.db2.gz ORBMLGVLQMXWLN-GFCCVEGCSA-N -1 3 341.407 4.376 20 0 EIADHM CCc1cc(C(=O)Nc2cc(Br)ccc2[O-])cs1 ZINC001147710682 1049202532 /nfs/dbraw/zinc/20/25/32/1049202532.db2.gz MVMHDYIPZRJKDG-UHFFFAOYSA-N -1 3 326.215 4.031 20 0 EIADHM COc1ccc(F)c(C(=O)[N-]c2ccccc2SC(C)(C)C)n1 ZINC001147778304 1049215649 /nfs/dbraw/zinc/21/56/49/1049215649.db2.gz SKBBAAVEOCJJIM-UHFFFAOYSA-N -1 3 334.416 4.372 20 0 EIADHM CCc1ccc(NC(=O)c2ccc(C(=O)c3ccccc3)cc2)c([O-])c1 ZINC001148291397 1049298599 /nfs/dbraw/zinc/29/85/99/1049298599.db2.gz PQXXABQBXBVBBY-UHFFFAOYSA-N -1 3 345.398 4.438 20 0 EIADHM CC(=O)c1cc(C(=O)Nc2cc3nc(C)sc3cc2C)ccc1[O-] ZINC001148663998 1049355834 /nfs/dbraw/zinc/35/58/34/1049355834.db2.gz GQMUIDJMNRKYOY-UHFFFAOYSA-N -1 3 340.404 4.074 20 0 EIADHM CC(=O)c1cc(C(=O)N[C@@H](c2ccccc2)C2CCCC2)ccc1[O-] ZINC001148668685 1049356360 /nfs/dbraw/zinc/35/63/60/1049356360.db2.gz HWQCKFQJPSXOHQ-FQEVSTJZSA-N -1 3 337.419 4.256 20 0 EIADHM CC(=O)c1cccc([O-])c1NC(=O)c1cccc(C(F)(F)F)c1C ZINC001148746035 1049366849 /nfs/dbraw/zinc/36/68/49/1049366849.db2.gz VPDAQJLPRBVLFZ-UHFFFAOYSA-N -1 3 337.297 4.174 20 0 EIADHM CCCOc1ccc(Cl)cc1[N-]C(=O)c1nnc(-c2ccco2)o1 ZINC001136302051 1049427678 /nfs/dbraw/zinc/42/76/78/1049427678.db2.gz WBUQBRCIXOPKPL-UHFFFAOYSA-N -1 3 347.758 4.024 20 0 EIADHM CC(=O)c1ccc(C(=O)N[C@@H](C)c2oc3ccccc3c2C)cc1[O-] ZINC001136375036 1049547561 /nfs/dbraw/zinc/54/75/61/1049547561.db2.gz AHYHTMLVYLEJLJ-LBPRGKRZSA-N -1 3 337.375 4.140 20 0 EIADHM CC(=O)c1ccc(C(=O)N[C@H](C)c2oc3ccccc3c2C)cc1[O-] ZINC001136375035 1049547927 /nfs/dbraw/zinc/54/79/27/1049547927.db2.gz AHYHTMLVYLEJLJ-GFCCVEGCSA-N -1 3 337.375 4.140 20 0 EIADHM O=C(OCc1noc(C2CCCCC2)n1)c1cc(Cl)c(Cl)[n-]1 ZINC000773126910 1049594508 /nfs/dbraw/zinc/59/45/08/1049594508.db2.gz UVAKBMYTVPLBNR-UHFFFAOYSA-N -1 3 344.198 4.109 20 0 EIADHM CC[C@@H](CNC(=O)c1cc([O-])cc(Br)c1)c1ccccc1 ZINC001136514122 1049711635 /nfs/dbraw/zinc/71/16/35/1049711635.db2.gz VQYOXLIWRKJQBF-LBPRGKRZSA-N -1 3 348.240 4.078 20 0 EIADHM CCc1cccc(C(=O)Nc2cc(C(C)(C)C)nn2C(C)(C)C)c1[O-] ZINC001136602976 1049779430 /nfs/dbraw/zinc/77/94/30/1049779430.db2.gz GAKLWVZSJZIVGD-UHFFFAOYSA-N -1 3 343.471 4.456 20 0 EIADHM CC(C)C[C@H]([N-]S(=O)(=O)c1cc(F)ccc1F)c1cccs1 ZINC000616021197 1049830677 /nfs/dbraw/zinc/83/06/77/1049830677.db2.gz AUDNXRRVEYVEFQ-ZDUSSCGKSA-N -1 3 345.436 4.092 20 0 EIADHM CCCCN(C)c1ccc(NC(=O)c2cccc(CC)c2[O-])cc1 ZINC001136700981 1049839001 /nfs/dbraw/zinc/83/90/01/1049839001.db2.gz JRFCBDZEEJUTMR-UHFFFAOYSA-N -1 3 326.440 4.443 20 0 EIADHM CC(C)OC(=O)[C@H](OC(=O)c1cc2ccsc2[n-]1)c1ccccc1 ZINC000813966188 1049844080 /nfs/dbraw/zinc/84/40/80/1049844080.db2.gz CQMCTSLLKGFLAK-OAHLLOKOSA-N -1 3 343.404 4.079 20 0 EIADHM Cc1cc(F)ccc1C[C@@H](C)NC(=O)CCCc1ccc([O-])c(F)c1 ZINC000617320184 1049979534 /nfs/dbraw/zinc/97/95/34/1049979534.db2.gz KWZUPXIZAWBKNT-CQSZACIVSA-N -1 3 347.405 4.049 20 0 EIADHM C[C@H](C(=O)Nc1cc(Br)ccc1[O-])c1ccccc1F ZINC000085591466 1050037262 /nfs/dbraw/zinc/03/72/62/1050037262.db2.gz QXXLMOAKLLEFQW-VIFPVBQESA-N -1 3 338.176 4.036 20 0 EIADHM CC(=O)c1cccc([O-])c1NC(=O)c1cc(C(F)(F)F)ccc1C ZINC001186268601 1050276972 /nfs/dbraw/zinc/27/69/72/1050276972.db2.gz KXDIZFCEYKGMSY-UHFFFAOYSA-N -1 3 337.297 4.174 20 0 EIADHM CC[C@@H](CNC(=O)c1cc([O-])c2ccccc2c1)CC(F)(F)F ZINC000412659474 1050310056 /nfs/dbraw/zinc/31/00/56/1050310056.db2.gz SLLYDVLRRZMNIU-LLVKDONJSA-N -1 3 325.330 4.254 20 0 EIADHM [O-]c1cncc(-c2nc(-c3cccc(Oc4ccccc4)c3)no2)c1 ZINC001212708499 1050330695 /nfs/dbraw/zinc/33/06/95/1050330695.db2.gz KLLPTJANKNTOGI-UHFFFAOYSA-N -1 3 331.331 4.297 20 0 EIADHM CSc1ccc(NC(=O)Nc2nc3c(cccc3[O-])s2)cc1 ZINC001188073599 1050691585 /nfs/dbraw/zinc/69/15/85/1050691585.db2.gz MKWDCCQUDHPTFX-UHFFFAOYSA-N -1 3 331.422 4.368 20 0 EIADHM O=C([N-]c1ccnc(Cl)c1Cl)c1ncsc1C(F)(F)F ZINC001188207757 1050726980 /nfs/dbraw/zinc/72/69/80/1050726980.db2.gz VSJWSUZIZDDRCU-UHFFFAOYSA-N -1 3 342.129 4.116 20 0 EIADHM COc1ccc(OC)c(NC(=O)Nc2cc3ccccc3cc2[O-])c1 ZINC001188345731 1050749271 /nfs/dbraw/zinc/74/92/71/1050749271.db2.gz GEMCMKSEFUUHRM-UHFFFAOYSA-N -1 3 338.363 4.207 20 0 EIADHM COc1ccc(NC(=O)[N-]c2cc(-c3cccs3)no2)c(OC)c1 ZINC001188512694 1050790337 /nfs/dbraw/zinc/79/03/37/1050790337.db2.gz OEYVAGONASJIEP-UHFFFAOYSA-N -1 3 345.380 4.064 20 0 EIADHM Cc1cccc([O-])c1C(=O)N1CC[C@@H](c2ccc(C(F)(F)F)cc2)C1 ZINC001188646191 1050813114 /nfs/dbraw/zinc/81/31/14/1050813114.db2.gz ASLGMGXONQVJOU-CQSZACIVSA-N -1 3 349.352 4.349 20 0 EIADHM Cc1cccc([O-])c1C(=O)Nc1ccc(N2CCC(F)(F)CC2)cc1 ZINC001188654912 1050814524 /nfs/dbraw/zinc/81/45/24/1050814524.db2.gz JLKJZJBPVNQGDG-UHFFFAOYSA-N -1 3 346.377 4.188 20 0 EIADHM O=C(c1cccc(Nc2cc([O-])c(F)cc2F)c1)N1CCCCC1 ZINC001174173844 1050815427 /nfs/dbraw/zinc/81/54/27/1050815427.db2.gz QGFRVEHTKUFDNV-UHFFFAOYSA-N -1 3 332.350 4.040 20 0 EIADHM CC[C@@H]1CN(C)c2ccccc2CN1Cc1cccc([O-])c1Cl ZINC001179975354 1050837580 /nfs/dbraw/zinc/83/75/80/1050837580.db2.gz WJOZQZULIKQLHL-MRXNPFEDSA-N -1 3 330.859 4.276 20 0 EIADHM CC(C)(C)c1cnc(SCc2cc(=O)[n-]c(-c3ccccc3)n2)o1 ZINC001188971797 1050876503 /nfs/dbraw/zinc/87/65/03/1050876503.db2.gz RVMUYOIIPUSUAE-UHFFFAOYSA-N -1 3 341.436 4.427 20 0 EIADHM Cc1c(F)cccc1NC(=O)Nc1ccc([O-])c(Br)c1 ZINC001189050583 1050894972 /nfs/dbraw/zinc/89/49/72/1050894972.db2.gz HNNWQWIQNMYLEC-UHFFFAOYSA-N -1 3 339.164 4.246 20 0 EIADHM Cc1cccc(CCC(=O)Nc2cc(Br)ccc2[O-])c1 ZINC001180165885 1050907523 /nfs/dbraw/zinc/90/75/23/1050907523.db2.gz HRXYYYQSCZEVBP-UHFFFAOYSA-N -1 3 334.213 4.034 20 0 EIADHM O=C(Nc1cc(=O)[n-]c(C2CC2)n1)Nc1cccc(Cl)c1Cl ZINC001189194679 1050923842 /nfs/dbraw/zinc/92/38/42/1050923842.db2.gz MTOQPDDQBALKON-UHFFFAOYSA-N -1 3 339.182 4.010 20 0 EIADHM CCCc1c(NCc2ccc([O-])c(F)c2)cnn1-c1cccc(F)c1 ZINC001180317742 1050950648 /nfs/dbraw/zinc/95/06/48/1050950648.db2.gz NCCYYUBEYPNGIC-UHFFFAOYSA-N -1 3 343.377 4.421 20 0 EIADHM CC(=O)c1ccc(C(=O)N2CC=C(c3cccc(C)c3C)CC2)cc1[O-] ZINC001180319452 1050960287 /nfs/dbraw/zinc/96/02/87/1050960287.db2.gz DGEHRTGDKSQGBL-UHFFFAOYSA-N -1 3 349.430 4.141 20 0 EIADHM Cc1oc(-c2cccs2)nc1CC(=O)Nc1ccc(Cl)cc1[O-] ZINC000153422338 1051037112 /nfs/dbraw/zinc/03/71/12/1051037112.db2.gz BQCLCYIPLRQXMN-UHFFFAOYSA-N -1 3 348.811 4.252 20 0 EIADHM [O-]c1c(F)cc(Br)cc1Nc1cccc(-c2cc[nH]n2)c1 ZINC001174509072 1051041064 /nfs/dbraw/zinc/04/10/64/1051041064.db2.gz BSNWDVOVIIOKJY-UHFFFAOYSA-N -1 3 348.175 4.428 20 0 EIADHM CCCCC[C@@H]1CCCCN1C(=O)c1cc(=O)c2ccccc2[n-]1 ZINC000620563778 1051156094 /nfs/dbraw/zinc/15/60/94/1051156094.db2.gz QAGCXGYDXJKQJF-OAHLLOKOSA-N -1 3 326.440 4.103 20 0 EIADHM CCCOc1ccc([N-]S(=O)(=O)c2ccc(C3CC3)cc2)cc1 ZINC001190497544 1051209826 /nfs/dbraw/zinc/20/98/26/1051209826.db2.gz NXHRBJROGLOXHL-UHFFFAOYSA-N -1 3 331.437 4.154 20 0 EIADHM COc1cc(C)c(S(=O)(=O)[N-]c2ccccc2C(C)(C)C)c(C)c1 ZINC000096659403 1051216573 /nfs/dbraw/zinc/21/65/73/1051216573.db2.gz VWIWUFOVSIWBSV-UHFFFAOYSA-N -1 3 347.480 4.410 20 0 EIADHM O=C(Nc1cc([O-])cc(Cl)c1)c1csc(-c2cccs2)n1 ZINC001190574649 1051220816 /nfs/dbraw/zinc/22/08/16/1051220816.db2.gz HZLHRNMEOOAJRO-UHFFFAOYSA-N -1 3 336.825 4.483 20 0 EIADHM CCc1ccc(C(=O)N2CCC3(C=Cc4ccccc4O3)CC2)c([O-])c1 ZINC000620720478 1051244000 /nfs/dbraw/zinc/24/40/00/1051244000.db2.gz HEMWRXZETPLSEE-UHFFFAOYSA-N -1 3 349.430 4.035 20 0 EIADHM O=C(CCc1cccc(OC(F)(F)F)c1)Nc1ccc(F)c([O-])c1 ZINC001181685233 1051268805 /nfs/dbraw/zinc/26/88/05/1051268805.db2.gz NVNVLXKQUDFLQQ-UHFFFAOYSA-N -1 3 343.276 4.001 20 0 EIADHM CCOc1cc(F)cc(Nc2cccc([O-])c2Br)c1 ZINC001175005797 1051289003 /nfs/dbraw/zinc/28/90/03/1051289003.db2.gz QFNNZPRWTBYNIE-UHFFFAOYSA-N -1 3 326.165 4.436 20 0 EIADHM Cc1ccc([C@@H]2CCCCN2C(=O)c2ccc(=O)[n-]c2Cl)cc1C ZINC001190910688 1051307873 /nfs/dbraw/zinc/30/78/73/1051307873.db2.gz VNQSSPMSHGQIAE-INIZCTEOSA-N -1 3 344.842 4.425 20 0 EIADHM Cc1cnc(Br)cc1Nc1cc(Cl)c([O-])cc1F ZINC001250020773 1051309455 /nfs/dbraw/zinc/30/94/55/1051309455.db2.gz QRRCZKMESHCMGY-UHFFFAOYSA-N -1 3 331.572 4.394 20 0 EIADHM [O-]c1cc(F)c(Nc2cc(Br)cc(F)c2O)c(F)c1 ZINC001175099863 1051345150 /nfs/dbraw/zinc/34/51/50/1051345150.db2.gz UOAPBVNBUGSACU-UHFFFAOYSA-N -1 3 334.091 4.021 20 0 EIADHM CC(=O)c1c(Br)cccc1Nc1c(F)cc([O-])cc1F ZINC001175099782 1051345305 /nfs/dbraw/zinc/34/53/05/1051345305.db2.gz SNEBTWUSBUVVNN-UHFFFAOYSA-N -1 3 342.139 4.379 20 0 EIADHM COc1cc(Br)c(Nc2c(F)cc([O-])cc2F)cc1F ZINC001175099617 1051346212 /nfs/dbraw/zinc/34/62/12/1051346212.db2.gz PTCXOAUJBWNSBE-UHFFFAOYSA-N -1 3 348.118 4.324 20 0 EIADHM O=C(c1cccc(F)c1Nc1c(F)cc([O-])cc1F)C(F)(F)F ZINC001175102972 1051351996 /nfs/dbraw/zinc/35/19/96/1051351996.db2.gz QDECZLIWNGZERD-UHFFFAOYSA-N -1 3 335.203 4.298 20 0 EIADHM O=c1cc(Nc2cc(C(F)(F)F)ccc2F)[n-]n1-c1ccccc1 ZINC001175076283 1051366281 /nfs/dbraw/zinc/36/62/81/1051366281.db2.gz RPPUHNCYFGAVFO-UHFFFAOYSA-N -1 3 337.276 4.479 20 0 EIADHM CNc1cccc(Br)c1Nc1c(F)cc([O-])cc1F ZINC001175096488 1051379639 /nfs/dbraw/zinc/37/96/39/1051379639.db2.gz BLPPXBLSHGMBSB-UHFFFAOYSA-N -1 3 329.144 4.218 20 0 EIADHM Cc1c(Br)ccc(N)c1Nc1c(F)cc([O-])cc1F ZINC001175096573 1051380705 /nfs/dbraw/zinc/38/07/05/1051380705.db2.gz DJAKQXITLPSITG-UHFFFAOYSA-N -1 3 329.144 4.067 20 0 EIADHM O=C(CCc1cccc(OC2CCCC2)c1)[N-]Oc1ccccc1 ZINC000773467061 1051382184 /nfs/dbraw/zinc/38/21/84/1051382184.db2.gz RPIAPHFZSFSFHJ-UHFFFAOYSA-N -1 3 325.408 4.051 20 0 EIADHM CC1(C)CCC(C)(C[N-]S(=O)(=O)c2ccc(Cl)cc2F)CC1 ZINC001191394062 1051439077 /nfs/dbraw/zinc/43/90/77/1051439077.db2.gz FMJWSAYSMCTWIO-UHFFFAOYSA-N -1 3 347.883 4.364 20 0 EIADHM CC1(C)[C@@H](C(F)(F)F)CCN1C(=O)c1cc2sccc2c([O-])c1 ZINC000774101494 1051454564 /nfs/dbraw/zinc/45/45/64/1051454564.db2.gz LTYHJCQWLKJJSH-ZDUSSCGKSA-N -1 3 343.370 4.410 20 0 EIADHM Cc1cc(OCc2ccccc2)ccc1Nc1ccc(C(N)=O)c([O-])c1 ZINC001175232159 1051460600 /nfs/dbraw/zinc/46/06/00/1051460600.db2.gz YRKTWPSDUBPGTD-UHFFFAOYSA-N -1 3 348.402 4.122 20 0 EIADHM CCN(Cc1cc(=O)[n-]c(-c2ccccc2)n1)c1cc(C)cc(C)c1 ZINC001191635526 1051496544 /nfs/dbraw/zinc/49/65/44/1051496544.db2.gz IMMCFORWERBIRO-UHFFFAOYSA-N -1 3 333.435 4.493 20 0 EIADHM [O-]c1ccc(F)c(Nc2ccc(F)c(F)c2Br)c1F ZINC001175264228 1051500384 /nfs/dbraw/zinc/50/03/84/1051500384.db2.gz CNLSKEIERNGLPL-UHFFFAOYSA-N -1 3 336.082 4.455 20 0 EIADHM [O-]c1ccc(F)c(Nc2cc(Br)c(F)cc2F)c1F ZINC001175264098 1051501264 /nfs/dbraw/zinc/50/12/64/1051501264.db2.gz AFSVXWSKNNZJPF-UHFFFAOYSA-N -1 3 336.082 4.455 20 0 EIADHM [O-]c1ccc(F)c(Nc2cncc(Br)c2Cl)c1F ZINC001175263375 1051501892 /nfs/dbraw/zinc/50/18/92/1051501892.db2.gz TVJJMHDMTLCAQG-UHFFFAOYSA-N -1 3 335.535 4.225 20 0 EIADHM CCOC(=O)c1cnc2cc(Nc3c(F)ccc([O-])c3F)ccc2c1 ZINC001175270368 1051505719 /nfs/dbraw/zinc/50/57/19/1051505719.db2.gz YUQPOCLQQZTAJH-UHFFFAOYSA-N -1 3 344.317 4.139 20 0 EIADHM [O-]c1ccc(F)c(Nc2ccc(F)c(Br)c2F)c1F ZINC001175270187 1051507571 /nfs/dbraw/zinc/50/75/71/1051507571.db2.gz VXYFLIDGXAMAJB-UHFFFAOYSA-N -1 3 336.082 4.455 20 0 EIADHM CCOC(=O)CCc1ccc(Nc2c(F)ccc([O-])c2F)cc1F ZINC001175271562 1051508990 /nfs/dbraw/zinc/50/89/90/1051508990.db2.gz VHQIPUIZIWUZEQ-UHFFFAOYSA-N -1 3 339.313 4.049 20 0 EIADHM Cc1noc(C2CC2)c1[N-]C(=O)c1csc(-c2ccc(F)cc2)n1 ZINC000156731068 1051558436 /nfs/dbraw/zinc/55/84/36/1051558436.db2.gz NKADYXPKHZNJPI-UHFFFAOYSA-N -1 3 343.383 4.375 20 0 EIADHM CSc1ccccc1[N-]S(=O)(=O)Cc1ccc(Cl)cc1F ZINC001191898332 1051581428 /nfs/dbraw/zinc/58/14/28/1051581428.db2.gz QHYHRVGSYPMGOG-UHFFFAOYSA-N -1 3 345.848 4.143 20 0 EIADHM COc1ccc(Nc2ccc(-c3nn[n-]n3)cc2)cc1-c1ccccc1 ZINC001175429880 1051587534 /nfs/dbraw/zinc/58/75/34/1051587534.db2.gz TVGPDLYUHXZLFH-UHFFFAOYSA-N -1 3 343.390 4.286 20 0 EIADHM [O-]c1ccc(CNC2(c3ccc(C(F)(F)F)cc3)CC2)c(F)c1F ZINC001182653701 1051668929 /nfs/dbraw/zinc/66/89/29/1051668929.db2.gz LKXINQUJGDZYMF-UHFFFAOYSA-N -1 3 343.295 4.468 20 0 EIADHM CN(CC/C=C/c1cccnc1)C(=O)c1ccc(C(C)(C)C)cc1[O-] ZINC001192322555 1051688975 /nfs/dbraw/zinc/68/89/75/1051688975.db2.gz DKAZOMFKMUIQSX-VMPITWQZSA-N -1 3 338.451 4.260 20 0 EIADHM CC(C)(C)c1ccc(C(=O)N[C@@H](c2ncccc2F)C2CC2)c([O-])c1 ZINC001192341249 1051694948 /nfs/dbraw/zinc/69/49/48/1051694948.db2.gz WAVJRMLNSXZMEP-QGZVFWFLSA-N -1 3 342.414 4.105 20 0 EIADHM CCc1c(Br)cccc1C(=O)Nc1ccc(F)c([O-])c1 ZINC001192419176 1051714923 /nfs/dbraw/zinc/71/49/23/1051714923.db2.gz PNRXPCRMOPSTNB-UHFFFAOYSA-N -1 3 338.176 4.109 20 0 EIADHM CCCC[C@H](C)NC(=O)Nc1ccc(C(=O)OC(C)(C)C)cc1[O-] ZINC001193073332 1051861426 /nfs/dbraw/zinc/86/14/26/1051861426.db2.gz WXEIDCKPNMHIQM-LBPRGKRZSA-N -1 3 336.432 4.048 20 0 EIADHM O=C(CC1CCC(C(F)(F)F)CC1)[N-]OCc1ccc(F)cc1 ZINC000184169876 1051862687 /nfs/dbraw/zinc/86/26/87/1051862687.db2.gz IPXPSIXLXZSYQW-UHFFFAOYSA-N -1 3 333.325 4.132 20 0 EIADHM Cc1ccc2ccc(F)c([N-]c3nc4c(s3)C(=O)CCC4)c2n1 ZINC001176114249 1051917129 /nfs/dbraw/zinc/91/71/29/1051917129.db2.gz QDTCVRVYUIYHDP-UHFFFAOYSA-N -1 3 327.384 4.401 20 0 EIADHM O=S(=O)([N-]CC[C@H]1CC=CCC1)c1c(Cl)cccc1Cl ZINC001193597164 1051946167 /nfs/dbraw/zinc/94/61/67/1051946167.db2.gz XWOVSFWAGQJAAM-NSHDSACASA-N -1 3 334.268 4.018 20 0 EIADHM CCOc1ccc(C)cc1NC(=O)c1ccc([O-])cc1C(F)(F)F ZINC001193745577 1051990720 /nfs/dbraw/zinc/99/07/20/1051990720.db2.gz KCMDYWHDOISZQL-UHFFFAOYSA-N -1 3 339.313 4.370 20 0 EIADHM Cc1nc2c(cccc2NC(=O)c2ccc([O-])cc2C(F)(F)F)o1 ZINC001193745878 1051991706 /nfs/dbraw/zinc/99/17/06/1051991706.db2.gz MUPJVNXWLDDKSI-UHFFFAOYSA-N -1 3 336.269 4.113 20 0 EIADHM Cc1cnc(Cl)c([N-]S(=O)(=O)c2ccc(C)c3ccccc32)c1 ZINC001193832833 1052006425 /nfs/dbraw/zinc/00/64/25/1052006425.db2.gz DGZDDHWOPAZEMB-UHFFFAOYSA-N -1 3 346.839 4.306 20 0 EIADHM Cc1ccc(F)c([N-]S(=O)(=O)c2ccc(C)c3ccccc32)c1 ZINC001193864689 1052019516 /nfs/dbraw/zinc/01/95/16/1052019516.db2.gz RRRAKDADZMICAI-UHFFFAOYSA-N -1 3 329.396 4.397 20 0 EIADHM Cc1cc(F)c([N-]S(=O)(=O)c2ccc(C)c3ccccc32)cc1O ZINC001193864076 1052019713 /nfs/dbraw/zinc/01/97/13/1052019713.db2.gz OGVJMVXFUZQBOI-UHFFFAOYSA-N -1 3 345.395 4.102 20 0 EIADHM CC[C@H](C)n1ncc(NC(=O)c2cc([O-])cc(C(F)(F)F)c2)c1C ZINC000621971123 1052044889 /nfs/dbraw/zinc/04/48/89/1052044889.db2.gz CLDPLOHRBQRJBZ-VIFPVBQESA-N -1 3 341.333 4.139 20 0 EIADHM CC(C)COc1ccc(CN[C@@H](CC(=O)[O-])c2cccs2)cc1 ZINC000671162179 1052074415 /nfs/dbraw/zinc/07/44/15/1052074415.db2.gz NIVVVQLEWOJQRI-INIZCTEOSA-N -1 3 333.453 4.089 20 0 EIADHM O=C(Nc1cc(Br)ccc1[O-])c1ccc(C2CC2)cc1 ZINC001194172139 1052096653 /nfs/dbraw/zinc/09/66/53/1052096653.db2.gz LFALKBAOXXMZIB-UHFFFAOYSA-N -1 3 332.197 4.284 20 0 EIADHM CC(C)[C@H]1N(C(=O)c2cc([O-])cc(C(F)(F)F)c2)CC12CCC2 ZINC000622062325 1052101185 /nfs/dbraw/zinc/10/11/85/1052101185.db2.gz DEVYZMNJEVJHAP-CQSZACIVSA-N -1 3 327.346 4.062 20 0 EIADHM CC(C)Oc1ccc(Cl)cc1Nc1cccc(C(=O)N(C)C)c1[O-] ZINC001176645103 1052153485 /nfs/dbraw/zinc/15/34/85/1052153485.db2.gz DVSOJHOCVVBUCI-UHFFFAOYSA-N -1 3 348.830 4.278 20 0 EIADHM O=c1cc(Nc2ccc(-c3ccncc3)cc2)[n-]n1-c1ccccc1 ZINC001176695363 1052166719 /nfs/dbraw/zinc/16/67/19/1052166719.db2.gz AXTYJWORYGMFNT-UHFFFAOYSA-N -1 3 328.375 4.384 20 0 EIADHM O=C(NC1(c2ccccc2)CCC1)c1cc([O-])cc(C(F)(F)F)c1 ZINC000622297584 1052192948 /nfs/dbraw/zinc/19/29/48/1052192948.db2.gz DDUAHNLKVQRFFI-UHFFFAOYSA-N -1 3 335.325 4.220 20 0 EIADHM CCc1ccc(C(=O)N(C)Cc2cccc(C(F)(F)F)c2)c([O-])c1 ZINC000622315333 1052203051 /nfs/dbraw/zinc/20/30/51/1052203051.db2.gz YRPGFPWLNGOHSF-UHFFFAOYSA-N -1 3 337.341 4.246 20 0 EIADHM Cc1ccccc1[C@H](N=c1ncnc2[nH][n-]cc1-2)[C@H]1CCC[C@@H](C)C1 ZINC001185323833 1052220139 /nfs/dbraw/zinc/22/01/39/1052220139.db2.gz ZFOCHIUOUTYFEW-QIIPPGSGSA-N -1 3 335.455 4.014 20 0 EIADHM Cc1ccc([O-])c(CN[C@@H](C)c2cc(F)c(Cl)cc2Cl)n1 ZINC001177098566 1052229855 /nfs/dbraw/zinc/22/98/55/1052229855.db2.gz NHYBMEFJSDLXEC-VIFPVBQESA-N -1 3 329.202 4.392 20 0 EIADHM Cc1ccc(C[C@@H](C)NC(=O)c2cc([O-])cc(C(F)(F)F)c2)s1 ZINC000622383748 1052239339 /nfs/dbraw/zinc/23/93/39/1052239339.db2.gz MQVBSJWZSURMAF-SECBINFHSA-N -1 3 343.370 4.142 20 0 EIADHM Cc1ccc(C(=O)N[C@H](CC(F)(F)F)c2ccc(F)cc2)c([O-])c1 ZINC000622477622 1052287709 /nfs/dbraw/zinc/28/77/09/1052287709.db2.gz FPIAGXUBSNDEHP-CQSZACIVSA-N -1 3 341.304 4.263 20 0 EIADHM COc1cc(C(=O)/C=C/c2sccc2Br)ccc1[O-] ZINC000184886695 1052293641 /nfs/dbraw/zinc/29/36/41/1052293641.db2.gz HTGDJGFARHJYKG-SNAWJCMRSA-N -1 3 339.210 4.121 20 0 EIADHM O=C(CCCc1cc(Cl)sc1Cl)Nc1ncccc1[O-] ZINC000622504832 1052304591 /nfs/dbraw/zinc/30/45/91/1052304591.db2.gz BWDWMOKHCURDAU-UHFFFAOYSA-N -1 3 331.224 4.117 20 0 EIADHM O=C(c1cc(Cc2ccccc2)ccc1[O-])N1Cc2cccc(F)c2C1 ZINC000622693490 1052378326 /nfs/dbraw/zinc/37/83/26/1052378326.db2.gz KWQDFPHDTOWKAM-UHFFFAOYSA-N -1 3 347.389 4.278 20 0 EIADHM CSc1nc2ccccc2c(C)c1[N-]C(=O)c1ncoc1C1CC1 ZINC000622968329 1052558459 /nfs/dbraw/zinc/55/84/59/1052558459.db2.gz KUMUCUMVEGBUAA-UHFFFAOYSA-N -1 3 339.420 4.383 20 0 EIADHM Cc1ccc(C(=O)Nc2cc(F)ccc2[O-])cc1Oc1ccncc1 ZINC000174905794 1052576975 /nfs/dbraw/zinc/57/69/75/1052576975.db2.gz SATQMPPIYWIUEN-UHFFFAOYSA-N -1 3 338.338 4.279 20 0 EIADHM CSc1ccc(CN2CCC(C(=O)c3ccc([O-])cc3)CC2)cc1 ZINC000623172546 1052600359 /nfs/dbraw/zinc/60/03/59/1052600359.db2.gz RZWTUYADUZEGOA-UHFFFAOYSA-N -1 3 341.476 4.209 20 0 EIADHM CCc1cc(=O)[n-]c(CN[C@H](c2ccc(Cl)cc2F)C(C)C)n1 ZINC000180263776 1052791381 /nfs/dbraw/zinc/79/13/81/1052791381.db2.gz ACAGRZDEXZYUBQ-KRWDZBQOSA-N -1 3 337.826 4.024 20 0 EIADHM Cc1sc2[n-]c([C@H](C)OC(=O)[C@@H]3CCC3(C)C)nc(=O)c2c1C ZINC000850070680 1053066406 /nfs/dbraw/zinc/06/64/06/1053066406.db2.gz ULQFRVMPGDXJMB-ONGXEEELSA-N -1 3 334.441 4.054 20 0 EIADHM CC(C)c1ccc(CN2CCC[C@@H](c3n[nH]c(=O)[n-]3)C2)c(C(C)C)c1 ZINC001194765136 1053100666 /nfs/dbraw/zinc/10/06/66/1053100666.db2.gz WAKYDXDSCVWLLH-QGZVFWFLSA-N -1 3 342.487 4.137 20 0 EIADHM O=c1ccnc(C=Cc2ccc(-c3cccc(Br)c3)o2)[n-]1 ZINC000764440919 1053103791 /nfs/dbraw/zinc/10/37/91/1053103791.db2.gz CSACNRRJDJGVLG-ALCCZGGFSA-N -1 3 343.180 4.375 20 0 EIADHM Cc1cccc(C(F)(F)F)c1[N-]S(=O)(=O)CC[Si](C)(C)C ZINC001195071982 1053256546 /nfs/dbraw/zinc/25/65/46/1053256546.db2.gz JOGLAGRGZRFZJG-UHFFFAOYSA-N -1 3 339.455 4.094 20 0 EIADHM Cc1ccc([C@@H]2CCCCN2C(=O)c2ccc(Cl)[n-]c2=O)cc1C ZINC001195133707 1053289244 /nfs/dbraw/zinc/28/92/44/1053289244.db2.gz MEQPOXXMEJMUQU-INIZCTEOSA-N -1 3 344.842 4.425 20 0 EIADHM O=C([N-]c1cc(C(F)(F)F)no1)c1cc(Cl)c(Cl)s1 ZINC001195169997 1053316308 /nfs/dbraw/zinc/31/63/08/1053316308.db2.gz UDQJSAZSWWLJMQ-UHFFFAOYSA-N -1 3 331.102 4.314 20 0 EIADHM CC(=O)c1cccc(NC(=O)Oc2ccccc2C(F)(F)F)c1[O-] ZINC001195201468 1053328295 /nfs/dbraw/zinc/32/82/95/1053328295.db2.gz YBSKYYUBZJOAHE-UHFFFAOYSA-N -1 3 339.269 4.225 20 0 EIADHM O=C(Nc1ccc(F)c([O-])c1)c1ccc(-c2ccccn2)cc1Cl ZINC001195665057 1053459722 /nfs/dbraw/zinc/45/97/22/1053459722.db2.gz NLPSMLDEKXWZPF-UHFFFAOYSA-N -1 3 342.757 4.499 20 0 EIADHM [O-]c1cc(Br)ccc1NC(=S)Nc1ccccc1F ZINC001195773519 1053477385 /nfs/dbraw/zinc/47/73/85/1053477385.db2.gz SJVZICZZSQTGRX-UHFFFAOYSA-N -1 3 341.205 4.103 20 0 EIADHM CC(C)c1sc(NC([O-])=NOCC(F)F)nc1-c1ccccc1 ZINC000888314666 1053640064 /nfs/dbraw/zinc/64/00/64/1053640064.db2.gz KUVUXWVZVDRPOR-UHFFFAOYSA-N -1 3 341.383 4.252 20 0 EIADHM CC(C)c1sc(NC(=O)[N-]OCC(F)F)nc1-c1ccccc1 ZINC000888314666 1053640069 /nfs/dbraw/zinc/64/00/69/1053640069.db2.gz KUVUXWVZVDRPOR-UHFFFAOYSA-N -1 3 341.383 4.252 20 0 EIADHM CC(C)P(CCNC(=O)c1cc(Cl)c(F)cc1[O-])C(C)C ZINC001196477443 1053675882 /nfs/dbraw/zinc/67/58/82/1053675882.db2.gz CHSFXDXUCSXCJA-UHFFFAOYSA-N -1 3 333.771 4.213 20 0 EIADHM CCCCc1nnc([N-]C(=O)c2occc2-c2ccccc2)s1 ZINC000022743108 1053762200 /nfs/dbraw/zinc/76/22/00/1053762200.db2.gz MFHVVMDDAPJXCF-UHFFFAOYSA-N -1 3 327.409 4.393 20 0 EIADHM O=C(Nc1cc([O-])cc(Cl)c1)c1c[nH]c(-c2ccc(F)cc2)c1 ZINC001196972672 1053809279 /nfs/dbraw/zinc/80/92/79/1053809279.db2.gz YNVALEGEVWRNEE-UHFFFAOYSA-N -1 3 330.746 4.432 20 0 EIADHM CC(C)c1nc(C(=O)[N-]c2nc(-c3ccc(F)cc3)ns2)cs1 ZINC000112595412 1053840281 /nfs/dbraw/zinc/84/02/81/1053840281.db2.gz JTFKFMKSNXAPBN-UHFFFAOYSA-N -1 3 348.428 4.176 20 0 EIADHM Cc1noc(C(C)C)c1C(=O)[N-]c1nc(F)cc(C(F)(F)F)c1F ZINC001197345709 1053878222 /nfs/dbraw/zinc/87/82/22/1053878222.db2.gz INZXJJIOKSZZAL-UHFFFAOYSA-N -1 3 349.259 4.051 20 0 EIADHM [O-]c1cccc2sc(NC(=S)NCc3ccc(Cl)cc3)nc21 ZINC001197546386 1053935632 /nfs/dbraw/zinc/93/56/32/1053935632.db2.gz CSQZYFQWYHWGHA-UHFFFAOYSA-N -1 3 349.868 4.142 20 0 EIADHM O=S(=O)(Cc1ccc(Cl)c(F)c1)[N-]c1ccccc1C(F)F ZINC001197673657 1053966913 /nfs/dbraw/zinc/96/69/13/1053966913.db2.gz ZGOQQWIBQZABDY-UHFFFAOYSA-N -1 3 349.761 4.359 20 0 EIADHM O=C(c1cc2sccc2c([O-])c1)N1CCC[C@@H]([C@H]2CCCCO2)C1 ZINC000855954961 1054000093 /nfs/dbraw/zinc/00/00/93/1054000093.db2.gz NJZVZQRTYAWVDM-CXAGYDPISA-N -1 3 345.464 4.028 20 0 EIADHM [O-]c1cccc(F)c1NC(=S)Nc1cccc(C(F)(F)F)c1 ZINC001198057881 1054055373 /nfs/dbraw/zinc/05/53/73/1054055373.db2.gz MOKJRHRXZMTFEX-UHFFFAOYSA-N -1 3 330.306 4.359 20 0 EIADHM COc1ccccc1-c1csc(NC(=O)c2cc(C)ccc2[O-])n1 ZINC000031991620 1054088367 /nfs/dbraw/zinc/08/83/67/1054088367.db2.gz OSQGWLNZJWQLHE-UHFFFAOYSA-N -1 3 340.404 4.085 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N1CCC[C@@H](OC2CCC2)CC1 ZINC000871326130 1054191443 /nfs/dbraw/zinc/19/14/43/1054191443.db2.gz BMDRLXQLMACEGD-GOSISDBHSA-N -1 3 339.435 4.109 20 0 EIADHM COc1ccc(CC[C@H](C)NC(=O)c2cc([O-])c3ccccc3c2)cc1 ZINC000471879904 1054192149 /nfs/dbraw/zinc/19/21/49/1054192149.db2.gz IFIAHOTWCAGQSK-HNNXBMFYSA-N -1 3 349.430 4.305 20 0 EIADHM Cc1cccnc1C[N-]C(=O)C(F)(F)c1cc(Cl)ccc1Cl ZINC000857448425 1054246877 /nfs/dbraw/zinc/24/68/77/1054246877.db2.gz YJIHFTWPDHQIGK-UHFFFAOYSA-N -1 3 345.176 4.105 20 0 EIADHM Cc1ccc(C(F)(F)F)cc1NC(=O)c1[n-]cnc1C(F)(F)F ZINC000857459751 1054252283 /nfs/dbraw/zinc/25/22/83/1054252283.db2.gz RFBIHJLWMLHOKV-UHFFFAOYSA-N -1 3 337.223 4.008 20 0 EIADHM Cc1ccc(C(F)(F)F)cc1NC(=O)c1nc[n-]c1C(F)(F)F ZINC000857459751 1054252295 /nfs/dbraw/zinc/25/22/95/1054252295.db2.gz RFBIHJLWMLHOKV-UHFFFAOYSA-N -1 3 337.223 4.008 20 0 EIADHM CC(C)CC1CCN(C(=O)c2cc([O-])cc(C(F)(F)F)c2)CC1 ZINC000857469296 1054258757 /nfs/dbraw/zinc/25/87/57/1054258757.db2.gz PSCJJMOSXLSGSX-UHFFFAOYSA-N -1 3 329.362 4.309 20 0 EIADHM O=C(C[C@@H]1CCCN1C(=O)c1cc([O-])c2ccccc2c1)c1ccco1 ZINC000472332292 1054287485 /nfs/dbraw/zinc/28/74/85/1054287485.db2.gz ZOWPZXIYXUTLAS-INIZCTEOSA-N -1 3 349.386 4.016 20 0 EIADHM CCCCc1ccccc1[N-]S(=O)(=O)c1ccc(OC)cc1C ZINC001198943570 1054312065 /nfs/dbraw/zinc/31/20/65/1054312065.db2.gz KBQOYMGTJANNPO-UHFFFAOYSA-N -1 3 333.453 4.147 20 0 EIADHM Cc1nn(-c2ccccc2)c(C)c1CN[C@H](C)c1cccc([O-])c1F ZINC000872018820 1054335926 /nfs/dbraw/zinc/33/59/26/1054335926.db2.gz QDOHWPSSHDHGJV-CYBMUJFWSA-N -1 3 339.414 4.185 20 0 EIADHM CCCC(=O)Nc1cccc(CN[C@H](C)c2cccc([O-])c2F)c1 ZINC000872024537 1054340894 /nfs/dbraw/zinc/34/08/94/1054340894.db2.gz BVQZIQXZWPDIBH-CYBMUJFWSA-N -1 3 330.403 4.121 20 0 EIADHM C[C@H](N[C@H](c1ccc(F)cc1)[C@@H]1CCCO1)c1cccc([O-])c1F ZINC000872028592 1054343696 /nfs/dbraw/zinc/34/36/96/1054343696.db2.gz KRWSIASQEWXGEA-OYYNGEPBSA-N -1 3 333.378 4.241 20 0 EIADHM C[C@H](N[C@H](c1ccc(F)cc1)[C@H]1CCCO1)c1cccc([O-])c1F ZINC000872028590 1054344511 /nfs/dbraw/zinc/34/45/11/1054344511.db2.gz KRWSIASQEWXGEA-OEPMTFCVSA-N -1 3 333.378 4.241 20 0 EIADHM CC[C@H](C)c1ccccc1NC(=O)[C@H](C)OC(=O)c1ccc([O-])cc1 ZINC000005061041 1054482767 /nfs/dbraw/zinc/48/27/67/1054482767.db2.gz AJQYFFYTMUZIRV-KBPBESRZSA-N -1 3 341.407 4.090 20 0 EIADHM [O-]c1ccc(CNCc2ccc(CSC(F)F)o2)cc1Cl ZINC000873178982 1054502278 /nfs/dbraw/zinc/50/22/78/1054502278.db2.gz IKBNABNVLWWSJN-UHFFFAOYSA-N -1 3 333.787 4.384 20 0 EIADHM O=C(OCc1ncc(Cl)cc1Cl)c1cc(Cl)c(Cl)[n-]1 ZINC000777058275 1054567288 /nfs/dbraw/zinc/56/72/88/1054567288.db2.gz CRUMEDGHURCUEC-UHFFFAOYSA-N -1 3 339.993 4.380 20 0 EIADHM Cc1ccc([C@H]2CCCN2C(=O)c2cc(=O)c3ccccc3[n-]2)cc1C ZINC000064323900 1054853785 /nfs/dbraw/zinc/85/37/85/1054853785.db2.gz YINFTESCPMEBRU-HXUWFJFHSA-N -1 3 346.430 4.122 20 0 EIADHM O=C(Nc1ccccc1)c1ccc(COC(=O)c2ccc([O-])cc2)cc1 ZINC000005693767 1054902075 /nfs/dbraw/zinc/90/20/75/1054902075.db2.gz OBLJCNKWCRQLMQ-UHFFFAOYSA-N -1 3 347.370 4.002 20 0 EIADHM Cc1ccc(C(=O)[C@@H](C)OC(=O)c2cc(Cl)c(Cl)[n-]2)cc1C ZINC000021730133 1054932409 /nfs/dbraw/zinc/93/24/09/1054932409.db2.gz GDUNKNBOCSNBEF-SNVBAGLBSA-N -1 3 340.206 4.367 20 0 EIADHM CC(=O)c1cccc([O-])c1NC(=O)Nc1ccccc1Br ZINC001201978834 1054955288 /nfs/dbraw/zinc/95/52/88/1054955288.db2.gz IXRDLRWTFJXPQF-UHFFFAOYSA-N -1 3 349.184 4.001 20 0 EIADHM C[C@H](NC(=O)Nc1cc(Br)ccc1[O-])c1ccccc1 ZINC001202506375 1055047810 /nfs/dbraw/zinc/04/78/10/1055047810.db2.gz XVKUYHNBTSCACW-JTQLQIEISA-N -1 3 335.201 4.037 20 0 EIADHM O=C(N[C@H](c1ccccn1)C1CCC1)c1cc2sccc2c([O-])c1 ZINC000862745967 1055105522 /nfs/dbraw/zinc/10/55/22/1055105522.db2.gz JYOKHFBJENKRRJ-SFHVURJKSA-N -1 3 338.432 4.273 20 0 EIADHM O=C(Nc1cccc(Cl)c1)Nc1c([O-])cccc1Br ZINC001202247052 1055114119 /nfs/dbraw/zinc/11/41/19/1055114119.db2.gz AOXAFXGOQJCQNP-UHFFFAOYSA-N -1 3 341.592 4.452 20 0 EIADHM CC[C@H](NC(=O)c1cc(=O)c2ccccc2[n-]1)C(C)(C)c1ccccc1 ZINC000266047816 1055126740 /nfs/dbraw/zinc/12/67/40/1055126740.db2.gz FMQDYFIACBONOL-FQEVSTJZSA-N -1 3 348.446 4.427 20 0 EIADHM CC(C)(C)[C@H](NCc1nnc(-c2ccccc2[O-])o1)c1ccccc1 ZINC000878215585 1055207887 /nfs/dbraw/zinc/20/78/87/1055207887.db2.gz YJLKXXRGECHKLT-GOSISDBHSA-N -1 3 337.423 4.319 20 0 EIADHM C[C@@H](c1cccc(F)c1)N1CCC(C(=O)c2ccc([O-])cc2)CC1 ZINC000616009586 1055252260 /nfs/dbraw/zinc/25/22/60/1055252260.db2.gz ZAIGLNAUXQYTRF-AWEZNQCLSA-N -1 3 327.399 4.187 20 0 EIADHM C[C@H](c1ccccc1Br)N1CCC(CCC(=O)[O-])CC1 ZINC000086755871 1055268866 /nfs/dbraw/zinc/26/88/66/1055268866.db2.gz JBRRJWXKRKOFHJ-GFCCVEGCSA-N -1 3 340.261 4.087 20 0 EIADHM Cc1sc2[n-]c([C@H](C)OC(=O)[C@@H]3CC[C@@H](C)C3)nc(=O)c2c1C ZINC000776424840 1055291247 /nfs/dbraw/zinc/29/12/47/1055291247.db2.gz PMRWWNFXDYOYCG-UBHAPETDSA-N -1 3 334.441 4.054 20 0 EIADHM CC[C@H](NCc1nnc(-c2ccccc2[O-])o1)c1ccc(Cl)s1 ZINC000878410200 1055297734 /nfs/dbraw/zinc/29/77/34/1055297734.db2.gz SMNWIJKXIWGNHT-NSHDSACASA-N -1 3 349.843 4.398 20 0 EIADHM CC[C@H](N[C@H](CCO)c1ccco1)c1ccc(Cl)c(Cl)c1[O-] ZINC000186421674 1055558102 /nfs/dbraw/zinc/55/81/02/1055558102.db2.gz VZNICZABIDPZBC-QWHCGFSZSA-N -1 3 344.238 4.456 20 0 EIADHM CSc1ccc(F)cc1C[N-]C(=O)C(F)(F)c1ccccc1F ZINC000765839242 1055829229 /nfs/dbraw/zinc/82/92/29/1055829229.db2.gz HJLFRFBYAXBRLC-UHFFFAOYSA-N -1 3 343.345 4.095 20 0 EIADHM Cc1ccccc1[C@@H](NC(=O)NCc1ccc([O-])c(F)c1)C(C)C ZINC000303744927 1056268472 /nfs/dbraw/zinc/26/84/72/1056268472.db2.gz AEUBSENYROXUFJ-SFHVURJKSA-N -1 3 330.403 4.036 20 0 EIADHM CC(C)c1ccc([C@H](C)CC(=O)Nc2nnc(C(F)(F)F)[n-]2)cc1 ZINC000303752492 1056276010 /nfs/dbraw/zinc/27/60/10/1056276010.db2.gz MDEJSFCBXWQXLH-SNVBAGLBSA-N -1 3 340.349 4.079 20 0 EIADHM CC(C)c1ccc([C@H](C)CC(=O)Nc2nc(C(F)(F)F)n[n-]2)cc1 ZINC000303752492 1056276031 /nfs/dbraw/zinc/27/60/31/1056276031.db2.gz MDEJSFCBXWQXLH-SNVBAGLBSA-N -1 3 340.349 4.079 20 0 EIADHM O=C([N-]c1nc(-c2ccsc2)ns1)c1cc2ccccc2o1 ZINC000109109170 1056377262 /nfs/dbraw/zinc/37/72/62/1056377262.db2.gz NVYCPDOAAGNLNS-UHFFFAOYSA-N -1 3 327.390 4.265 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N1CCn2c(cc3ccccc32)C1 ZINC000462845381 1056476253 /nfs/dbraw/zinc/47/62/53/1056476253.db2.gz LXPDYUXSMPRKBM-UHFFFAOYSA-N -1 3 342.398 4.156 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N1CCc2c(F)ccc(F)c2C1 ZINC000354818269 1056709699 /nfs/dbraw/zinc/70/96/99/1056709699.db2.gz JDSORLCUBXIYJC-UHFFFAOYSA-N -1 3 339.341 4.022 20 0 EIADHM CC(C)C[C@H]1CCN(Cc2ccc(C(=O)[O-])cc2Br)C1 ZINC000307820371 1056735015 /nfs/dbraw/zinc/73/50/15/1056735015.db2.gz POABZCIBEGQQLL-GFCCVEGCSA-N -1 3 340.261 4.015 20 0 EIADHM Cc1c2cccc(F)c2oc1C(=O)[N-]c1nc(C(C)(C)C)ns1 ZINC000075444484 1056784872 /nfs/dbraw/zinc/78/48/72/1056784872.db2.gz KMHIYJPVBOMYIK-UHFFFAOYSA-N -1 3 333.388 4.282 20 0 EIADHM CCCCCC[C@H](C)C(=O)Nc1ccc(-c2nc(C)cc(=O)[n-]2)cc1 ZINC000741913557 1058448617 /nfs/dbraw/zinc/44/86/17/1058448617.db2.gz OAOLSEFDXSZOMP-AWEZNQCLSA-N -1 3 341.455 4.290 20 0 EIADHM Cc1cc(=O)[n-]c(-c2cccc(OC(=O)c3ccc(Cl)s3)c2)n1 ZINC000744219165 1059336356 /nfs/dbraw/zinc/33/63/56/1059336356.db2.gz MHYJJQJOCBHJBN-UHFFFAOYSA-N -1 3 346.795 4.092 20 0 EIADHM Cc1cc(C(=O)Oc2cccc(-c3nc(C)cc(=O)[n-]3)c2)sc1C ZINC000744218016 1059337456 /nfs/dbraw/zinc/33/74/56/1059337456.db2.gz VBMQMFYPQGMCNV-UHFFFAOYSA-N -1 3 340.404 4.055 20 0 EIADHM C[C@@H]1CCC[C@@H](OCCCCCC(=O)[N-]OCc2ccccc2)C1 ZINC000766329478 1059821371 /nfs/dbraw/zinc/82/13/71/1059821371.db2.gz MVNKYJJQCWHXQS-IEBWSBKVSA-N -1 3 333.472 4.390 20 0 EIADHM CCC(C)(C)CC(=O)O[C@H](C)c1nc(=O)c2c(C)c(C)sc2[n-]1 ZINC000745777035 1059890309 /nfs/dbraw/zinc/89/03/09/1059890309.db2.gz FXFQOAVEWOJZPA-SNVBAGLBSA-N -1 3 336.457 4.444 20 0 EIADHM COc1cc(Nc2c(Cl)ccc([O-])c2F)cc(Br)n1 ZINC001214559889 1060236844 /nfs/dbraw/zinc/23/68/44/1060236844.db2.gz UZLVSMXQHSHSEU-UHFFFAOYSA-N -1 3 347.571 4.094 20 0 EIADHM C[C@H]1CCc2c(sc(Nc3ccc(Cl)c([O-])c3)c2C(N)=O)C1 ZINC001212588378 1060757499 /nfs/dbraw/zinc/75/74/99/1060757499.db2.gz NEHNOWPXCMFOTN-QMMMGPOBSA-N -1 3 336.844 4.074 20 0 EIADHM Cc1cc(Nc2ccc(Cl)c([O-])c2)n(Cc2ccccc2F)n1 ZINC001212590220 1060818496 /nfs/dbraw/zinc/81/84/96/1060818496.db2.gz AQRMGHXOLMDUPC-UHFFFAOYSA-N -1 3 331.778 4.482 20 0 EIADHM O=c1[n-]c(N[C@@H]2CCO[C@@H](c3ccccc3)C2)c(Cl)cc1Cl ZINC001169757355 1060947473 /nfs/dbraw/zinc/94/74/73/1060947473.db2.gz DFVTZCSRJGSGEP-BXUZGUMPSA-N -1 3 339.222 4.426 20 0 EIADHM Nc1ccc(Br)c(F)c1Nc1ccc(Cl)c([O-])c1 ZINC001212594965 1060980007 /nfs/dbraw/zinc/98/00/07/1060980007.db2.gz FMCDMNOPZZEMLR-UHFFFAOYSA-N -1 3 331.572 4.273 20 0 EIADHM COc1cc(CNc2cc(F)cc(F)c2)cc(Br)c1[O-] ZINC000019961614 212090819 /nfs/dbraw/zinc/09/08/19/212090819.db2.gz RVNXPZHXFVCVPP-UHFFFAOYSA-N -1 3 344.155 4.054 20 0 EIADHM CCC(CC)c1nnc([N-]C(=O)c2nc(Cl)ccc2Cl)s1 ZINC000028701444 521636635 /nfs/dbraw/zinc/63/66/35/521636635.db2.gz VPQHUZKUMOCMMF-UHFFFAOYSA-N -1 3 345.255 4.396 20 0 EIADHM CC(C)Cc1nnc([N-]C(=O)c2ccc(-c3ccc(F)cc3)o2)s1 ZINC000025445181 1032154993 /nfs/dbraw/zinc/15/49/93/1032154993.db2.gz PVVJBIZXWYTSKA-UHFFFAOYSA-N -1 3 345.399 4.388 20 0 EIADHM COc1ccc(S[C@H](C)C(=O)Nc2ccc(Cl)cc2[O-])cc1 ZINC000532837745 1032342385 /nfs/dbraw/zinc/34/23/85/1032342385.db2.gz RURHMHNWFJOVMW-SNVBAGLBSA-N -1 3 337.828 4.174 20 0 EIADHM O=C(Nc1ccc(Cl)cc1[O-])c1cccc(C(F)(F)F)c1F ZINC000533159386 1032515070 /nfs/dbraw/zinc/51/50/70/1032515070.db2.gz XRAYXOVXJXSWAT-UHFFFAOYSA-N -1 3 333.668 4.456 20 0 EIADHM Cc1nc2cc(F)ccc2cc1C(=O)Nc1ccc(Cl)cc1[O-] ZINC000533159339 1032515161 /nfs/dbraw/zinc/51/51/61/1032515161.db2.gz VGWOFMGSLBNKQM-UHFFFAOYSA-N -1 3 330.746 4.294 20 0 EIADHM O=C(Cc1ccc([O-])c(F)c1)N1CCC[C@H](c2ccc(F)cc2)CC1 ZINC000450465174 1032516355 /nfs/dbraw/zinc/51/63/55/1032516355.db2.gz BLIXLLHBEFXFBQ-HNNXBMFYSA-N -1 3 345.389 4.009 20 0 EIADHM Cc1cc(NC(=O)c2c[n-]c3ccccc3c2=O)cc(C(F)(F)F)c1 ZINC000683121433 1018864732 /nfs/dbraw/zinc/86/47/32/1018864732.db2.gz WAOZTRLXHOFRNM-UHFFFAOYSA-N -1 3 346.308 4.108 20 0 EIADHM O=C(Nc1n[n-]c(-c2ccco2)n1)c1cccc(Nc2ccccc2)c1 ZINC000605303168 1018948788 /nfs/dbraw/zinc/94/87/88/1018948788.db2.gz CRXLJMOBBPKLBR-UHFFFAOYSA-N -1 3 345.362 4.061 20 0 EIADHM CC(C)(CCNCc1c(Cl)cccc1OC(F)F)CCC(=O)[O-] ZINC000683172851 1019094762 /nfs/dbraw/zinc/09/47/62/1019094762.db2.gz ZLPVZVXPGGDVBV-UHFFFAOYSA-N -1 3 349.805 4.312 20 0 EIADHM Cc1nc(-c2c[nH]c(C(=O)Nc3ccc(Cl)cc3[O-])c2)cs1 ZINC000153617337 1019408333 /nfs/dbraw/zinc/40/83/33/1019408333.db2.gz COIBRXXUYLHQLA-UHFFFAOYSA-N -1 3 333.800 4.058 20 0 EIADHM COc1cc(C(=O)/C=C/c2ccc(Br)s2)ccc1[O-] ZINC000008322785 1019665533 /nfs/dbraw/zinc/66/55/33/1019665533.db2.gz ZQJLRJMWQLVGKW-ZZXKWVIFSA-N -1 3 339.210 4.121 20 0 EIADHM O=C(OCCOc1ccccc1Cl)c1cc(Cl)c(Cl)[n-]1 ZINC000011809360 1019748685 /nfs/dbraw/zinc/74/86/85/1019748685.db2.gz YLEPSLDCTJBOIT-UHFFFAOYSA-N -1 3 334.586 4.211 20 0 EIADHM Cc1cc(=O)[n-]c(-c2ccc(NC(=O)C3(C)CCCCCC3)cc2)n1 ZINC000180579224 1020147730 /nfs/dbraw/zinc/14/77/30/1020147730.db2.gz YXHNVUXPQZDIMZ-UHFFFAOYSA-N -1 3 339.439 4.044 20 0 EIADHM O=C(NCCc1cccc2ccccc21)c1cc([O-])ccc1Cl ZINC000683377888 1020484063 /nfs/dbraw/zinc/48/40/63/1020484063.db2.gz VDYGRWLOTZUZPV-UHFFFAOYSA-N -1 3 325.795 4.171 20 0 EIADHM COc1cc(-c2ccccc2)sc1C(=O)[N-]c1c(C)noc1C ZINC000340259310 1020696446 /nfs/dbraw/zinc/69/64/46/1020696446.db2.gz MMLJNOLPIVVCRR-UHFFFAOYSA-N -1 3 328.393 4.281 20 0 EIADHM CC[C@H](c1ccc(Br)cc1)N1CCC(CC(=O)[O-])CC1 ZINC000093682508 1020816973 /nfs/dbraw/zinc/81/69/73/1020816973.db2.gz PJXDFJYEENNNQM-OAHLLOKOSA-N -1 3 340.261 4.087 20 0 EIADHM C[C@H]1CCCC[C@@H]1OCc1nc(=O)c2c3c(sc2[n-]1)CCCCC3 ZINC000063579696 1021390258 /nfs/dbraw/zinc/39/02/58/1021390258.db2.gz ANNMFXOWJHQJOY-JSGCOSHPSA-N -1 3 346.496 4.349 20 0 EIADHM O=C([O-])C[C@H](NCc1ccc(F)cc1)c1cccc(C(F)(F)F)c1 ZINC000340673837 1021892938 /nfs/dbraw/zinc/89/29/38/1021892938.db2.gz DTMGXWYWGWUKIR-HNNXBMFYSA-N -1 3 341.304 4.150 20 0 EIADHM Cc1cccc2c(CCC(=O)Nc3c([O-])cccc3Cl)c[nH]c21 ZINC000557183762 1022181583 /nfs/dbraw/zinc/18/15/83/1022181583.db2.gz OCNVPQDJADQZDA-UHFFFAOYSA-N -1 3 328.799 4.407 20 0 EIADHM COc1cccc(SC)c1[N-]C(=O)c1oc2c(c1C)C(=O)CCC2 ZINC000416121988 1022488360 /nfs/dbraw/zinc/48/83/60/1022488360.db2.gz MHRLUTHXGPRPOZ-UHFFFAOYSA-N -1 3 345.420 4.090 20 0 EIADHM CCc1cccc(C(=O)N2CC[C@@H](c3cccc(Cl)c3)C2)c1[O-] ZINC000581002488 1022797065 /nfs/dbraw/zinc/79/70/65/1022797065.db2.gz DFQFLLCVRPZJFM-OAHLLOKOSA-N -1 3 329.827 4.238 20 0 EIADHM CC(C)(C)[C@@H]1CCCN1Cc1coc(-c2ccc(C(=O)[O-])cc2)n1 ZINC000581017579 1022802614 /nfs/dbraw/zinc/80/26/14/1022802614.db2.gz UXXCTCMCTLUCPR-INIZCTEOSA-N -1 3 328.412 4.050 20 0 EIADHM CSc1cccc(CN2CCC(C(=O)c3ccc([O-])cc3)CC2)c1 ZINC000660024053 1022874563 /nfs/dbraw/zinc/87/45/63/1022874563.db2.gz FPABBHXTBQHABU-UHFFFAOYSA-N -1 3 341.476 4.209 20 0 EIADHM Cc1ccc2c(c1)[C@@H](NCc1cccc([O-])c1Br)CC2 ZINC000656497516 1023058032 /nfs/dbraw/zinc/05/80/32/1023058032.db2.gz FLOCBEHXHCGCFU-HNNXBMFYSA-N -1 3 332.241 4.240 20 0 EIADHM [O-]C(=Cc1nc(-c2ccc3ncccc3c2)no1)c1ccccc1Cl ZINC001211646914 1023210205 /nfs/dbraw/zinc/21/02/05/1023210205.db2.gz CDXHAOIQOWNQEG-UHFFFAOYSA-N -1 3 349.777 4.364 20 0 EIADHM Cc1cc(F)c(F)cc1-c1noc(C=C([O-])c2ccccc2Cl)n1 ZINC001211646955 1023210736 /nfs/dbraw/zinc/21/07/36/1023210736.db2.gz FCAHREQSXRTKEZ-UHFFFAOYSA-N -1 3 348.736 4.402 20 0 EIADHM O=C(c1cc(Oc2ccccc2)ccc1[O-])N(CC(F)F)C1CC1 ZINC000179553358 1023216560 /nfs/dbraw/zinc/21/65/60/1023216560.db2.gz FVFNBHWQASEMPD-UHFFFAOYSA-N -1 3 333.334 4.054 20 0 EIADHM CSCCC(=O)Nc1ccc([O-])c(-c2nc3ccccc3s2)c1 ZINC000179934614 1023222804 /nfs/dbraw/zinc/22/28/04/1023222804.db2.gz VOOUGWHBDOKAGY-UHFFFAOYSA-N -1 3 344.461 4.361 20 0 EIADHM Cc1ccc(CNCc2c(F)ccc([O-])c2F)c(OC(C)(C)C)c1 ZINC000511625462 1023301502 /nfs/dbraw/zinc/30/15/02/1023301502.db2.gz GUNXVEVJJAPAII-UHFFFAOYSA-N -1 3 335.394 4.446 20 0 EIADHM O=C(Nc1ccc(F)c(C(F)(F)F)c1)c1cc([O-])ccc1Cl ZINC000319017722 1023329391 /nfs/dbraw/zinc/32/93/91/1023329391.db2.gz AEJSWJLTRCHMKJ-UHFFFAOYSA-N -1 3 333.668 4.456 20 0 EIADHM O=C(Nc1cccc(-c2cnco2)c1)c1cc([O-])c2ccccc2c1 ZINC000377068280 1023362089 /nfs/dbraw/zinc/36/20/89/1023362089.db2.gz QVEFRBZVASKHCM-UHFFFAOYSA-N -1 3 330.343 4.453 20 0 EIADHM CC(C)Cc1ncc(CN[C@H](CCC(=O)[O-])c2ccccc2)s1 ZINC000417593205 1023367330 /nfs/dbraw/zinc/36/73/30/1023367330.db2.gz FZGUPPYFMNLNAN-MRXNPFEDSA-N -1 3 332.469 4.037 20 0 EIADHM O=C([O-])CC[C@H](NCc1cnc(C2CCC2)s1)c1ccccc1 ZINC000417600466 1023373526 /nfs/dbraw/zinc/37/35/26/1023373526.db2.gz JPDORNRNHRXBNG-INIZCTEOSA-N -1 3 330.453 4.106 20 0 EIADHM O=C([O-])[C@@H]1C[C@H](NCc2cnc(C3CCCC3)s2)c2ccccc21 ZINC000417630005 1023381161 /nfs/dbraw/zinc/38/11/61/1023381161.db2.gz QQZBKWIAPZFZMA-SJORKVTESA-N -1 3 342.464 4.204 20 0 EIADHM O=C([O-])[C@@H]1C[C@H](NCc2ccccc2C(F)(F)F)c2ccccc21 ZINC000417626009 1023386410 /nfs/dbraw/zinc/38/64/10/1023386410.db2.gz SHHOOBNRUSMUBR-ZBFHGGJFSA-N -1 3 335.325 4.108 20 0 EIADHM O=C([O-])[C@H](NCc1cc2ccccc2o1)C(C1CCC1)C1CCC1 ZINC000417645340 1023389114 /nfs/dbraw/zinc/38/91/14/1023389114.db2.gz DCVDHZCVLGFBBJ-LJQANCHMSA-N -1 3 327.424 4.192 20 0 EIADHM CCC[C@H](CCCCNCc1nc2c(s1)C[C@@H](C)CC2)C(=O)[O-] ZINC000417641415 1023394826 /nfs/dbraw/zinc/39/48/26/1023394826.db2.gz PXDXVIBRMRSLGZ-UONOGXRCSA-N -1 3 338.517 4.029 20 0 EIADHM Cc1cc(=O)[n-]c(-c2cccc(NC(=O)c3ccoc3C(C)C)c2)n1 ZINC000377295853 1023455286 /nfs/dbraw/zinc/45/52/86/1023455286.db2.gz BHIQATHIUVTVOW-UHFFFAOYSA-N -1 3 337.379 4.126 20 0 EIADHM CCC(C)(CC)[N-]S(=O)(=O)c1ccc(Cl)cc1C(F)(F)F ZINC000500079054 1023490565 /nfs/dbraw/zinc/49/05/65/1023490565.db2.gz XYOQVQCXMCQOIY-UHFFFAOYSA-N -1 3 343.798 4.216 20 0 EIADHM O=C([O-])[C@H](c1cccc(Cl)c1Cl)N1CCC[C@@H](CCF)C1 ZINC000656764662 1023505638 /nfs/dbraw/zinc/50/56/38/1023505638.db2.gz ZYJUMLLCBUDPIX-HZMBPMFUSA-N -1 3 334.218 4.191 20 0 EIADHM O=C([O-])[C@@H]1CCN(Cc2c(Cl)cccc2Cl)[C@H]2CCCC[C@H]12 ZINC000656765796 1023509375 /nfs/dbraw/zinc/50/93/75/1023509375.db2.gz OSMZSLQXCLGMKN-HSMVNMDESA-N -1 3 342.266 4.459 20 0 EIADHM O=C(Nc1ccc2c(c1)C=CC1(CCC1)O2)c1[n-]cnc1C(F)(F)F ZINC000925685917 1023735584 /nfs/dbraw/zinc/73/55/84/1023735584.db2.gz QFPJBFWRWIMVLV-UHFFFAOYSA-N -1 3 349.312 4.009 20 0 EIADHM O=C(Nc1ccc2c(c1)C=CC1(CCC1)O2)c1nc[n-]c1C(F)(F)F ZINC000925685917 1023735593 /nfs/dbraw/zinc/73/55/93/1023735593.db2.gz QFPJBFWRWIMVLV-UHFFFAOYSA-N -1 3 349.312 4.009 20 0 EIADHM C[C@H](CC(=O)[N-]OCCC(F)(F)F)c1ccc(C(F)(F)F)cc1 ZINC000162754798 1023791018 /nfs/dbraw/zinc/79/10/18/1023791018.db2.gz CPQXLDRZRFKVRX-SECBINFHSA-N -1 3 343.267 4.199 20 0 EIADHM CC(C)CCOc1ccccc1CNCc1c(F)ccc([O-])c1F ZINC000510486259 1023848360 /nfs/dbraw/zinc/84/83/60/1023848360.db2.gz XGOOFOCHCIZNHW-UHFFFAOYSA-N -1 3 335.394 4.385 20 0 EIADHM Cc1oc(-c2ccsc2)nc1CC(=O)Nc1cc(Cl)ccc1[O-] ZINC000588926546 1023902374 /nfs/dbraw/zinc/90/23/74/1023902374.db2.gz YXJNLFPMZPWFBO-UHFFFAOYSA-N -1 3 348.811 4.252 20 0 EIADHM Cc1cc(=O)[n-]c(C(C)(C)NCc2nc(C3CCCCC3)cs2)n1 ZINC000660749791 1024043581 /nfs/dbraw/zinc/04/35/81/1024043581.db2.gz PWAUDYUSOQNAKL-UHFFFAOYSA-N -1 3 346.500 4.020 20 0 EIADHM O=C([N-]c1nnc(CC2CCCCC2)s1)c1cc2ncccc2o1 ZINC001126031605 1024228994 /nfs/dbraw/zinc/22/89/94/1024228994.db2.gz BIFSESVOQLQINS-UHFFFAOYSA-N -1 3 342.424 4.054 20 0 EIADHM O=C(N[C@@H]1CC[C@@H](c2cccc(F)c2)C1)c1cc([O-])ccc1Cl ZINC000510904888 1024772328 /nfs/dbraw/zinc/77/23/28/1024772328.db2.gz COQSNGXRZQYSQZ-TZMCWYRMSA-N -1 3 333.790 4.251 20 0 EIADHM CC(=O)c1ccc(-c2nc(=O)c3c4ccccc4sc3[n-]2)s1 ZINC000535664906 1024810394 /nfs/dbraw/zinc/81/03/94/1024810394.db2.gz DMBNGWINPFGJPY-UHFFFAOYSA-N -1 3 326.402 4.481 20 0 EIADHM Cc1cc(=O)[n-]c([C@H](C)N[C@H](c2ccc(Cl)cc2)[C@@H]2C[C@H]2C)n1 ZINC000248731324 1024875919 /nfs/dbraw/zinc/87/59/19/1024875919.db2.gz JMANHWZRNPDDGO-SADCGLOJSA-N -1 3 331.847 4.192 20 0 EIADHM C[C@H](Cc1cccc(F)c1)N(C)C(=O)CCCc1ccc([O-])c(F)c1 ZINC000458234823 1024967041 /nfs/dbraw/zinc/96/70/41/1024967041.db2.gz CYDMSAWXYRMLKL-CQSZACIVSA-N -1 3 347.405 4.083 20 0 EIADHM O=C([O-])CC[C@H](CNCc1cc(Cl)cc(Cl)c1)C(F)(F)F ZINC000663262511 1024967765 /nfs/dbraw/zinc/96/77/65/1024967765.db2.gz SRVLFQSLMNUDID-SECBINFHSA-N -1 3 344.160 4.126 20 0 EIADHM COc1ccc([N-]S(=O)(=O)c2c(C)c(C)c(C)c(C)c2C)c(C)c1 ZINC000014223736 1025773223 /nfs/dbraw/zinc/77/32/23/1025773223.db2.gz JTPXDKNYNANYEM-UHFFFAOYSA-N -1 3 347.480 4.347 20 0 EIADHM CC[C@@H](C)[C@@H](C)[N-]S(=O)(=O)c1ccc(Cl)cc1C(F)(F)F ZINC000512029405 1025794600 /nfs/dbraw/zinc/79/46/00/1025794600.db2.gz CBXOHAZHPXWREY-RKDXNWHRSA-N -1 3 343.798 4.072 20 0 EIADHM O=C(NCc1ncccc1[O-])c1cc(-c2ccccc2)ccc1Cl ZINC000473643990 1025979697 /nfs/dbraw/zinc/97/96/97/1025979697.db2.gz PZSYJUCFFFDVNO-UHFFFAOYSA-N -1 3 338.794 4.038 20 0 EIADHM Cc1ccc([N-]S(=O)(=O)c2c(C)c(C)cc(C)c2C)c(C)c1O ZINC000071977246 1026022686 /nfs/dbraw/zinc/02/26/86/1026022686.db2.gz SDTCAKIJVIQYQK-UHFFFAOYSA-N -1 3 333.453 4.044 20 0 EIADHM Cc1onc(-c2cccnc2)c1C(=O)[N-]c1cc(Cl)cc(F)c1F ZINC000344239972 1026171342 /nfs/dbraw/zinc/17/13/42/1026171342.db2.gz ZBJOQKQNUOZYRB-UHFFFAOYSA-N -1 3 349.724 4.229 20 0 EIADHM Cc1ccc(-c2nc(-c3cccc(Br)c3)no2)c([O-])c1 ZINC000111687505 1026320385 /nfs/dbraw/zinc/32/03/85/1026320385.db2.gz CCTHOPYVOVDGGL-UHFFFAOYSA-N -1 3 331.169 4.180 20 0 EIADHM COc1ccc2cc(CN[C@@H](CC(=O)[O-])c3ccsc3)ccc2c1 ZINC000426696470 1026480697 /nfs/dbraw/zinc/48/06/97/1026480697.db2.gz RUOJQYBGRYZEHY-SFHVURJKSA-N -1 3 341.432 4.216 20 0 EIADHM O=C([O-])[C@@H](CC1CCCC1)NCc1csc(-c2ccc(F)cc2)n1 ZINC000426723220 1026501635 /nfs/dbraw/zinc/50/16/35/1026501635.db2.gz KYKXLYKIQYDHFB-MRXNPFEDSA-N -1 3 348.443 4.072 20 0 EIADHM COc1ccc(C)cc1CN[C@@H](CC(=O)[O-])c1ccc(C(C)C)cc1 ZINC000426770777 1026550789 /nfs/dbraw/zinc/55/07/89/1026550789.db2.gz VWFOAHOMHBNCRH-IBGZPJMESA-N -1 3 341.451 4.433 20 0 EIADHM CCCSC[C@@H](NCc1ccc(-c2ccccc2)cc1F)C(=O)[O-] ZINC000426782158 1026556121 /nfs/dbraw/zinc/55/61/21/1026556121.db2.gz FXPCHCXVZUQYGD-GOSISDBHSA-N -1 3 347.455 4.179 20 0 EIADHM O=C([O-])C[C@@H](NCc1ccc(Cl)s1)c1cccc(Cl)c1 ZINC000426791431 1026565475 /nfs/dbraw/zinc/56/54/75/1026565475.db2.gz IKEDVNPUIBJDLT-GFCCVEGCSA-N -1 3 330.236 4.361 20 0 EIADHM O=C([O-])[C@@H](NCc1ccc(Cl)c(C(F)(F)F)c1)c1cccs1 ZINC000426813784 1026575116 /nfs/dbraw/zinc/57/51/16/1026575116.db2.gz ZNWUKJNWENSLRU-LBPRGKRZSA-N -1 3 349.761 4.336 20 0 EIADHM Cc1ccc(OC2CCN(Cc3cccc([O-])c3Cl)CC2)cc1 ZINC000507352615 1026757012 /nfs/dbraw/zinc/75/70/12/1026757012.db2.gz LBJVUOGOIQNHTL-UHFFFAOYSA-N -1 3 331.843 4.397 20 0 EIADHM COc1c(Br)cc(F)cc1Nc1c(F)cc([O-])cc1F ZINC001211715500 1026803426 /nfs/dbraw/zinc/80/34/26/1026803426.db2.gz ZSQWBXWWDUIWIP-UHFFFAOYSA-N -1 3 348.118 4.324 20 0 EIADHM CC(=O)c1cc([N-]S(=O)(=O)c2c(C)c(C)cc(C)c2C)ccc1F ZINC000507628406 1026858798 /nfs/dbraw/zinc/85/87/98/1026858798.db2.gz FFEVBMWAARDKHJ-UHFFFAOYSA-N -1 3 349.427 4.063 20 0 EIADHM CSc1ccccc1S(=O)(=O)[N-]c1cccc(Cl)c1F ZINC000188284696 1027244987 /nfs/dbraw/zinc/24/49/87/1027244987.db2.gz AYFLMMTWSLXSKE-UHFFFAOYSA-N -1 3 331.821 4.002 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@@H](CC)c3cccs3)nc2)n1 ZINC000302675661 1027358359 /nfs/dbraw/zinc/35/83/59/1027358359.db2.gz PSHVPLBMFNLJFY-AWEZNQCLSA-N -1 3 340.452 4.431 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@H]3CCCC(C)(C)C3)nc2)n1 ZINC000302672778 1027359063 /nfs/dbraw/zinc/35/90/63/1027359063.db2.gz OQOHUZONECBEGC-HNNXBMFYSA-N -1 3 326.444 4.187 20 0 EIADHM Cc1cc2cc[nH]c2cc1NC(=O)c1c[n-]c2c(C)cc(F)cc2c1=O ZINC000342925032 1027584592 /nfs/dbraw/zinc/58/45/92/1027584592.db2.gz HMWICFRYTACYPR-UHFFFAOYSA-N -1 3 349.365 4.018 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(NC[C@@H](CC)c3ccccc3)nc2)n1 ZINC000111221490 1027814282 /nfs/dbraw/zinc/81/42/82/1027814282.db2.gz IMYLSJSUAGISBJ-OAHLLOKOSA-N -1 3 348.450 4.000 20 0 EIADHM Cc1c2cc(F)ccc2oc1C(=O)[N-]c1nnc(C(C)(C)C)s1 ZINC000079241494 1027854440 /nfs/dbraw/zinc/85/44/40/1027854440.db2.gz JHAYBECKOBMQRO-UHFFFAOYSA-N -1 3 333.388 4.282 20 0 EIADHM Cc1nc(C(C)C)sc1[C@H](C)N(C)C(=O)c1ccc(C)cc1[O-] ZINC000126613028 1027967504 /nfs/dbraw/zinc/96/75/04/1027967504.db2.gz FJNBCKZZGHHUJD-ZDUSSCGKSA-N -1 3 332.469 4.422 20 0 EIADHM Cc1nc(C(C)C)sc1[C@@H](C)N(C)C(=O)c1ccc(C)cc1[O-] ZINC000126613288 1027968257 /nfs/dbraw/zinc/96/82/57/1027968257.db2.gz FJNBCKZZGHHUJD-CYBMUJFWSA-N -1 3 332.469 4.422 20 0 EIADHM CC(C)n1c2ccccc2nc1[C@H]1CCCN1CC1(CC(=O)[O-])CC1 ZINC000583089212 1027980052 /nfs/dbraw/zinc/98/00/52/1027980052.db2.gz ATRZCCCWBMLYHP-QGZVFWFLSA-N -1 3 341.455 4.009 20 0 EIADHM CC(C)(C)c1ccc(SCC(=O)NCc2ccc([O-])c(F)c2)cc1 ZINC000523424203 1028103897 /nfs/dbraw/zinc/10/38/97/1028103897.db2.gz BUWDPXWHTKLRAJ-UHFFFAOYSA-N -1 3 347.455 4.237 20 0 EIADHM Cc1cc(C)c(CSc2nc(=O)cc([O-])n2C2CCCC2)c(C)c1 ZINC000520470181 1028157780 /nfs/dbraw/zinc/15/77/80/1028157780.db2.gz NMOHXGFWQWHAAR-UHFFFAOYSA-N -1 3 344.480 4.282 20 0 EIADHM Cc1ncc(CN[C@H](C)c2ccc(Cl)c(Cl)c2Cl)c(=O)[n-]1 ZINC000346811730 1028666964 /nfs/dbraw/zinc/66/69/64/1028666964.db2.gz VGRXZEVEVXTQRP-SSDOTTSWSA-N -1 3 346.645 4.302 20 0 EIADHM CSc1cccnc1-c1noc(-c2ccc(C(C)C)cc2[O-])n1 ZINC000445621997 1028807112 /nfs/dbraw/zinc/80/71/12/1028807112.db2.gz YPEOUAARZNIBSX-UHFFFAOYSA-N -1 3 327.409 4.350 20 0 EIADHM c1ccc(-c2nc([N-][C@H](c3ccccc3)c3ccccn3)no2)cc1 ZINC000156926695 1028875939 /nfs/dbraw/zinc/87/59/39/1028875939.db2.gz MWEAWPUNMJZRKQ-GOSISDBHSA-N -1 3 328.375 4.333 20 0 EIADHM Cc1ccc(C(F)(F)F)cc1NC(=O)c1c[n-]c2ccccc2c1=O ZINC000150009915 1029256692 /nfs/dbraw/zinc/25/66/92/1029256692.db2.gz VHIZNKGDKMYPKG-UHFFFAOYSA-N -1 3 346.308 4.108 20 0 EIADHM COc1ccc(C(C)(C)C)cc1NC(=O)Cc1ccc([O-])c(F)c1 ZINC000648081289 1029320733 /nfs/dbraw/zinc/32/07/33/1029320733.db2.gz SVBASMLKPIACEX-UHFFFAOYSA-N -1 3 331.387 4.019 20 0 EIADHM CCc1oc(C(=O)[N-]c2ccccc2SC(C)C)cc1C(=O)OC ZINC000583884360 1029324545 /nfs/dbraw/zinc/32/45/45/1029324545.db2.gz JCIBZNDJUAGQQB-UHFFFAOYSA-N -1 3 347.436 4.381 20 0 EIADHM [O-]c1cc2ccccc2cc1-c1nc([C@H]2CCOC3(CCC3)C2)no1 ZINC000897111099 1029425632 /nfs/dbraw/zinc/42/56/32/1029425632.db2.gz STPKMDAHBFRJGB-HNNXBMFYSA-N -1 3 336.391 4.412 20 0 EIADHM CC(C)[C@@H]1CCCN1Cc1csc(-c2cccc(C(=O)[O-])c2)n1 ZINC000583999696 1029488029 /nfs/dbraw/zinc/48/80/29/1029488029.db2.gz VAEIXVDZCVDKOQ-INIZCTEOSA-N -1 3 330.453 4.129 20 0 EIADHM CC(C)c1cc(C(=O)[N-]c2sc3c(c2C(=O)C2CC2)CCC3)on1 ZINC000446609979 1029489411 /nfs/dbraw/zinc/48/94/11/1029489411.db2.gz JIEGCXXTFHXAAI-UHFFFAOYSA-N -1 3 344.436 4.193 20 0 EIADHM CC(C)c1ccc(-c2nc3ccc(Br)cc3c(=O)[n-]2)cc1 ZINC000525200261 1029511071 /nfs/dbraw/zinc/51/10/71/1029511071.db2.gz HABXOEAFESPAMB-UHFFFAOYSA-N -1 3 343.224 4.476 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(NCC[C@H]3CCC(F)(F)C3)nc2)n1 ZINC000897239747 1029605235 /nfs/dbraw/zinc/60/52/35/1029605235.db2.gz NXWRZJGHKSQTRB-GFCCVEGCSA-N -1 3 348.397 4.044 20 0 EIADHM CC(C)c1c(C(=O)Nc2cc(F)ccc2[O-])cnn1-c1ccccc1 ZINC000536212844 1029606448 /nfs/dbraw/zinc/60/64/48/1029606448.db2.gz FWOOHBIBFHGLOL-UHFFFAOYSA-N -1 3 339.370 4.093 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(NC[C@H]3C[C@@H]3c3ccccc3)nc2)n1 ZINC000301226282 1029689968 /nfs/dbraw/zinc/68/99/68/1029689968.db2.gz BURYCQQSFBYXFS-SJLPKXTDSA-N -1 3 346.434 4.022 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@@H]3CC[C@@H](C)C[C@@H]3C)nc2)n1 ZINC000301248435 1029693776 /nfs/dbraw/zinc/69/37/76/1029693776.db2.gz IKGIEZTUDWAOEX-DVOMOZLQSA-N -1 3 326.444 4.043 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@H](C)CCC(C)(C)C)nc2)n1 ZINC000301273791 1029698475 /nfs/dbraw/zinc/69/84/75/1029698475.db2.gz LEMUQQWLQGVAFI-CYBMUJFWSA-N -1 3 328.460 4.433 20 0 EIADHM [O-]c1ccc(CNc2ncnc3sc4c(c32)CCCC4)cc1F ZINC000301347062 1029714331 /nfs/dbraw/zinc/71/43/31/1029714331.db2.gz HGOBSUNIHHEOBR-UHFFFAOYSA-N -1 3 329.400 4.027 20 0 EIADHM CCc1cccc(C(=O)N2CCCCC[C@@H]2[C@H]2CCCCC2=O)c1[O-] ZINC000092429858 1029907863 /nfs/dbraw/zinc/90/78/63/1029907863.db2.gz YBBZURBJLVSSCQ-SJLPKXTDSA-N -1 3 343.467 4.099 20 0 EIADHM CCc1nc2c(s1)[C@H](N(C)C(=O)c1cccc(CC)c1[O-])CCC2 ZINC000092605629 1029945247 /nfs/dbraw/zinc/94/52/47/1029945247.db2.gz PSTPEHGURUSOOG-OAHLLOKOSA-N -1 3 344.480 4.123 20 0 EIADHM O=C1CCC2(CC1)CCN(Cc1c(Cl)cc([O-])cc1Cl)CC2 ZINC001142118476 1030049650 /nfs/dbraw/zinc/04/96/50/1030049650.db2.gz NCHQRIXRVCLOGW-UHFFFAOYSA-N -1 3 342.266 4.424 20 0 EIADHM C[C@H]1CC(F)(F)CCN1Cc1c(C(=O)[O-])sc2cccc(F)c21 ZINC000530173870 1030194534 /nfs/dbraw/zinc/19/45/34/1030194534.db2.gz RIKOVQKPLABTMA-VIFPVBQESA-N -1 3 343.370 4.358 20 0 EIADHM COc1ccc(Cl)c(NC(=O)CCCc2ccc([O-])c(F)c2)c1 ZINC000526052055 1030233887 /nfs/dbraw/zinc/23/38/87/1030233887.db2.gz CLECMNHZNVIKLR-UHFFFAOYSA-N -1 3 337.778 4.155 20 0 EIADHM CC[C@@H](C)Sc1ccc(NC(=O)c2cccc3n[n-]nc32)c(C)c1 ZINC000526113674 1030286260 /nfs/dbraw/zinc/28/62/60/1030286260.db2.gz OXTBNYVNTHKWIN-GFCCVEGCSA-N -1 3 340.452 4.409 20 0 EIADHM O=C(Nc1cc(F)ccc1[O-])c1csc(-c2ccccc2F)n1 ZINC000530657946 1030630692 /nfs/dbraw/zinc/63/06/92/1030630692.db2.gz HIIRVUCKPIQMDD-UHFFFAOYSA-N -1 3 332.331 4.046 20 0 EIADHM COc1ccc([O-])c(C(=O)Nc2cccc(CCC(F)(F)F)c2)c1 ZINC000530769889 1030699428 /nfs/dbraw/zinc/69/94/28/1030699428.db2.gz CQLLCJGBUCAYGU-UHFFFAOYSA-N -1 3 339.313 4.148 20 0 EIADHM [O-]c1cc(Br)cnc1O[C@@H](c1ccccc1)C(F)(F)F ZINC001228953626 1030734484 /nfs/dbraw/zinc/73/44/84/1030734484.db2.gz VPUZFTWRGLZQTI-NSHDSACASA-N -1 3 348.118 4.232 20 0 EIADHM CCCCSCCC(=O)Nc1cc(Br)ccc1[O-] ZINC000530916451 1030806807 /nfs/dbraw/zinc/80/68/07/1030806807.db2.gz DFJXNQLSPBPSNL-UHFFFAOYSA-N -1 3 332.263 4.017 20 0 EIADHM O=C(N=c1cc(-c2cccc(F)c2)o[n-]1)c1occc1-c1ccccc1 ZINC000448537085 1030836199 /nfs/dbraw/zinc/83/61/99/1030836199.db2.gz GFARXXVJRJRJIA-UHFFFAOYSA-N -1 3 348.333 4.415 20 0 EIADHM O=C(CCCc1ccccc1)Nc1cc(Br)ccc1[O-] ZINC000531155452 1030946603 /nfs/dbraw/zinc/94/66/03/1030946603.db2.gz LYHGCZYKLCPCHG-UHFFFAOYSA-N -1 3 334.213 4.116 20 0 EIADHM Cc1sc(C(=O)Nc2ncccc2[O-])cc1-c1ccc(F)cc1 ZINC000531278907 1031035723 /nfs/dbraw/zinc/03/57/23/1031035723.db2.gz MJMYYSFARCIKEM-UHFFFAOYSA-N -1 3 328.368 4.216 20 0 EIADHM CCC[C@H]1CCCCN1Cc1ccc(C(=O)[O-])cc1Br ZINC000226736326 1031104394 /nfs/dbraw/zinc/10/43/94/1031104394.db2.gz CVDZESXHJWHKDC-AWEZNQCLSA-N -1 3 340.261 4.302 20 0 EIADHM CCCN(C(=O)Cc1ccc([O-])c(F)c1)[C@@H](C)c1ccccc1OC ZINC000448819394 1031121372 /nfs/dbraw/zinc/12/13/72/1031121372.db2.gz AWTBZQDVOUMQNM-AWEZNQCLSA-N -1 3 345.414 4.082 20 0 EIADHM O=C(Cc1ccc([O-])c(F)c1)N(C1CC1)[C@H]1CCCc2ccccc21 ZINC000448857275 1031149278 /nfs/dbraw/zinc/14/92/78/1031149278.db2.gz PKTGOXZFVINZDB-IBGZPJMESA-N -1 3 339.410 4.142 20 0 EIADHM O=C(Cc1ccc([O-])c(F)c1)N(Cc1cccc(F)c1)C1CCCC1 ZINC000448947036 1031274467 /nfs/dbraw/zinc/27/44/67/1031274467.db2.gz UEAVILLCVNCQRU-UHFFFAOYSA-N -1 3 345.389 4.184 20 0 EIADHM O=c1[n-]c(CN2CCCc3c(F)cccc32)nc2c3ccccc3oc21 ZINC000532568498 1031299706 /nfs/dbraw/zinc/29/97/06/1031299706.db2.gz SWYIKPBXGOUWHF-UHFFFAOYSA-N -1 3 349.365 4.174 20 0 EIADHM O=C(CCc1cnc2ccccc2c1)Nc1ccc(Cl)cc1[O-] ZINC000472438770 1031617535 /nfs/dbraw/zinc/61/75/35/1031617535.db2.gz ICUZEESAMFOBND-UHFFFAOYSA-N -1 3 326.783 4.165 20 0 EIADHM Cc1ccc(C)c(C(=O)CCC(=O)Nc2c([O-])cccc2Cl)c1 ZINC000570114626 1031651481 /nfs/dbraw/zinc/65/14/81/1031651481.db2.gz UPOYNDHVGFDFSZ-UHFFFAOYSA-N -1 3 331.799 4.264 20 0 EIADHM [O-]c1cccc(CN[C@@H](c2cccs2)C2(CO)CCC2)c1Cl ZINC000449765700 1031989659 /nfs/dbraw/zinc/98/96/59/1031989659.db2.gz KCLPMECOEOLRBG-INIZCTEOSA-N -1 3 337.872 4.101 20 0 EIADHM [O-]c1cccc(CN[C@@H](c2ccccc2)C2(CO)CCCC2)c1Cl ZINC000453615317 1032044708 /nfs/dbraw/zinc/04/47/08/1032044708.db2.gz NALAKDJTHVWDMN-IBGZPJMESA-N -1 3 345.870 4.429 20 0 EIADHM Cc1cc(-c2nc3cc(Cl)ccc3c(=O)[n-]2)ccc1Br ZINC000614110272 1033383030 /nfs/dbraw/zinc/38/30/30/1033383030.db2.gz IBFKDVMNEIRGGL-UHFFFAOYSA-N -1 3 349.615 4.314 20 0 EIADHM CCN(C(=O)c1c[n-]c2c(Cl)cccc2c1=O)[C@@H]1CCCC[C@H]1C ZINC001143552797 1033776798 /nfs/dbraw/zinc/77/67/98/1033776798.db2.gz DZJJKWQWSXWQMN-MLGOLLRUSA-N -1 3 346.858 4.222 20 0 EIADHM [O-]c1cccc(CNCc2ccc(OCC(F)(F)F)cc2)c1Cl ZINC000645143955 1033836612 /nfs/dbraw/zinc/83/66/12/1033836612.db2.gz LWNUHSTYPVWVRW-UHFFFAOYSA-N -1 3 345.748 4.277 20 0 EIADHM Cn1cccc1[C@@H]1CCCCCN1C(=O)c1cc([O-])ccc1Cl ZINC000433218836 1034064372 /nfs/dbraw/zinc/06/43/72/1034064372.db2.gz KNCKYMYRGVEIFB-KRWDZBQOSA-N -1 3 332.831 4.142 20 0 EIADHM CCN(C(=O)c1cc([O-])ccc1Cl)[C@@H](C)Cc1ccc(OC)cc1 ZINC000433344264 1034251036 /nfs/dbraw/zinc/25/10/36/1034251036.db2.gz RBBRYJXTJBDJKU-ZDUSSCGKSA-N -1 3 347.842 4.148 20 0 EIADHM Cc1ccc(Br)cc1CNCc1c(F)ccc([O-])c1F ZINC000513031394 1034338444 /nfs/dbraw/zinc/33/84/44/1034338444.db2.gz FGAYDRUCGUCXAF-UHFFFAOYSA-N -1 3 342.183 4.031 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1ccccc1Oc1cccnc1 ZINC000052148227 1034465413 /nfs/dbraw/zinc/46/54/13/1034465413.db2.gz JRTHFGYBXGVWOL-UHFFFAOYSA-N -1 3 340.766 4.485 20 0 EIADHM C[C@H](c1ccc(OC(F)F)cc1)N1Cc2ccccc2[C@H](C(=O)[O-])C1 ZINC000327504954 1034645377 /nfs/dbraw/zinc/64/53/77/1034645377.db2.gz LKLBYOYZABGDSD-SJKOYZFVSA-N -1 3 347.361 4.033 20 0 EIADHM Cc1cc(S(=O)(=O)[N-]c2cc(C(F)F)ccc2Cl)c(C)o1 ZINC000345129395 1035126520 /nfs/dbraw/zinc/12/65/20/1035126520.db2.gz WJTQRCBJKLIFTE-UHFFFAOYSA-N -1 3 335.759 4.288 20 0 EIADHM C/C=C\c1ccc(OCC(=O)Nc2cc(Cl)ccc2[O-])c(OC)c1 ZINC000490694155 1035610188 /nfs/dbraw/zinc/61/01/88/1035610188.db2.gz DZHFULJNELWNGA-ARJAWSKDSA-N -1 3 347.798 4.105 20 0 EIADHM Cc1ccccc1NC(=O)c1c[n-]c(=NC(=O)OC(C)(C)C)s1 ZINC000905025979 1035718771 /nfs/dbraw/zinc/71/87/71/1035718771.db2.gz WUPNBYGFOWATEK-UHFFFAOYSA-N -1 3 333.413 4.051 20 0 EIADHM O=C(Nc1ccccc1-c1ccccc1)c1cc2c(cc1[O-])OCO2 ZINC000436752762 1035771767 /nfs/dbraw/zinc/77/17/67/1035771767.db2.gz BVUVNBKXHGNWKM-UHFFFAOYSA-N -1 3 333.343 4.040 20 0 EIADHM CN(Cc1ccsc1)C(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000586708729 1035832498 /nfs/dbraw/zinc/83/24/98/1035832498.db2.gz KBAGZUFRVKHPOT-UHFFFAOYSA-N -1 3 337.444 4.317 20 0 EIADHM CCOCCOc1c(Cl)cccc1NC(=O)c1cccc(C)c1[O-] ZINC000195728327 1035883049 /nfs/dbraw/zinc/88/30/49/1035883049.db2.gz MKMBXRYWFHYAFL-UHFFFAOYSA-N -1 3 349.814 4.022 20 0 EIADHM Cc1ccc(N(C)C(=O)c2c[n-]c(=NC(=O)OC(C)(C)C)s2)cc1 ZINC000906499246 1036306841 /nfs/dbraw/zinc/30/68/41/1036306841.db2.gz MONOKGIUWPINNM-UHFFFAOYSA-N -1 3 347.440 4.075 20 0 EIADHM O=c1cc(C=Cc2cccc(Cl)c2Cl)nc(-c2ccncc2)[n-]1 ZINC000486028113 1036442114 /nfs/dbraw/zinc/44/21/14/1036442114.db2.gz JOVQLDGRIPIHAH-SNAWJCMRSA-N -1 3 344.201 4.309 20 0 EIADHM CC(C)COc1cccc(C=Cc2cc(=O)[n-]c(-c3ccncc3)n2)c1 ZINC000486054012 1036456606 /nfs/dbraw/zinc/45/66/06/1036456606.db2.gz UTOLXPCLXJSXPJ-VOTSOKGWSA-N -1 3 347.418 4.037 20 0 EIADHM CCCCOc1ccc(C=Cc2cc(=O)[n-]c(-c3ccncc3)n2)cc1 ZINC000486056029 1036461181 /nfs/dbraw/zinc/46/11/81/1036461181.db2.gz UYYHRURTRJTLCI-DAXSKMNVSA-N -1 3 347.418 4.181 20 0 EIADHM CC(C)(C)c1ccc(C=Cc2cc(=O)[n-]c(-c3ccncc3)n2)cc1 ZINC000486078269 1036466403 /nfs/dbraw/zinc/46/64/03/1036466403.db2.gz ULWGDPVWBDOACW-RMKNXTFCSA-N -1 3 331.419 4.300 20 0 EIADHM Fc1ccc(F)c(-c2csc([N-]c3ncnc4ccncc43)n2)c1 ZINC000502684885 1036504000 /nfs/dbraw/zinc/50/40/00/1036504000.db2.gz DJJZSAQZYXAQAR-UHFFFAOYSA-N -1 3 341.346 4.170 20 0 EIADHM CCc1ccc(-c2csc([N-]c3ncnc4ccncc43)n2)cc1 ZINC000502746981 1036612330 /nfs/dbraw/zinc/61/23/30/1036612330.db2.gz MEIIUZPPZZHPNT-UHFFFAOYSA-N -1 3 333.420 4.454 20 0 EIADHM O=S(=O)([N-]c1cc(Cl)ccc1Sc1ccccc1)C1CC1 ZINC000589428439 1036799185 /nfs/dbraw/zinc/79/91/85/1036799185.db2.gz UMQIAHKDXUPAJC-UHFFFAOYSA-N -1 3 339.869 4.395 20 0 EIADHM C[C@@H](CC1CCCC1)C(=O)Nc1ccc(Br)cc1[O-] ZINC000603858584 1037052205 /nfs/dbraw/zinc/05/22/05/1037052205.db2.gz LYUJEHJFYCCXIC-JTQLQIEISA-N -1 3 326.234 4.310 20 0 EIADHM COc1cccc([C@@H]([N-]c2nc3cc(C)ccc3o2)c2nccn2C)c1 ZINC000604034394 1037163004 /nfs/dbraw/zinc/16/30/04/1037163004.db2.gz KJGAKOVYDVKVOX-GOSISDBHSA-N -1 3 348.406 4.080 20 0 EIADHM O=C([N-]c1nnc(CC2CCCCC2)s1)c1cnc(C2CC2)s1 ZINC000591204538 1037310817 /nfs/dbraw/zinc/31/08/17/1037310817.db2.gz AIGPNJRNDGYTQZ-UHFFFAOYSA-N -1 3 348.497 4.247 20 0 EIADHM C[C@H](/N=C/c1cc(Cl)ccc1[O-])c1ccc2c(c1)CCC(=O)N2 ZINC000044011457 1037421961 /nfs/dbraw/zinc/42/19/61/1037421961.db2.gz PDBQODZXWSXCBT-KKBVUKDESA-N -1 3 328.799 4.110 20 0 EIADHM COc1cc([C@H](C)/N=C/c2cc(Cl)ccc2[O-])cc(OC)c1OC ZINC000044010196 1037425446 /nfs/dbraw/zinc/42/54/46/1037425446.db2.gz RRMWHGQUFROKEL-KKBVUKDESA-N -1 3 349.814 4.252 20 0 EIADHM O=C([N-]c1nnc(-c2ccco2)s1)c1scnc1C1CCCC1 ZINC000273432719 1037464973 /nfs/dbraw/zinc/46/49/73/1037464973.db2.gz AVVCPCROJPENJZ-UHFFFAOYSA-N -1 3 346.437 4.165 20 0 EIADHM O=C([N-]c1c(F)cc(F)cc1F)c1scnc1C1CCCC1 ZINC000273612961 1037527085 /nfs/dbraw/zinc/52/70/85/1037527085.db2.gz PAELVIHJBIUPOC-UHFFFAOYSA-N -1 3 326.343 4.470 20 0 EIADHM CCC(C)(C)[C@@H](C)NC(=O)Nc1ccc(-c2cc(=O)[n-]c(C)n2)cc1 ZINC000664319908 1037771226 /nfs/dbraw/zinc/77/12/26/1037771226.db2.gz UGNUUIHXOPYPGZ-GFCCVEGCSA-N -1 3 342.443 4.104 20 0 EIADHM Cc1cc(SC(C)(C)C)ccc1NC([O-])=NO[C@@H]1CCCCO1 ZINC000155958976 1037813733 /nfs/dbraw/zinc/81/37/33/1037813733.db2.gz GLUYTDTZIVXOEV-OAHLLOKOSA-N -1 3 338.473 4.465 20 0 EIADHM Cc1cc(SC(C)(C)C)ccc1NC(=O)[N-]O[C@@H]1CCCCO1 ZINC000155958976 1037813737 /nfs/dbraw/zinc/81/37/37/1037813737.db2.gz GLUYTDTZIVXOEV-OAHLLOKOSA-N -1 3 338.473 4.465 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1cnc(-c2ccsc2)s1 ZINC000489410358 1038031338 /nfs/dbraw/zinc/03/13/38/1038031338.db2.gz RKACGHMXCVPYPD-UHFFFAOYSA-N -1 3 336.825 4.483 20 0 EIADHM CC(C)(C)c1ccc(CCCC(=O)NCc2ccc([O-])c(F)c2)cc1 ZINC000606537213 1038154797 /nfs/dbraw/zinc/15/47/97/1038154797.db2.gz BMZFNUUQGDMXFF-UHFFFAOYSA-N -1 3 343.442 4.468 20 0 EIADHM O=C(Nc1c([O-])cccc1Cl)c1ccc(N2CCCCCC2)nc1 ZINC000574710669 1038331833 /nfs/dbraw/zinc/33/18/33/1038331833.db2.gz KAACTSIOHIPZRL-UHFFFAOYSA-N -1 3 345.830 4.073 20 0 EIADHM O=C(N[C@H]1CC[C@@H](Cc2ccccc2)C1)c1cc([O-])ccc1Cl ZINC000504601829 1038424958 /nfs/dbraw/zinc/42/49/58/1038424958.db2.gz PZKWAUZOMUOCIB-GJZGRUSLSA-N -1 3 329.827 4.187 20 0 EIADHM CC[C@@H]1CCc2c(sc3[n-]c(COC4CCCC4)nc(=O)c23)C1 ZINC000608386162 1038812263 /nfs/dbraw/zinc/81/22/63/1038812263.db2.gz NLJXOGBZRRXSEM-LLVKDONJSA-N -1 3 332.469 4.371 20 0 EIADHM O=C(NCc1ccc(-c2ccccc2)o1)c1cc([O-])ccc1Cl ZINC000550750201 1038892456 /nfs/dbraw/zinc/89/24/56/1038892456.db2.gz CRRDMJLQXZGNJM-UHFFFAOYSA-N -1 3 327.767 4.236 20 0 EIADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)[C@H]3CCCC[C@@H]3C)c2)n1 ZINC000424597209 1038921198 /nfs/dbraw/zinc/92/11/98/1038921198.db2.gz HJRVDYJIKASBFU-GUYCJALGSA-N -1 3 339.439 4.176 20 0 EIADHM CCc1cc(=O)[n-]c(CN[C@@H](CC(C)C)c2ccc(Cl)cc2)n1 ZINC000539295383 1038943949 /nfs/dbraw/zinc/94/39/49/1038943949.db2.gz LIYHPVYKKXOAER-INIZCTEOSA-N -1 3 333.863 4.275 20 0 EIADHM Cc1cc(F)c(CNCCC[C@@H](Cc2ccccc2)C(=O)[O-])c(F)c1 ZINC000424620871 1038961996 /nfs/dbraw/zinc/96/19/96/1038961996.db2.gz PAQZHSXVNSVNOO-INIZCTEOSA-N -1 3 347.405 4.087 20 0 EIADHM CCc1cc(=O)[n-]c(CNC(C)(C)c2ccc(Cl)c(Cl)c2)n1 ZINC000119717254 1038994574 /nfs/dbraw/zinc/99/45/74/1038994574.db2.gz OJELCAKEBHHKJX-UHFFFAOYSA-N -1 3 340.254 4.076 20 0 EIADHM Cc1ccccc1-c1cc(=NC(=O)c2c(C)c(F)ccc2Cl)[nH][n-]1 ZINC000476579055 1039383181 /nfs/dbraw/zinc/38/31/81/1039383181.db2.gz VZMNCBINOYSKCL-UHFFFAOYSA-N -1 3 343.789 4.160 20 0 EIADHM CC(=O)CCCCSc1nnc([N-]c2ccccc2F)s1 ZINC000121727536 1039436828 /nfs/dbraw/zinc/43/68/28/1039436828.db2.gz UHUUNEDYWBITKE-UHFFFAOYSA-N -1 3 325.434 4.272 20 0 EIADHM Cc1ccc(-c2nc(CC(=O)Nc3c([O-])cccc3Cl)cs2)o1 ZINC000552435582 1039514437 /nfs/dbraw/zinc/51/44/37/1039514437.db2.gz OMQOIJCGUBNOKO-UHFFFAOYSA-N -1 3 348.811 4.252 20 0 EIADHM CCCCc1nnc([N-]C(=O)c2cnc(-c3ccccc3)s2)s1 ZINC000514101213 1039606622 /nfs/dbraw/zinc/60/66/22/1039606622.db2.gz WQLQMNUVGIAVFJ-UHFFFAOYSA-N -1 3 344.465 4.257 20 0 EIADHM Cc1ccc([O-])c(C(=O)N2CCCc3cc(Br)ccc32)c1 ZINC000537640364 1039608591 /nfs/dbraw/zinc/60/85/91/1039608591.db2.gz BUMLRGJJDDFJKY-UHFFFAOYSA-N -1 3 346.224 4.056 20 0 EIADHM CCc1c(C(=O)Nc2cc(Cl)ccc2[O-])cnn1C(CC)CC ZINC000478329770 1039666172 /nfs/dbraw/zinc/66/61/72/1039666172.db2.gz LICFOYVNLKVPQY-UHFFFAOYSA-N -1 3 335.835 4.418 20 0 EIADHM CCc1ccc([O-])c(C(=O)N2CC[C@@H](C(F)(F)F)C3(CCC3)C2)c1 ZINC000514202116 1039732349 /nfs/dbraw/zinc/73/23/49/1039732349.db2.gz SEDSPNXTZMMILT-OAHLLOKOSA-N -1 3 341.373 4.149 20 0 EIADHM CC(C)(C)c1ccccc1OCC(=O)Nc1c([O-])cccc1Cl ZINC000552781679 1039817515 /nfs/dbraw/zinc/81/75/15/1039817515.db2.gz ROZCUPJMPRUKGF-UHFFFAOYSA-N -1 3 333.815 4.361 20 0 EIADHM CCC(CC)c1nnc([N-]C(=O)c2cc3cccc(OC)c3o2)s1 ZINC000097256387 1040053088 /nfs/dbraw/zinc/05/30/88/1040053088.db2.gz NXLWJJSPLDEAEV-UHFFFAOYSA-N -1 3 345.424 4.449 20 0 EIADHM Cc1c(Br)scc1C(=O)Nc1cc(Cl)ccc1[O-] ZINC000477121498 1040240735 /nfs/dbraw/zinc/24/07/35/1040240735.db2.gz NKMWGVOOOOHVQT-UHFFFAOYSA-N -1 3 346.633 4.430 20 0 EIADHM CCCc1cc(=O)[n-]c(C(=Cc2ccc(OC(C)C)cc2)CC)n1 ZINC000435341114 1040297778 /nfs/dbraw/zinc/29/77/78/1040297778.db2.gz STSYTZMVWRDKLH-VBKFSLOCSA-N -1 3 326.440 4.460 20 0 EIADHM CCSc1nccnc1C(=O)[N-]c1cc(Cl)ccc1SC ZINC000430406610 1040485389 /nfs/dbraw/zinc/48/53/89/1040485389.db2.gz VKKMDVORQRYSBW-UHFFFAOYSA-N -1 3 339.873 4.216 20 0 EIADHM O=C(NC[C@H]1CCC[C@H](C(F)(F)F)C1)c1cc([O-])ccc1Cl ZINC000551770259 1040571932 /nfs/dbraw/zinc/57/19/32/1040571932.db2.gz HKFBDAWYOJMAJS-UWVGGRQHSA-N -1 3 335.753 4.144 20 0 EIADHM O=C(NC[C@H]1CCC[C@@H](C(F)(F)F)C1)c1cc([O-])ccc1Cl ZINC000551770260 1040573337 /nfs/dbraw/zinc/57/33/37/1040573337.db2.gz HKFBDAWYOJMAJS-VHSXEESVSA-N -1 3 335.753 4.144 20 0 EIADHM COc1cc(C)c([N-]S(=O)(=O)c2cccc(Cl)c2C)cc1C ZINC000435733290 1040591291 /nfs/dbraw/zinc/59/12/91/1040591291.db2.gz SJFSYUQDBSGAEZ-UHFFFAOYSA-N -1 3 339.844 4.075 20 0 EIADHM COc1ccc([O-])c(C(=O)Nc2ccccc2-c2csc(C)n2)c1 ZINC000477689898 1040721893 /nfs/dbraw/zinc/72/18/93/1040721893.db2.gz HZPNIXGNAFQFPT-UHFFFAOYSA-N -1 3 340.404 4.085 20 0 EIADHM Cc1c(Br)scc1C(=O)Nc1ccc(Cl)cc1[O-] ZINC000477691285 1040726347 /nfs/dbraw/zinc/72/63/47/1040726347.db2.gz HHTYMKHDCBQZRS-UHFFFAOYSA-N -1 3 346.633 4.430 20 0 EIADHM CC(C)c1ccc(OC2CCN(C(=O)c3ccccc3[O-])CC2)cc1 ZINC000515593626 1040883033 /nfs/dbraw/zinc/88/30/33/1040883033.db2.gz GCWDZMTXUOWZBR-UHFFFAOYSA-N -1 3 339.435 4.199 20 0 EIADHM Cc1cc(C)c(S(=O)(=O)[N-]c2cccc(OC(F)F)c2)c(C)c1 ZINC000515634185 1040915616 /nfs/dbraw/zinc/91/56/16/1040915616.db2.gz XDZFBIQGQAZLPA-UHFFFAOYSA-N -1 3 341.379 4.014 20 0 EIADHM Cn1ncc2c1nc(Sc1ccc(C3CCCCC3)cc1)[n-]c2=O ZINC000539991880 1040980914 /nfs/dbraw/zinc/98/09/14/1040980914.db2.gz YBXYWCOXSCPWHA-UHFFFAOYSA-N -1 3 340.452 4.268 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-][C@@H](c2ccc(Cl)cc2)C2CCC2)o1 ZINC000538007226 1040984941 /nfs/dbraw/zinc/98/49/41/1040984941.db2.gz XREGFVZQZYMFCV-MRXNPFEDSA-N -1 3 339.844 4.061 20 0 EIADHM CC(C)c1ccc(C(=O)N2CC[C@@H](c3ccccc3F)C2)c([O-])c1 ZINC000436484269 1041283090 /nfs/dbraw/zinc/28/30/90/1041283090.db2.gz HGEOJZUFILXNBM-OAHLLOKOSA-N -1 3 327.399 4.284 20 0 EIADHM Cc1cccc([C@@H](CC(=O)[O-])NCc2ccc(C(F)(F)F)s2)c1 ZINC000904045921 1041302054 /nfs/dbraw/zinc/30/20/54/1041302054.db2.gz RKZNXHDZCOIMRJ-CYBMUJFWSA-N -1 3 343.370 4.381 20 0 EIADHM CSc1ccc(N(C)C(=O)c2ccc3c(c2[O-])OC(C)(C)C3)cc1 ZINC000436547099 1041323829 /nfs/dbraw/zinc/32/38/29/1041323829.db2.gz MDLBTWDUAJECDQ-UHFFFAOYSA-N -1 3 343.448 4.104 20 0 EIADHM COc1ccc(C(=O)N(C)[C@@H](c2ccccc2C)C(C)C)c([O-])c1 ZINC000436549197 1041325443 /nfs/dbraw/zinc/32/54/43/1041325443.db2.gz UDUSNXWTHBSRML-LJQANCHMSA-N -1 3 327.424 4.179 20 0 EIADHM CCCN(C(=O)c1ccc(OC)cc1[O-])[C@H](C)c1ccccc1OC ZINC000436541135 1041334951 /nfs/dbraw/zinc/33/49/51/1041334951.db2.gz SVSWTUZZWYJWPS-CQSZACIVSA-N -1 3 343.423 4.023 20 0 EIADHM CC(C)c1ccc(-c2nc([C@@H](C)C(=O)OC(C)(C)C)no2)c([O-])c1 ZINC000436577383 1041340313 /nfs/dbraw/zinc/34/03/13/1041340313.db2.gz OPXLLOMOPWSFSH-LLVKDONJSA-N -1 3 332.400 4.011 20 0 EIADHM CC(C)c1ccc(C(=O)N2CCCC[C@H]2c2cccn2C)c([O-])c1 ZINC000436570860 1041349304 /nfs/dbraw/zinc/34/93/04/1041349304.db2.gz BDNRSJHQRFOZKU-SFHVURJKSA-N -1 3 326.440 4.222 20 0 EIADHM CC[C@H](NC(=O)c1ccc(C)cc1[O-])c1nc(C(F)(F)F)cs1 ZINC000436581335 1041361012 /nfs/dbraw/zinc/36/10/12/1041361012.db2.gz APWGWMPZWABTDA-JTQLQIEISA-N -1 3 344.358 4.057 20 0 EIADHM CC[C@@H]1CCCC[C@@H]1c1noc(-c2cc(OC)c([O-])c(OC)c2)n1 ZINC000436588680 1041363022 /nfs/dbraw/zinc/36/30/22/1041363022.db2.gz ITKGXFRULQNRJW-YPMHNXCESA-N -1 3 332.400 4.143 20 0 EIADHM O=C(Nc1cccc([O-])c1F)c1coc(-c2ccccc2Cl)n1 ZINC000538496381 1041376735 /nfs/dbraw/zinc/37/67/35/1041376735.db2.gz HEMWPCTUYXJNOE-UHFFFAOYSA-N -1 3 332.718 4.092 20 0 EIADHM Cc1ccc(C)n1C1CCN(C(=O)c2ccc(C(C)C)cc2[O-])CC1 ZINC000436623164 1041390083 /nfs/dbraw/zinc/39/00/83/1041390083.db2.gz GCEYIHHPBJGGBK-UHFFFAOYSA-N -1 3 340.467 4.411 20 0 EIADHM Cc1cccc(CO[N-]C(=O)CCCCCO[C@H]2CCC[C@H](C)C2)n1 ZINC000898933763 1041413842 /nfs/dbraw/zinc/41/38/42/1041413842.db2.gz GKADXCANTQBIIH-LPHOPBHVSA-N -1 3 348.487 4.094 20 0 EIADHM Cc1ccc(C(=O)Nc2ccc(OCc3ccncc3)cc2)c([O-])c1C ZINC000436675837 1041414803 /nfs/dbraw/zinc/41/48/03/1041414803.db2.gz MBNPWFPNGWDLNH-UHFFFAOYSA-N -1 3 348.402 4.235 20 0 EIADHM COc1ccccc1-c1csc(NC(=O)c2ccc(C)cc2[O-])n1 ZINC000436682765 1041419515 /nfs/dbraw/zinc/41/95/15/1041419515.db2.gz RNZHZOPLDIGYLO-UHFFFAOYSA-N -1 3 340.404 4.085 20 0 EIADHM COc1cc(-c2nc(-c3cc(Cl)ccc3C)no2)cc(OC)c1[O-] ZINC000436686100 1041421142 /nfs/dbraw/zinc/42/11/42/1041421142.db2.gz DORVFFRNNABOMF-UHFFFAOYSA-N -1 3 346.770 4.088 20 0 EIADHM CCCC[C@H](C)N(CCCC)C(=O)c1cc(NC(C)=O)ccc1[O-] ZINC000436709554 1041425898 /nfs/dbraw/zinc/42/58/98/1041425898.db2.gz OERYQSSPDOHMPA-AWEZNQCLSA-N -1 3 334.460 4.172 20 0 EIADHM CCc1cc(=O)[n-]c(CNC(C)(C)c2ccc(C(C)(C)C)cc2)n1 ZINC000540403581 1041433929 /nfs/dbraw/zinc/43/39/29/1041433929.db2.gz IXKDAOXAXIBNOS-UHFFFAOYSA-N -1 3 327.472 4.067 20 0 EIADHM Cc1cc(C(=O)Nc2ccc(Cl)cc2[O-])c2c(n1)onc2C(C)C ZINC000436734581 1041446823 /nfs/dbraw/zinc/44/68/23/1041446823.db2.gz AXWCFOKJVFRURU-UHFFFAOYSA-N -1 3 345.786 4.266 20 0 EIADHM Cc1cccc(C(=O)Nc2cnn(-c3ccccc3)c2C(C)C)c1[O-] ZINC000436731258 1041454002 /nfs/dbraw/zinc/45/40/02/1041454002.db2.gz BVSGGOXVQDVLGL-UHFFFAOYSA-N -1 3 335.407 4.262 20 0 EIADHM Cc1ccc(Sc2nc3c(cnn3-c3ccccc3)c(=O)[n-]2)c(C)c1 ZINC000461462889 1041455896 /nfs/dbraw/zinc/45/58/96/1041455896.db2.gz KGVJIUZZPDGBLX-UHFFFAOYSA-N -1 3 348.431 4.289 20 0 EIADHM Cc1ccc(C(=O)N2CCC(F)(c3cccc(Cl)c3)CC2)c([O-])c1 ZINC000436750346 1041463460 /nfs/dbraw/zinc/46/34/60/1041463460.db2.gz NDFATJFWANNWMA-UHFFFAOYSA-N -1 3 347.817 4.455 20 0 EIADHM CC(C)c1ccc(C(=O)N(C)CCCOCc2ccccc2)c([O-])c1 ZINC000436781637 1041479024 /nfs/dbraw/zinc/47/90/24/1041479024.db2.gz KOWLRSPCUCLZPR-UHFFFAOYSA-N -1 3 341.451 4.195 20 0 EIADHM CCSc1cccc(Br)c1[N-]C(=O)c1cscn1 ZINC000484887831 1041488470 /nfs/dbraw/zinc/48/84/70/1041488470.db2.gz XIKLCJKZPFRRPC-UHFFFAOYSA-N -1 3 343.271 4.270 20 0 EIADHM Cc1ccc(C2CCN(C(=O)c3ccc(C(C)C)cc3[O-])CC2)cn1 ZINC000436810071 1041491068 /nfs/dbraw/zinc/49/10/68/1041491068.db2.gz QVCXTCIPAYYFNQ-UHFFFAOYSA-N -1 3 338.451 4.239 20 0 EIADHM CC(C)c1ccc(C(=O)N2CC[C@@H](c3c(F)cccc3F)C2)c([O-])c1 ZINC000436822363 1041501058 /nfs/dbraw/zinc/50/10/58/1041501058.db2.gz UBMKWKOKQIHBCG-CQSZACIVSA-N -1 3 345.389 4.424 20 0 EIADHM O=C(c1ccccc1[O-])N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1 ZINC000436854696 1041506755 /nfs/dbraw/zinc/50/67/55/1041506755.db2.gz TWFUWNRELPLHSI-CYBMUJFWSA-N -1 3 335.325 4.041 20 0 EIADHM Cc1ccc([O-])c(C(=O)Nc2ccccc2O[C@H](C)C(F)(F)F)c1 ZINC000436843634 1041512896 /nfs/dbraw/zinc/51/28/96/1041512896.db2.gz JJFXZEMOKSFTMW-LLVKDONJSA-N -1 3 339.313 4.283 20 0 EIADHM CCc1cccc(C(=O)N(CCCCOC)Cc2ccccc2)c1[O-] ZINC000538743834 1041518207 /nfs/dbraw/zinc/51/82/07/1041518207.db2.gz OWFXCUQOVGBRAH-UHFFFAOYSA-N -1 3 341.451 4.024 20 0 EIADHM COc1ccccc1[C@@H]1CC[C@H](C)CN1C(=O)c1ccccc1[O-] ZINC000436857687 1041534986 /nfs/dbraw/zinc/53/49/86/1041534986.db2.gz BRDZOWUCKBBGEP-YOEHRIQHSA-N -1 3 325.408 4.014 20 0 EIADHM CCc1ccc(-c2nc(Cc3nccc4ccccc43)no2)c([O-])c1 ZINC000436880699 1041539749 /nfs/dbraw/zinc/53/97/49/1041539749.db2.gz KYGMXJPSZVUGRE-UHFFFAOYSA-N -1 3 331.375 4.144 20 0 EIADHM [O-]c1ccc(Cc2ccccc2)cc1-c1nc(Cc2ccncc2)no1 ZINC000436886556 1041542521 /nfs/dbraw/zinc/54/25/21/1041542521.db2.gz HDZNBYXFYPKLPN-UHFFFAOYSA-N -1 3 343.386 4.019 20 0 EIADHM COc1ccc(N(CCC(C)C)C(=O)c2cc(OC)ccc2[O-])cc1 ZINC000436910861 1041548690 /nfs/dbraw/zinc/54/86/90/1041548690.db2.gz OUZGOQFNLRUGNE-UHFFFAOYSA-N -1 3 343.423 4.102 20 0 EIADHM [O-]c1ccc(Cc2ccccc2)cc1-c1nc(Cc2cscn2)no1 ZINC000436898256 1041551546 /nfs/dbraw/zinc/55/15/46/1041551546.db2.gz XGASPPSKHHNHJU-UHFFFAOYSA-N -1 3 349.415 4.080 20 0 EIADHM COc1ccc2cc(-c3noc(-c4cccc(OC)c4[O-])n3)ccc2c1 ZINC000436900619 1041552619 /nfs/dbraw/zinc/55/26/19/1041552619.db2.gz DEMVPZFQDZDDTP-UHFFFAOYSA-N -1 3 348.358 4.280 20 0 EIADHM [O-]c1ccccc1-c1nc(-c2ccc(OCc3ccccc3)nc2)no1 ZINC000436924992 1041560823 /nfs/dbraw/zinc/56/08/23/1041560823.db2.gz YOFJXPRSBCJUTH-UHFFFAOYSA-N -1 3 345.358 4.083 20 0 EIADHM CC(C)c1ccc(-c2nc([C@H]3CCOc4ccccc43)no2)c([O-])c1 ZINC000436934393 1041563347 /nfs/dbraw/zinc/56/33/47/1041563347.db2.gz SMRJUSJYIQTXGO-HNNXBMFYSA-N -1 3 336.391 4.480 20 0 EIADHM CC(C)c1ccc(-c2nc(Cc3c[nH]c4ncccc34)no2)c([O-])c1 ZINC000436938216 1041566898 /nfs/dbraw/zinc/56/68/98/1041566898.db2.gz IKBUTPFJMWKMFE-UHFFFAOYSA-N -1 3 334.379 4.033 20 0 EIADHM C[C@H]1CN(C(=O)c2cc(Cc3ccccc3)ccc2[O-])CCC1(F)F ZINC000436936478 1041567131 /nfs/dbraw/zinc/56/71/31/1041567131.db2.gz GAISIBJEBZLMEG-AWEZNQCLSA-N -1 3 345.389 4.100 20 0 EIADHM CSc1ccc(S(=O)(=O)[N-]c2c(C)cccc2F)cc1Cl ZINC000464422997 1042007697 /nfs/dbraw/zinc/00/76/97/1042007697.db2.gz XXKXJMSKPFZZGP-UHFFFAOYSA-N -1 3 345.848 4.310 20 0 EIADHM CC(C)Cc1nnc([N-]C(=O)c2ncsc2-c2ccccc2)s1 ZINC000438044175 1042028388 /nfs/dbraw/zinc/02/83/88/1042028388.db2.gz LPCYDBOTIBIVPX-UHFFFAOYSA-N -1 3 344.465 4.112 20 0 EIADHM O=C([N-]c1csc(-c2ccccn2)n1)c1nc2ccccc2s1 ZINC000541748857 1042099454 /nfs/dbraw/zinc/09/94/54/1042099454.db2.gz GLBSSGZDFFJFPI-UHFFFAOYSA-N -1 3 338.417 4.067 20 0 EIADHM CC[C@H](C)Oc1ccc([N-]S(=O)(=O)c2ccc(F)c(C)c2)cc1 ZINC000517937049 1042283317 /nfs/dbraw/zinc/28/33/17/1042283317.db2.gz NJZLEWKUKAOPEU-ZDUSSCGKSA-N -1 3 337.416 4.112 20 0 EIADHM [O-]c1ccc(F)c(CN2CC=C(c3c[nH]c4ccccc34)CC2)c1F ZINC000438829272 1042372286 /nfs/dbraw/zinc/37/22/86/1042372286.db2.gz POTDUPTXUXHQPW-UHFFFAOYSA-N -1 3 340.373 4.441 20 0 EIADHM Cc1ccccc1-c1cc(=NC(=O)[C@@H](C)c2cccc(Cl)c2)[nH][n-]1 ZINC000439147404 1042519794 /nfs/dbraw/zinc/51/97/94/1042519794.db2.gz MWTYLSHXLLGABP-ZDUSSCGKSA-N -1 3 339.826 4.203 20 0 EIADHM COc1cccc(C(=O)Nc2ccc(OC3CCCC3)c(F)c2)c1[O-] ZINC000303938159 1042535125 /nfs/dbraw/zinc/53/51/25/1042535125.db2.gz DHKFMUQPCWJEQK-UHFFFAOYSA-N -1 3 345.370 4.114 20 0 EIADHM COc1c(C)cc(S(=O)(=O)[N-]c2cccc(C(F)F)c2)cc1C ZINC000509610563 1042689799 /nfs/dbraw/zinc/68/97/99/1042689799.db2.gz KPPUPAJJKPWJBD-UHFFFAOYSA-N -1 3 341.379 4.050 20 0 EIADHM O=C(/C=C/c1ccc2ccc(Cl)cc2n1)Nc1cccc([O-])c1F ZINC000492777584 1042747979 /nfs/dbraw/zinc/74/79/79/1042747979.db2.gz PFZHFMXVJVXTED-CMDGGOBGSA-N -1 3 342.757 4.385 20 0 EIADHM CC(C)c1ccc(/C=C\CC(=O)Nc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000492944230 1042775562 /nfs/dbraw/zinc/77/55/62/1042775562.db2.gz JYEALABGEGMEMA-HYXAFXHYSA-N -1 3 347.422 4.032 20 0 EIADHM CC(C)c1ccc(/C=C\CC(=O)Nc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000492944230 1042775568 /nfs/dbraw/zinc/77/55/68/1042775568.db2.gz JYEALABGEGMEMA-HYXAFXHYSA-N -1 3 347.422 4.032 20 0 EIADHM O=C([N-]c1cc(-c2ccccc2)on1)c1coc(-c2ccccc2)n1 ZINC000175862819 1042785621 /nfs/dbraw/zinc/78/56/21/1042785621.db2.gz HAGHILLQHXNNAE-UHFFFAOYSA-N -1 3 331.331 4.249 20 0 EIADHM Cc1cc2nc([N-]C(=O)c3ncsc3C(F)(F)F)oc2c(C)c1 ZINC000669971334 1042785853 /nfs/dbraw/zinc/78/58/53/1042785853.db2.gz VKHAUFAABHDMHV-UHFFFAOYSA-N -1 3 341.314 4.172 20 0 EIADHM CC(C)c1cnc(CNCCC[C@H](Cc2ccccc2)C(=O)[O-])s1 ZINC000417554440 1042872375 /nfs/dbraw/zinc/87/23/75/1042872375.db2.gz JJLLIFCJYBPAGL-MRXNPFEDSA-N -1 3 346.496 4.080 20 0 EIADHM CC(C)(C)c1ncc(CN[C@H](CCC(=O)[O-])c2ccccc2)s1 ZINC000417590105 1042895618 /nfs/dbraw/zinc/89/56/18/1042895618.db2.gz BKLSSVSJEATKOH-OAHLLOKOSA-N -1 3 332.469 4.136 20 0 EIADHM COc1ccc(C(=O)Nc2cccc([O-])c2F)c(OCCC(C)C)c1 ZINC000189856921 1043009781 /nfs/dbraw/zinc/00/97/81/1043009781.db2.gz QKQIJNHOQTUCFE-UHFFFAOYSA-N -1 3 347.386 4.217 20 0 EIADHM Cc1ccc(C(=O)N=c2cc(-c3ccccc3C)[n-][nH]2)c(Cl)c1 ZINC000427715548 1043175245 /nfs/dbraw/zinc/17/52/45/1043175245.db2.gz QSGFVZUFRRPILI-UHFFFAOYSA-N -1 3 325.799 4.021 20 0 EIADHM COc1cccc(C(=O)Nc2ccccc2N2CCCCCC2)c1[O-] ZINC000219043091 1043182183 /nfs/dbraw/zinc/18/21/83/1043182183.db2.gz OCURGZGLOWWQMB-UHFFFAOYSA-N -1 3 340.423 4.034 20 0 EIADHM [O-]c1cc(F)cc(CNc2ccc(-c3ncc4n3CCCC4)cc2)c1 ZINC000185589275 1043201474 /nfs/dbraw/zinc/20/14/74/1043201474.db2.gz JXURUTHUCLOVKM-UHFFFAOYSA-N -1 3 337.398 4.343 20 0 EIADHM CCOc1ccccc1[N-]S(=O)(=O)/C=C/c1ccccc1Cl ZINC000727349828 1043203684 /nfs/dbraw/zinc/20/36/84/1043203684.db2.gz KWGNQIVETRPJNP-VAWYXSNFSA-N -1 3 337.828 4.151 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N(C[C@@H]1CCCO1)C1CCCC1 ZINC000525935078 1043236709 /nfs/dbraw/zinc/23/67/09/1043236709.db2.gz UDIVSJQLTOZUHR-SFHVURJKSA-N -1 3 339.435 4.109 20 0 EIADHM O=C([N-]c1c(F)cccc1F)c1cnc(Cc2ccccc2F)s1 ZINC000186004550 1043238503 /nfs/dbraw/zinc/23/85/03/1043238503.db2.gz QOFDQFBWIHKVKI-UHFFFAOYSA-N -1 3 348.349 4.404 20 0 EIADHM Cc1ccccc1[C@H]1CCN(C(=O)c2cc([O-])c3ccccc3c2)C1 ZINC000526890463 1043243749 /nfs/dbraw/zinc/24/37/49/1043243749.db2.gz KWVLMSZYKXLMGV-KRWDZBQOSA-N -1 3 331.415 4.484 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N1CCC(c2ccc(O)cc2)CC1 ZINC000527166811 1043253105 /nfs/dbraw/zinc/25/31/05/1043253105.db2.gz KIROYALSSVNOPG-UHFFFAOYSA-N -1 3 347.414 4.271 20 0 EIADHM CCC(CC)[C@H]1C[C@@H](NC(=O)c2cc([O-])c3ccccc3c2)CCO1 ZINC000527170423 1043253725 /nfs/dbraw/zinc/25/37/25/1043253725.db2.gz IWXDPLAFDMQCQV-FXAWDEMLSA-N -1 3 341.451 4.259 20 0 EIADHM CCCCN(Cc1ccccc1F)C(=O)NCc1ccc([O-])c(F)c1 ZINC000163645454 1043257101 /nfs/dbraw/zinc/25/71/01/1043257101.db2.gz AMYGNZUYLFVPDE-UHFFFAOYSA-N -1 3 348.393 4.182 20 0 EIADHM CC(C)c1cc(C(=O)NCc2ccc([O-])c(F)c2)c2ccccc2n1 ZINC000427953670 1043273971 /nfs/dbraw/zinc/27/39/71/1043273971.db2.gz WNTPGQFXUDFJBD-UHFFFAOYSA-N -1 3 338.382 4.133 20 0 EIADHM C[C@@H]1C[C@H](CCNC(=O)c2c[n-]c3ccccc3c2=O)CC(C)(C)C1 ZINC001128609580 1043415175 /nfs/dbraw/zinc/41/51/75/1043415175.db2.gz ZSAGKENWMUIUFA-CABCVRRESA-N -1 3 340.467 4.110 20 0 EIADHM Cc1cc(Br)c(Nc2cc(F)cc(F)c2[O-])nc1C ZINC001212482086 1043456935 /nfs/dbraw/zinc/45/69/35/1043456935.db2.gz ZNQZVDLYPNYSQN-UHFFFAOYSA-N -1 3 329.144 4.188 20 0 EIADHM CSc1ccncc1[N-]C(=O)c1csc(Cc2ccccc2)n1 ZINC000674258448 1043521182 /nfs/dbraw/zinc/52/11/82/1043521182.db2.gz MVLQCSRAWMVXIE-UHFFFAOYSA-N -1 3 341.461 4.103 20 0 EIADHM C[C@@H](CS(=O)(=O)[N-]c1cc(Cl)cc(F)c1F)c1ccccc1 ZINC000442231941 1043562870 /nfs/dbraw/zinc/56/28/70/1043562870.db2.gz AYGPNXXUTPGTDV-JTQLQIEISA-N -1 3 345.798 4.164 20 0 EIADHM CS[C@H]1CCCCN([C@@H](C(=O)[O-])c2ccc(Cl)c(Cl)c2)C1 ZINC000521257585 1043670084 /nfs/dbraw/zinc/67/00/84/1043670084.db2.gz MORSJIKHDANULL-SMDDNHRTSA-N -1 3 348.295 4.337 20 0 EIADHM Cc1ccc(-c2nsc([N-]C(=O)c3cccc(F)c3F)n2)s1 ZINC000066412778 1043688442 /nfs/dbraw/zinc/68/84/42/1043688442.db2.gz MSVHBOBOEFPPJA-UHFFFAOYSA-N -1 3 337.376 4.106 20 0 EIADHM Cc1csc(C(=O)Nc2ccc(Cl)cc2[O-])c1Br ZINC000190988307 1043759666 /nfs/dbraw/zinc/75/96/66/1043759666.db2.gz USHYTHPYRBFLBM-UHFFFAOYSA-N -1 3 346.633 4.430 20 0 EIADHM CSc1cc(O)ccc1[N-]C(=O)c1ncoc1-c1ccc(C)cc1 ZINC000191559349 1043826845 /nfs/dbraw/zinc/82/68/45/1043826845.db2.gz JUJDVDQNVMQQEQ-UHFFFAOYSA-N -1 3 340.404 4.330 20 0 EIADHM Cc1cc([N-]S(=O)(=O)c2ccc3ccccc3c2)ccc1N(C)C ZINC000731782699 1043831512 /nfs/dbraw/zinc/83/15/12/1043831512.db2.gz KRHRYLXTTRNPNC-UHFFFAOYSA-N -1 3 340.448 4.015 20 0 EIADHM COc1ccc([O-])c(C(=O)Nc2ccc3oc(C(C)(C)C)nc3c2)c1 ZINC000509234628 1043841639 /nfs/dbraw/zinc/84/16/39/1043841639.db2.gz AIJWAHVTRDZGBB-UHFFFAOYSA-N -1 3 340.379 4.092 20 0 EIADHM CCc1nc([C@H](C)[N-]C(=O)C(F)(F)c2cccc(Cl)c2)cs1 ZINC000732032778 1043867018 /nfs/dbraw/zinc/86/70/18/1043867018.db2.gz RRHKJATYLCPJHC-VIFPVBQESA-N -1 3 344.814 4.328 20 0 EIADHM O=C([N-]c1cc(-c2ccccc2F)no1)C(F)(F)c1ccccc1 ZINC000732829844 1044015628 /nfs/dbraw/zinc/01/56/28/1044015628.db2.gz UXIXCYRJRZAWAE-UHFFFAOYSA-N -1 3 332.281 4.211 20 0 EIADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)C[C@@H](C)CC(C)C)c2)n1 ZINC000067815677 1044042352 /nfs/dbraw/zinc/04/23/52/1044042352.db2.gz QQFDFVAVMMZXFU-AWEZNQCLSA-N -1 3 341.455 4.010 20 0 EIADHM O=[S@](c1ccc([O-])cc1)[C@H]1CCc2c1cc(Cl)cc2Cl ZINC000443392000 1044245459 /nfs/dbraw/zinc/24/54/59/1044245459.db2.gz IZWDRRSLAYAVER-MGPUTAFESA-N -1 3 327.232 4.494 20 0 EIADHM Cc1cc(N(C)C)cc(C)c1[N-]S(=O)(=O)c1cccc(C(C)C)c1 ZINC000443419749 1044271940 /nfs/dbraw/zinc/27/19/40/1044271940.db2.gz SBLDXTYQELDUGP-UHFFFAOYSA-N -1 3 346.496 4.294 20 0 EIADHM O=C([N-]c1ncc(Cl)cc1Cl)c1cc(-c2ccccc2)no1 ZINC000642292382 1044302573 /nfs/dbraw/zinc/30/25/73/1044302573.db2.gz XJXRAOBPEPULSN-UHFFFAOYSA-N -1 3 334.162 4.296 20 0 EIADHM CCc1nc(C(=O)[N-]c2cccc(Cl)c2SCC(F)F)co1 ZINC000543389583 1044485013 /nfs/dbraw/zinc/48/50/13/1044485013.db2.gz KCWRMBZSRQWDBP-UHFFFAOYSA-N -1 3 346.786 4.500 20 0 EIADHM Cc1cccc(NC(=O)[C@H](C)OC(=O)c2cc3ccsc3[n-]2)c1C ZINC000914890138 1044852073 /nfs/dbraw/zinc/85/20/73/1044852073.db2.gz CHISAHVBGISCKM-LBPRGKRZSA-N -1 3 342.420 4.030 20 0 EIADHM Cc1ccc(NC(=O)[C@H](C)OC(=O)c2cc3ccsc3[n-]2)cc1C ZINC000914891254 1044852758 /nfs/dbraw/zinc/85/27/58/1044852758.db2.gz LIIMNFACXCBVFX-LBPRGKRZSA-N -1 3 342.420 4.030 20 0 EIADHM CCC(CC)[C@H](C)C(=O)Oc1cccc(-c2nc(C)cc(=O)[n-]2)c1 ZINC000762063740 1044886096 /nfs/dbraw/zinc/88/60/96/1044886096.db2.gz DNIRAWYUVWNCJZ-ZDUSSCGKSA-N -1 3 328.412 4.135 20 0 EIADHM Cc1ccc(-c2c[nH]cc2C(=O)N=c2cc(-c3ccccc3)[n-][nH]2)s1 ZINC000429069409 1045101477 /nfs/dbraw/zinc/10/14/77/1045101477.db2.gz QJVNPKROKBUVMI-UHFFFAOYSA-N -1 3 348.431 4.116 20 0 EIADHM C[C@@H]1CN(Cc2c(C(=O)[O-])sc3cccc(F)c32)C[C@@H](C)S1 ZINC000387078565 1045415697 /nfs/dbraw/zinc/41/56/97/1045415697.db2.gz OXCQBCRBXQMIMB-NXEZZACHSA-N -1 3 339.457 4.064 20 0 EIADHM O=C(Cc1cccc(Cl)c1)[N-]OCc1ccc(C(F)(F)F)cc1 ZINC000746932543 1045545663 /nfs/dbraw/zinc/54/56/63/1045545663.db2.gz FOVHGMNBUKOKCL-UHFFFAOYSA-N -1 3 343.732 4.149 20 0 EIADHM CCO[N-]C(=O)CC1(Cc2nc3ccccc3s2)CCCCC1 ZINC000790930025 1045624513 /nfs/dbraw/zinc/62/45/13/1045624513.db2.gz IAURAOZCNQAJIP-UHFFFAOYSA-N -1 3 332.469 4.247 20 0 EIADHM Cc1nc(-c2ccccc2)ncc1C(=O)Nc1ccc(Cl)cc1[O-] ZINC000533617109 1045638458 /nfs/dbraw/zinc/63/84/58/1045638458.db2.gz OBWBYBQZVYCRJO-UHFFFAOYSA-N -1 3 339.782 4.063 20 0 EIADHM CCS[C@H]1CCCC[C@H]1NC(=O)c1cc2sccc2c([O-])c1 ZINC000791382383 1045728486 /nfs/dbraw/zinc/72/84/86/1045728486.db2.gz YOMWXYLUJTZICV-HIFRSBDPSA-N -1 3 335.494 4.401 20 0 EIADHM O=C(NCC1(c2cccc(F)c2)CC1)c1cc2sccc2c([O-])c1 ZINC000791365927 1045731435 /nfs/dbraw/zinc/73/14/35/1045731435.db2.gz FKGJQXDYLJFZPI-UHFFFAOYSA-N -1 3 341.407 4.208 20 0 EIADHM Cc1cc(=O)[n-]c(CSCc2cc(-c3ccc(Cl)cc3)no2)n1 ZINC000763207663 1045742388 /nfs/dbraw/zinc/74/23/88/1045742388.db2.gz DJNIPHFANAYFSA-UHFFFAOYSA-N -1 3 347.827 4.232 20 0 EIADHM C[C@@]1(c2noc(-c3cc(Cc4ccccc4)ccc3[O-])n2)CCCO1 ZINC000763319432 1045820755 /nfs/dbraw/zinc/82/07/55/1045820755.db2.gz GGAFBZNVWSYUIW-FQEVSTJZSA-N -1 3 336.391 4.059 20 0 EIADHM [O-]c1ccc(Nc2ccc(F)c(F)c2Br)c(F)c1F ZINC001212007509 1045827984 /nfs/dbraw/zinc/82/79/84/1045827984.db2.gz JZEIQYTVMVTQIS-UHFFFAOYSA-N -1 3 336.082 4.455 20 0 EIADHM CC(=O)c1c(Br)cccc1Nc1ccc([O-])c(F)c1F ZINC001212014055 1045834938 /nfs/dbraw/zinc/83/49/38/1045834938.db2.gz XGNDYCUJGBGRTM-UHFFFAOYSA-N -1 3 342.139 4.379 20 0 EIADHM CCOC(=O)Cc1ccc(Nc2ccc([O-])c(F)c2F)c(Cl)c1 ZINC001212013701 1045834956 /nfs/dbraw/zinc/83/49/56/1045834956.db2.gz FSCHLMQIEYLAQD-UHFFFAOYSA-N -1 3 341.741 4.173 20 0 EIADHM COc1cccc(Nc2ccc([O-])c(F)c2F)c1C(=O)C(F)(F)F ZINC001212016590 1045841693 /nfs/dbraw/zinc/84/16/93/1045841693.db2.gz XGUVTPVYNZTSLW-UHFFFAOYSA-N -1 3 347.239 4.168 20 0 EIADHM O=C(Nc1cccc(-c2cn[nH]c2)c1)c1cc([O-])c2ccccc2c1 ZINC000792280146 1045884534 /nfs/dbraw/zinc/88/45/34/1045884534.db2.gz CTLYYVNVVPRGSU-UHFFFAOYSA-N -1 3 329.359 4.188 20 0 EIADHM CC(C)OC1CCC(NC(=O)c2cc([O-])c3ccccc3c2)CC1 ZINC000792274962 1045888365 /nfs/dbraw/zinc/88/83/65/1045888365.db2.gz ORNQVSXKPGPJTP-UHFFFAOYSA-N -1 3 327.424 4.011 20 0 EIADHM CCCCn1nc(C)c(/C=C/C(=O)c2ccc([O-])c(OC)c2)c1Cl ZINC000008322802 1045943616 /nfs/dbraw/zinc/94/36/16/1045943616.db2.gz YJFWIBSQOSVTQN-VQHVLOKHSA-N -1 3 348.830 4.255 20 0 EIADHM CSc1ccc([O-])c(C(=O)N(C)[C@H]2CC[C@@H](C(F)(F)F)CC2)c1 ZINC000614947989 1045963139 /nfs/dbraw/zinc/96/31/39/1045963139.db2.gz ATGXFZJGMLBESW-PHIMTYICSA-N -1 3 347.402 4.307 20 0 EIADHM COc1cccc(C(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)c1[O-] ZINC000320040596 1045995892 /nfs/dbraw/zinc/99/58/92/1045995892.db2.gz QBKOEYYBXLXTOM-UHFFFAOYSA-N -1 3 345.704 4.325 20 0 EIADHM Cc1ccc(C(=O)Nc2ccccc2SC(=O)N(C)C)c([O-])c1C ZINC000769759624 1046058608 /nfs/dbraw/zinc/05/86/08/1046058608.db2.gz PLNQFOJSZQGTEY-UHFFFAOYSA-N -1 3 344.436 4.035 20 0 EIADHM COc1ccc(Cl)c([N-]S(=O)(=O)c2cc(C)ccc2Cl)c1 ZINC000124175983 1046221727 /nfs/dbraw/zinc/22/17/27/1046221727.db2.gz XJTLTIIQIALLSM-UHFFFAOYSA-N -1 3 346.235 4.111 20 0 EIADHM COc1ccc(N(C(=O)c2cc(C)ccc2[O-])[C@@H](C)C2CC2)cc1 ZINC000124608877 1046251868 /nfs/dbraw/zinc/25/18/68/1046251868.db2.gz ZARGJSSBTDDSQD-AWEZNQCLSA-N -1 3 325.408 4.155 20 0 EIADHM CC(C)Sc1cccc(Cl)c1CN1C[C@H](C(=O)[O-])C[C@H](C)C1 ZINC000263092157 1046253171 /nfs/dbraw/zinc/25/31/71/1046253171.db2.gz UNQRBAJDPJIYSQ-QWHCGFSZSA-N -1 3 341.904 4.383 20 0 EIADHM COc1ccc2oc([C@H](C)NCc3ccc(C(=O)[O-])cc3)c(C)c2c1 ZINC000263382986 1046278418 /nfs/dbraw/zinc/27/84/18/1046278418.db2.gz CFASTWZZYRWTQQ-ZDUSSCGKSA-N -1 3 339.391 4.299 20 0 EIADHM COc1ccccc1CSc1ccccc1[N-]C(=O)c1ccon1 ZINC000125730251 1046333375 /nfs/dbraw/zinc/33/33/75/1046333375.db2.gz NFPONIKQIFBHLZ-UHFFFAOYSA-N -1 3 340.404 4.228 20 0 EIADHM CCOc1cc(CNc2ccc3c(c2)OCCCO3)cc(Cl)c1[O-] ZINC000916840454 1046386220 /nfs/dbraw/zinc/38/62/20/1046386220.db2.gz CGJAKNVWAHRWLD-UHFFFAOYSA-N -1 3 349.814 4.218 20 0 EIADHM Cc1sc2[n-]c([C@H](C)OC(=O)[C@@H]3CCCC3(C)C)nc(=O)c2c1C ZINC000772608429 1046672943 /nfs/dbraw/zinc/67/29/43/1046672943.db2.gz MPHUKUWWNKBCEQ-JQWIXIFHSA-N -1 3 348.468 4.444 20 0 EIADHM Cc1ccc(-c2nc(C(=O)[N-]c3ccnc(Cl)c3F)cs2)o1 ZINC001129739975 1046689925 /nfs/dbraw/zinc/68/99/25/1046689925.db2.gz PPAVSOBPPBPEKD-UHFFFAOYSA-N -1 3 337.763 4.151 20 0 EIADHM CSc1cc(NC(=O)c2c[n-]c3ccccc3c2=O)ccc1Cl ZINC001129735746 1046691833 /nfs/dbraw/zinc/69/18/33/1046691833.db2.gz AWTYBWUVFMOUJA-UHFFFAOYSA-N -1 3 344.823 4.156 20 0 EIADHM O=C(CCCCC(=O)c1ccccc1)Nc1cc(Cl)ccc1[O-] ZINC000067145664 1046715255 /nfs/dbraw/zinc/71/52/55/1046715255.db2.gz MWSZRNNORDTSBD-UHFFFAOYSA-N -1 3 331.799 4.427 20 0 EIADHM CCOc1cc(CNc2ccc3c(C)nn(C)c3c2)cc(Cl)c1[O-] ZINC000459557514 1046775042 /nfs/dbraw/zinc/77/50/42/1046775042.db2.gz MABXADKSWTVXGJ-UHFFFAOYSA-N -1 3 345.830 4.252 20 0 EIADHM O=C(CSCc1ccc(Cl)cc1)Nc1cccc([O-])c1F ZINC000128267477 1046802617 /nfs/dbraw/zinc/80/26/17/1046802617.db2.gz CXWKBNRJBGKBFE-UHFFFAOYSA-N -1 3 325.792 4.057 20 0 EIADHM Cc1oc(-c2cccs2)nc1COC(=O)c1cc2occc2[n-]1 ZINC000786032134 1046803591 /nfs/dbraw/zinc/80/35/91/1046803591.db2.gz RDZPOFZCGKUGFW-UHFFFAOYSA-N -1 3 328.349 4.143 20 0 EIADHM CCc1cc2c(CSc3ncccc3C)cc(=O)oc2cc1[O-] ZINC000804921489 1046828531 /nfs/dbraw/zinc/82/85/31/1046828531.db2.gz ABHAXEDQOGACHF-UHFFFAOYSA-N -1 3 327.405 4.057 20 0 EIADHM O=C(Cc1cccc2ccccc21)[N-]OCCCCC(F)(F)F ZINC000154348859 1046833881 /nfs/dbraw/zinc/83/38/81/1046833881.db2.gz SDZVBRYXDLLTHY-UHFFFAOYSA-N -1 3 325.330 4.163 20 0 EIADHM Cc1ccc2c(c1)CCCN2C(=O)CCCc1ccc([O-])c(F)c1 ZINC000786717509 1046859919 /nfs/dbraw/zinc/85/99/19/1046859919.db2.gz FLEMEAPNWMLNPN-UHFFFAOYSA-N -1 3 327.399 4.142 20 0 EIADHM O=C(Nc1cccc([O-])c1F)c1ccccc1C(=O)c1cccs1 ZINC000128500664 1046892942 /nfs/dbraw/zinc/89/29/42/1046892942.db2.gz YHROEFNPCGTTTL-UHFFFAOYSA-N -1 3 341.363 4.076 20 0 EIADHM CCc1cc(=O)[n-]c(CN[C@H](c2oc3ccccc3c2C)C(C)C)n1 ZINC000537059220 1046910220 /nfs/dbraw/zinc/91/02/20/1046910220.db2.gz UUNKXYRMPJZJST-IBGZPJMESA-N -1 3 339.439 4.286 20 0 EIADHM Cc1ccc(NC(=O)c2c[n-]c3ccccc3c2=O)c(Cl)c1C ZINC001130309359 1046967341 /nfs/dbraw/zinc/96/73/41/1046967341.db2.gz JOXXREGYRQYHBX-UHFFFAOYSA-N -1 3 326.783 4.051 20 0 EIADHM Cc1cc([C@@H]([N-]C(=O)C(F)F)c2ccccc2Cl)ccc1F ZINC000787384129 1046999479 /nfs/dbraw/zinc/99/94/79/1046999479.db2.gz OUWRCBCNYHIJOV-CQSZACIVSA-N -1 3 327.733 4.258 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)OCc1cccc2cccnc21 ZINC000787846991 1047058343 /nfs/dbraw/zinc/05/83/43/1047058343.db2.gz YLJSKSLFQKGDRA-UHFFFAOYSA-N -1 3 339.366 4.146 20 0 EIADHM O=C(CCOc1cccc(Cl)c1Cl)Nc1cccc([O-])c1F ZINC000128797799 1047080349 /nfs/dbraw/zinc/08/03/49/1047080349.db2.gz XAJDMZHUGORASI-UHFFFAOYSA-N -1 3 344.169 4.246 20 0 EIADHM CN(CCCOc1ccccc1)C(=O)c1cc2sccc2c([O-])c1 ZINC000788279156 1047156225 /nfs/dbraw/zinc/15/62/25/1047156225.db2.gz FAOQDRGDVVIOHR-UHFFFAOYSA-N -1 3 341.432 4.148 20 0 EIADHM CCN(Cc1ccc(OC)cc1)C(=O)c1cc2sccc2c([O-])c1 ZINC000788280985 1047156370 /nfs/dbraw/zinc/15/63/70/1047156370.db2.gz BURDZNOPLUDZGY-UHFFFAOYSA-N -1 3 341.432 4.278 20 0 EIADHM CC(C)COc1ccc(S(=O)(=O)[N-]c2ccc3[nH]ccc3c2)cc1 ZINC000497954895 1047208899 /nfs/dbraw/zinc/20/88/99/1047208899.db2.gz IEYSTWXBLMGFJM-UHFFFAOYSA-N -1 3 344.436 4.004 20 0 EIADHM Cc1ccc(-c2nc(CN[C@H](C)CCC[C@@H](C)C(=O)[O-])cs2)cc1 ZINC000325635435 1047287841 /nfs/dbraw/zinc/28/78/41/1047287841.db2.gz VIZYNHFEFCHGSG-HUUCEWRRSA-N -1 3 346.496 4.488 20 0 EIADHM C[C@H](Oc1cccc(Cl)c1Cl)C(=O)Nc1cccc([O-])c1F ZINC000129084206 1047289000 /nfs/dbraw/zinc/28/90/00/1047289000.db2.gz RCNGJAXEXQCEQK-QMMMGPOBSA-N -1 3 344.169 4.244 20 0 EIADHM O=C(Nc1cccc([O-])c1F)c1[nH]c2ccccc2c1Br ZINC000129088612 1047289577 /nfs/dbraw/zinc/28/95/77/1047289577.db2.gz RBBVWINWVYEJNF-UHFFFAOYSA-N -1 3 349.159 4.027 20 0 EIADHM C[C@H](Oc1ccc(Cl)c(Cl)c1)C(=O)Nc1cccc([O-])c1F ZINC000129308422 1047348463 /nfs/dbraw/zinc/34/84/63/1047348463.db2.gz WVNSXQLNVQCAKV-QMMMGPOBSA-N -1 3 344.169 4.244 20 0 EIADHM O=C(COc1ccccc1Cl)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000476129332 1047350920 /nfs/dbraw/zinc/35/09/20/1047350920.db2.gz BSHHDRFQVZTYPT-UHFFFAOYSA-N -1 3 345.704 4.082 20 0 EIADHM O=C(Nc1ccc([O-])c(C(F)(F)F)c1)[C@H]1Cc2ccccc2S1 ZINC000476137006 1047369853 /nfs/dbraw/zinc/36/98/53/1047369853.db2.gz DURSJQZSIOYDAB-CQSZACIVSA-N -1 3 339.338 4.067 20 0 EIADHM COc1ccc(C(=O)CCCC(=O)Nc2cc(Cl)ccc2[O-])cc1 ZINC000129461089 1047396771 /nfs/dbraw/zinc/39/67/71/1047396771.db2.gz IAHKMTIHNPEPIQ-UHFFFAOYSA-N -1 3 347.798 4.046 20 0 EIADHM COc1ccsc1C(=O)[N-]c1nnc(-c2ccc(C)cc2C)s1 ZINC000105955880 1047650725 /nfs/dbraw/zinc/65/07/25/1047650725.db2.gz XXICHGMFSHJOOY-UHFFFAOYSA-N -1 3 345.449 4.144 20 0 EIADHM CC(C)(C)OC(=O)Nc1cccc(C(=O)Nc2cc(F)ccc2[O-])c1 ZINC000174871282 1047660960 /nfs/dbraw/zinc/66/09/60/1047660960.db2.gz VTFBOMAJXVQMOV-UHFFFAOYSA-N -1 3 346.358 4.131 20 0 EIADHM O=C([N-]c1cccc2ocnc21)c1cc(-c2cccc(Cl)c2)no1 ZINC000556438159 1047760710 /nfs/dbraw/zinc/76/07/10/1047760710.db2.gz QNKUAXOCWZEBAQ-UHFFFAOYSA-N -1 3 339.738 4.389 20 0 EIADHM O=C(Nc1cc(Br)ccc1[O-])c1ccc(Cl)c(F)c1 ZINC000498650702 1047800401 /nfs/dbraw/zinc/80/04/01/1047800401.db2.gz YNOGYDWCSPQXDW-UHFFFAOYSA-N -1 3 344.567 4.200 20 0 EIADHM CSc1ccc(COC(=O)c2cc(-c3ccc(C)o3)[n-]n2)cc1 ZINC000919326996 1047814223 /nfs/dbraw/zinc/81/42/23/1047814223.db2.gz VYLFHWMNHVCTBF-UHFFFAOYSA-N -1 3 328.393 4.057 20 0 EIADHM CSc1ccc(COC(=O)c2cc(-c3ccc(C)o3)n[n-]2)cc1 ZINC000919326996 1047814229 /nfs/dbraw/zinc/81/42/29/1047814229.db2.gz VYLFHWMNHVCTBF-UHFFFAOYSA-N -1 3 328.393 4.057 20 0 EIADHM Cc1cccc([C@@H](NC(=O)c2cc([O-])ccc2Cl)C(F)(F)F)c1 ZINC000498804986 1047853391 /nfs/dbraw/zinc/85/33/91/1047853391.db2.gz OPKNHKWRCYLUTL-CQSZACIVSA-N -1 3 343.732 4.387 20 0 EIADHM CC(=O)c1cccc(NC(=O)[C@@H](C)Oc2cccc3ccccc32)c1[O-] ZINC000556893707 1048137236 /nfs/dbraw/zinc/13/72/36/1048137236.db2.gz YTGRXZQHXHKVKR-CQSZACIVSA-N -1 3 349.386 4.154 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2cccc(CCC(F)(F)F)c2)cc1 ZINC000131958638 1048174589 /nfs/dbraw/zinc/17/45/89/1048174589.db2.gz BMTBFEXBYWFQOO-UHFFFAOYSA-N -1 3 343.370 4.291 20 0 EIADHM O=C(c1cc(Oc2ccccc2)ccc1[O-])N1Cc2ccccc2C1 ZINC001144042939 1048376819 /nfs/dbraw/zinc/37/68/19/1048376819.db2.gz NVRPCTIIVDRSCI-UHFFFAOYSA-N -1 3 331.371 4.341 20 0 EIADHM CC(C)n1cc(C(=O)[N-]c2cccc(Cl)c2SC(F)F)nn1 ZINC000815229485 1048386048 /nfs/dbraw/zinc/38/60/48/1048386048.db2.gz DEFWPYSVMNWFMD-UHFFFAOYSA-N -1 3 346.790 4.079 20 0 EIADHM Cc1nc(C(C)C)ccc1COC(=O)CCCc1ccc([O-])c(F)c1 ZINC000815236664 1048400386 /nfs/dbraw/zinc/40/03/86/1048400386.db2.gz COBIFQQDQUYQFZ-UHFFFAOYSA-N -1 3 345.414 4.424 20 0 EIADHM CC(C)(C)[C@@H]1CCCC[C@H]1CNC(=O)c1c[n-]c2ccccc2c1=O ZINC000920040022 1048401567 /nfs/dbraw/zinc/40/15/67/1048401567.db2.gz NDBGUERBVDEYBO-WMLDXEAASA-N -1 3 340.467 4.110 20 0 EIADHM O=C(c1ccccc1[O-])N1CCC(CCc2ccc(F)cc2F)CC1 ZINC001144195778 1048489269 /nfs/dbraw/zinc/48/92/69/1048489269.db2.gz YVXGZHQGXIKELJ-UHFFFAOYSA-N -1 3 345.389 4.155 20 0 EIADHM Cc1cccc([N-]S(=O)(=O)c2ccccc2OC(F)F)c1Cl ZINC000075082112 1048656587 /nfs/dbraw/zinc/65/65/87/1048656587.db2.gz DYFWTOCRZAEKAP-UHFFFAOYSA-N -1 3 347.770 4.051 20 0 EIADHM O=C([N-]c1ccc(F)c(F)c1F)c1nc(-c2ccccc2)cs1 ZINC000075452075 1048728321 /nfs/dbraw/zinc/72/83/21/1048728321.db2.gz FGPHAATZJIBDKW-UHFFFAOYSA-N -1 3 334.322 4.480 20 0 EIADHM O=C(Nc1cc(-c2ccccc2F)no1)c1cc([O-])ccc1Cl ZINC000810343632 1048765901 /nfs/dbraw/zinc/76/59/01/1048765901.db2.gz NFVXUIXLSFFXHA-UHFFFAOYSA-N -1 3 332.718 4.092 20 0 EIADHM COc1cccc(C2CCN(Cc3cc(F)c([O-])cc3F)CC2)c1 ZINC001144663946 1048780453 /nfs/dbraw/zinc/78/04/53/1048780453.db2.gz OWXOJVIWHMWZFK-UHFFFAOYSA-N -1 3 333.378 4.059 20 0 EIADHM COc1cccc([C@@H]2CCCN(Cc3cc(F)c([O-])cc3F)C2)c1 ZINC001144663560 1048781929 /nfs/dbraw/zinc/78/19/29/1048781929.db2.gz GKJBQHLXEMIVDN-CQSZACIVSA-N -1 3 333.378 4.059 20 0 EIADHM Cc1ncsc1CCOC(=O)c1cc2cc(Cl)sc2[n-]1 ZINC000810538450 1048815359 /nfs/dbraw/zinc/81/53/59/1048815359.db2.gz DQWSXSGVYCPSLU-UHFFFAOYSA-N -1 3 326.830 4.047 20 0 EIADHM O=C(OCCn1ncc2ccccc21)c1cc2cc(Cl)sc2[n-]1 ZINC000810592449 1048824839 /nfs/dbraw/zinc/82/48/39/1048824839.db2.gz UQQZRFZQCPWHSB-UHFFFAOYSA-N -1 3 345.811 4.090 20 0 EIADHM C[C@@H]1C[C@@H]1c1ccc(C[N-]C(=O)C(F)(F)c2cccc(Cl)c2)o1 ZINC000921004287 1048835312 /nfs/dbraw/zinc/83/53/12/1048835312.db2.gz CNIMXMYTHOGUOW-YGRLFVJLSA-N -1 3 339.769 4.465 20 0 EIADHM C[C@H]1CN(C(=O)c2cc(CCc3ccccc3)ccc2[O-])CC[C@@H]1C ZINC001137556942 1048843218 /nfs/dbraw/zinc/84/32/18/1048843218.db2.gz FOIHILCHSQDLAT-IRXDYDNUSA-N -1 3 337.463 4.296 20 0 EIADHM CCCC[C@](CC)(Nc1ccc2c(c1)[N-]C(=S)C2)C(=O)OCC ZINC001171232335 1048877964 /nfs/dbraw/zinc/87/79/64/1048877964.db2.gz HVEWQOYBDWRACK-SFHVURJKSA-N -1 3 334.485 4.296 20 0 EIADHM O=C(Nc1ccc([O-])c(C(F)(F)F)c1)c1ccnc2ccccc21 ZINC000134133564 1048886286 /nfs/dbraw/zinc/88/62/86/1048886286.db2.gz OHLYMJKFKYQRRE-UHFFFAOYSA-N -1 3 332.281 4.212 20 0 EIADHM C[C@H](C(=O)Nc1ccc([O-])c(C(F)(F)F)c1)c1cccc(F)c1 ZINC000134175416 1048891496 /nfs/dbraw/zinc/89/14/96/1048891496.db2.gz FRUZMWZDMBMQQX-VIFPVBQESA-N -1 3 327.277 4.292 20 0 EIADHM O=C(Nc1ccc([O-])c(C(F)(F)F)c1)c1cncc2ccccc21 ZINC000134188432 1048893640 /nfs/dbraw/zinc/89/36/40/1048893640.db2.gz NMPQODFKRZYIBY-UHFFFAOYSA-N -1 3 332.281 4.212 20 0 EIADHM COc1cc(NC(=O)c2cc3sccc3c([O-])c2)cc(OC)c1C ZINC000817147558 1048902610 /nfs/dbraw/zinc/90/26/10/1048902610.db2.gz RFSWCYJPXYHYOF-UHFFFAOYSA-N -1 3 343.404 4.185 20 0 EIADHM Cc1sc2[n-]c([C@H](C)OC(=O)[C@@H]3CC[C@H]4C[C@H]4C3)nc(=O)c2c1C ZINC000817200801 1048911456 /nfs/dbraw/zinc/91/14/56/1048911456.db2.gz ILPCOQDXFDUZLN-SYEHKZFSSA-N -1 3 346.452 4.054 20 0 EIADHM CO[C@H](COC(=O)c1cc2cc(Cl)sc2[n-]1)c1ccccc1 ZINC000811393660 1049050366 /nfs/dbraw/zinc/05/03/66/1049050366.db2.gz PFALYPLDWCLTLL-CYBMUJFWSA-N -1 3 335.812 4.427 20 0 EIADHM O=C(OCc1ncc(Cl)s1)c1cc2cc(Cl)sc2[n-]1 ZINC000811394102 1049051035 /nfs/dbraw/zinc/05/10/35/1049051035.db2.gz LMOBIMIKZSEQHW-UHFFFAOYSA-N -1 3 333.221 4.350 20 0 EIADHM O=C([N-]c1cc(Cl)cc(Cl)c1F)c1scnc1Cl ZINC001132796462 1049059962 /nfs/dbraw/zinc/05/99/62/1049059962.db2.gz QPXFPDMGUSQWJD-UHFFFAOYSA-N -1 3 325.579 4.495 20 0 EIADHM COc1cccc(CSCc2cc(=O)oc3c(C)c([O-])ccc23)c1 ZINC000064376190 1049078850 /nfs/dbraw/zinc/07/88/50/1049078850.db2.gz RVATVEZRXYKTRE-UHFFFAOYSA-N -1 3 342.416 4.249 20 0 EIADHM COc1ccc(C(=O)NCC2(c3cccs3)CCCCC2)c([O-])c1 ZINC001147469909 1049154684 /nfs/dbraw/zinc/15/46/84/1049154684.db2.gz HWXLKIWDAJCIPT-UHFFFAOYSA-N -1 3 345.464 4.094 20 0 EIADHM CC[C@@H](Cc1ccccc1)N(C)C(=O)c1cc(SC)ccc1[O-] ZINC001148232923 1049282465 /nfs/dbraw/zinc/28/24/65/1049282465.db2.gz JVHUMOIAMSKFHQ-HNNXBMFYSA-N -1 3 329.465 4.207 20 0 EIADHM CC(=O)c1cc(C(=O)N[C@H](c2ccccc2)C2CCCC2)ccc1[O-] ZINC001148668687 1049359255 /nfs/dbraw/zinc/35/92/55/1049359255.db2.gz HWQCKFQJPSXOHQ-HXUWFJFHSA-N -1 3 337.419 4.256 20 0 EIADHM Cc1cccc([O-])c1C(=O)Nc1cccc(-c2n[nH]c3c2CCCC3)c1 ZINC001136255244 1049360057 /nfs/dbraw/zinc/36/00/57/1049360057.db2.gz OHXDRPIMPHNSME-UHFFFAOYSA-N -1 3 347.418 4.222 20 0 EIADHM Cc1c(F)c(C)c(F)c(C(=O)[N-]c2cc(-c3ccccn3)no2)c1F ZINC001148752603 1049373306 /nfs/dbraw/zinc/37/33/06/1049373306.db2.gz XUUDJYILXUXTQG-UHFFFAOYSA-N -1 3 347.296 4.023 20 0 EIADHM CCc1cccc(C(=O)Nc2cc(F)c(N3CCCC3)c(F)c2)c1[O-] ZINC001136323524 1049476267 /nfs/dbraw/zinc/47/62/67/1049476267.db2.gz DWBNIYICIUTYRP-UHFFFAOYSA-N -1 3 346.377 4.085 20 0 EIADHM COc1cc(SC)ccc1[N-]S(=O)(=O)/C=C\c1ccc(C)cc1 ZINC000773273918 1049683393 /nfs/dbraw/zinc/68/33/93/1049683393.db2.gz IUWBDKSLXDBMIJ-KHPPLWFESA-N -1 3 349.477 4.138 20 0 EIADHM CC(C)[C@@H](CC1CCCCC1)C(=O)Nc1ccc(-c2nnn[n-]2)cc1 ZINC001136496893 1049694358 /nfs/dbraw/zinc/69/43/58/1049694358.db2.gz SGARXYJHBZIQFH-QGZVFWFLSA-N -1 3 341.459 4.048 20 0 EIADHM CC(C)[C@@H](CC1CCCCC1)C(=O)Nc1ccc(-c2nn[n-]n2)cc1 ZINC001136496893 1049694367 /nfs/dbraw/zinc/69/43/67/1049694367.db2.gz SGARXYJHBZIQFH-QGZVFWFLSA-N -1 3 341.459 4.048 20 0 EIADHM CC[C@@H](NCc1cc(=O)oc2cc([O-])ccc12)c1cc(F)ccc1F ZINC000179787580 1049760328 /nfs/dbraw/zinc/76/03/28/1049760328.db2.gz BDLVRUPNKCLCHA-QGZVFWFLSA-N -1 3 345.345 4.018 20 0 EIADHM CSc1ccc([O-])c(C(=O)NCC(C)(C)c2ccccc2Cl)c1 ZINC001136587828 1049769032 /nfs/dbraw/zinc/76/90/32/1049769032.db2.gz GQGYZYMMSSGSPJ-UHFFFAOYSA-N -1 3 349.883 4.475 20 0 EIADHM CCc1ccc(C(=O)Nc2cnn(-c3ccccc3Cl)c2)c([O-])c1 ZINC001136712936 1049843518 /nfs/dbraw/zinc/84/35/18/1049843518.db2.gz PLQWAQZXRLMXQM-UHFFFAOYSA-N -1 3 341.798 4.046 20 0 EIADHM CCn1cc(N(CC(C)C)C(=O)c2cc3sccc3c([O-])c2)cn1 ZINC000823430958 1049846652 /nfs/dbraw/zinc/84/66/52/1049846652.db2.gz SGWFWYHXCXGLOM-UHFFFAOYSA-N -1 3 343.452 4.126 20 0 EIADHM CC(C)CCc1nnc([N-]C(=O)c2sccc2OC(F)F)s1 ZINC000617096209 1049949550 /nfs/dbraw/zinc/94/95/50/1049949550.db2.gz LADYABVNOPOGPK-UHFFFAOYSA-N -1 3 347.412 4.042 20 0 EIADHM Cc1cc2ccccc2[nH]c1=N[N-]C(=O)c1nc(Cl)ccc1Cl ZINC000181292587 1050088805 /nfs/dbraw/zinc/08/88/05/1050088805.db2.gz LHJKCGCWUJQQGT-UHFFFAOYSA-N -1 3 347.205 4.002 20 0 EIADHM Cc1[nH]c2ccccc2c1C(=O)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000089506038 1050120345 /nfs/dbraw/zinc/12/03/45/1050120345.db2.gz MMUFMURNIQWMAF-UHFFFAOYSA-N -1 3 334.297 4.453 20 0 EIADHM CCc1ccc2ccccc2c1CNC(=O)c1ccc(C(C)=O)c([O-])c1 ZINC001177338942 1050193944 /nfs/dbraw/zinc/19/39/44/1050193944.db2.gz REEKQUQREWATOA-UHFFFAOYSA-N -1 3 347.414 4.240 20 0 EIADHM CC[C@H](CNC(=O)c1cc([O-])c2ccccc2c1)CC(F)(F)F ZINC000412659478 1050311446 /nfs/dbraw/zinc/31/14/46/1050311446.db2.gz SLLYDVLRRZMNIU-NSHDSACASA-N -1 3 325.330 4.254 20 0 EIADHM CC(=O)c1cc(F)cc(CN[C@@H](C)c2c(F)cccc2Cl)c1[O-] ZINC000181762646 1050328426 /nfs/dbraw/zinc/32/84/26/1050328426.db2.gz FRSKNFDWQLMDTP-VIFPVBQESA-N -1 3 339.769 4.377 20 0 EIADHM Cc1ccc(-c2ccccc2)c(-c2noc(-c3cncc([O-])c3)n2)c1 ZINC001212708480 1050330821 /nfs/dbraw/zinc/33/08/21/1050330821.db2.gz JXVPROSBVXVNAF-UHFFFAOYSA-N -1 3 329.359 4.480 20 0 EIADHM O=C(Nc1nc2ccccc2n1CC1CC1)c1cc([O-])ccc1Cl ZINC001178255956 1050413105 /nfs/dbraw/zinc/41/31/05/1050413105.db2.gz QWZWGEOTIIRRIJ-UHFFFAOYSA-N -1 3 341.798 4.058 20 0 EIADHM CCCCC[C@@H]([N-]S(=O)(=O)c1cccnc1Cl)C(C)(C)C ZINC001186922840 1050447876 /nfs/dbraw/zinc/44/78/76/1050447876.db2.gz XHZHWWOUXZMZCL-CYBMUJFWSA-N -1 3 332.897 4.008 20 0 EIADHM Cc1cc(F)c(S(=O)(=O)[N-][C@H](CCC(C)C)C(C)(C)C)cc1F ZINC001187005725 1050456858 /nfs/dbraw/zinc/45/68/58/1050456858.db2.gz OTKOFMZAOQSOPB-MRXNPFEDSA-N -1 3 347.471 4.402 20 0 EIADHM COc1ccc([O-])c(C(=O)Nc2cccc(-c3ccc(C)cc3)n2)c1 ZINC001178662518 1050525357 /nfs/dbraw/zinc/52/53/57/1050525357.db2.gz OEDNBXIOYCUSOY-UHFFFAOYSA-N -1 3 334.375 4.024 20 0 EIADHM CC(=O)c1cccc(NC(=O)Nc2cccc(Br)c2)c1[O-] ZINC001187464217 1050545919 /nfs/dbraw/zinc/54/59/19/1050545919.db2.gz QCTJZJLWRPNECK-UHFFFAOYSA-N -1 3 349.184 4.001 20 0 EIADHM Cc1ccc([O-])c(NC(=O)Nc2cc(C(F)(F)F)ccc2Cl)n1 ZINC001187494074 1050556954 /nfs/dbraw/zinc/55/69/54/1050556954.db2.gz WVCDXZMHACKYMM-UHFFFAOYSA-N -1 3 345.708 4.412 20 0 EIADHM Cc1ccccc1S(=O)(=O)[N-]c1ccc(N2CCCCCC2)cc1 ZINC000242878651 1050565629 /nfs/dbraw/zinc/56/56/29/1050565629.db2.gz GKLGSLBPZHDXBL-UHFFFAOYSA-N -1 3 344.480 4.176 20 0 EIADHM Cc1ccc(CSc2nnc([N-]c3ccccc3F)s2)cn1 ZINC001188115354 1050703196 /nfs/dbraw/zinc/70/31/96/1050703196.db2.gz WUBHBZRGTUOZPR-UHFFFAOYSA-N -1 3 332.429 4.417 20 0 EIADHM O=C(NC1CCCCC1)c1ccc(Nc2cc([O-])c(F)cc2F)cc1 ZINC001174081194 1050755538 /nfs/dbraw/zinc/75/55/38/1050755538.db2.gz GQDJAUAXSBFHTR-UHFFFAOYSA-N -1 3 346.377 4.477 20 0 EIADHM COc1ccc(NC(=O)Nc2ccc(C)c([O-])c2Cl)c(OC)c1 ZINC001188550649 1050801231 /nfs/dbraw/zinc/80/12/31/1050801231.db2.gz ZKLZCYDGBAUYGP-UHFFFAOYSA-N -1 3 336.775 4.015 20 0 EIADHM Cc1cccc([O-])c1C(=O)Nc1cnc(Oc2ccccc2)cc1C ZINC001188640106 1050820198 /nfs/dbraw/zinc/82/01/98/1050820198.db2.gz GAWALORPNBTEEQ-UHFFFAOYSA-N -1 3 334.375 4.449 20 0 EIADHM Cc1ccc(NC(=O)c2cc(C)ccc2[O-])c(OCC(F)(F)F)c1 ZINC000619609586 1050832513 /nfs/dbraw/zinc/83/25/13/1050832513.db2.gz JHKPBWCFKPXWAA-UHFFFAOYSA-N -1 3 339.313 4.202 20 0 EIADHM CC[C@H]1CN(C)c2ccccc2CN1Cc1cccc([O-])c1Cl ZINC001179975353 1050837706 /nfs/dbraw/zinc/83/77/06/1050837706.db2.gz WJOZQZULIKQLHL-INIZCTEOSA-N -1 3 330.859 4.276 20 0 EIADHM COc1ccc(F)c(Nc2cc(Br)cc(F)c2[O-])c1 ZINC001174211303 1050844807 /nfs/dbraw/zinc/84/48/07/1050844807.db2.gz VYAFZNHTJMBDPB-UHFFFAOYSA-N -1 3 330.128 4.185 20 0 EIADHM Cc1cccc([N-]S(=O)(=O)c2ccc(F)c3ccccc32)c1F ZINC001189389660 1050977209 /nfs/dbraw/zinc/97/72/09/1050977209.db2.gz NXJPOIDHVLBTQX-UHFFFAOYSA-N -1 3 333.359 4.227 20 0 EIADHM CC(C)(O)c1cccc(Nc2cc(Br)cc(F)c2[O-])c1 ZINC001174409396 1050986087 /nfs/dbraw/zinc/98/60/87/1050986087.db2.gz MHCRCWVVWUELAJ-UHFFFAOYSA-N -1 3 340.192 4.265 20 0 EIADHM Cc1cc(F)c([N-]S(=O)(=O)Cc2cc(F)ccc2F)cc1Cl ZINC001189691948 1051038627 /nfs/dbraw/zinc/03/86/27/1051038627.db2.gz ZLVPCZHXTRQMIV-UHFFFAOYSA-N -1 3 349.761 4.008 20 0 EIADHM Cc1cccc([O-])c1C(=O)Nc1ncc(-c2cccc(F)c2)s1 ZINC001180660085 1051059482 /nfs/dbraw/zinc/05/94/82/1051059482.db2.gz YMGPMGHEAYDMMM-UHFFFAOYSA-N -1 3 328.368 4.216 20 0 EIADHM CCc1cccc(CC)c1NC(=O)Nc1c([O-])cccc1C(C)=O ZINC001189772560 1051059454 /nfs/dbraw/zinc/05/94/54/1051059454.db2.gz MBTOVVQPOJVQOP-UHFFFAOYSA-N -1 3 326.396 4.364 20 0 EIADHM O=C(CCc1ccc(Oc2ccccc2)cc1)Nc1cncc([O-])c1 ZINC001180930549 1051112904 /nfs/dbraw/zinc/11/29/04/1051112904.db2.gz XUSZIHGTMBKWRZ-UHFFFAOYSA-N -1 3 334.375 4.151 20 0 EIADHM COc1cc([O-])c(C(=O)N(C(C)C)[C@@H](C)c2ccccc2)c(OC)c1 ZINC001190136517 1051120928 /nfs/dbraw/zinc/12/09/28/1051120928.db2.gz AXZISRFIXJONAT-AWEZNQCLSA-N -1 3 343.423 4.021 20 0 EIADHM Cn1ccnc1Nc1ccc(-c2cc(C(=O)[O-])c3ccccc3n2)cc1 ZINC001174852693 1051213316 /nfs/dbraw/zinc/21/33/16/1051213316.db2.gz JNNCGFMSWIDTJS-UHFFFAOYSA-N -1 3 344.374 4.077 20 0 EIADHM O=C([N-]c1cc(Cl)cc2ncoc21)c1csc(C(F)(F)F)n1 ZINC001191017327 1051327358 /nfs/dbraw/zinc/32/73/58/1051327358.db2.gz WYHLUZWDAATGMW-UHFFFAOYSA-N -1 3 347.705 4.209 20 0 EIADHM COc1cccc(Br)c1Nc1c(F)cc([O-])cc1F ZINC001175099784 1051346085 /nfs/dbraw/zinc/34/60/85/1051346085.db2.gz SOHWKGYULQRXBN-UHFFFAOYSA-N -1 3 330.128 4.185 20 0 EIADHM Nc1cc(Cl)c(Br)cc1Nc1c(F)cc([O-])cc1F ZINC001175101964 1051349551 /nfs/dbraw/zinc/34/95/51/1051349551.db2.gz BJCKLHAPTMTJEK-UHFFFAOYSA-N -1 3 349.562 4.412 20 0 EIADHM [O-]c1cc(F)c(Nc2cc(F)c(OCC3CC3)c(F)c2)c(F)c1 ZINC001175102912 1051350294 /nfs/dbraw/zinc/35/02/94/1051350294.db2.gz OWMLJHSCQCZTLB-UHFFFAOYSA-N -1 3 327.277 4.481 20 0 EIADHM COc1cccc(-c2cc([N-]c3c(F)ccc(OC)c3F)on2)c1 ZINC001175115973 1051357876 /nfs/dbraw/zinc/35/78/76/1051357876.db2.gz BDPSRVACTSULLQ-UHFFFAOYSA-N -1 3 332.306 4.381 20 0 EIADHM CC(=O)c1cccc([O-])c1NC(=O)c1cccc(Oc2ccccc2)n1 ZINC001191143157 1051378659 /nfs/dbraw/zinc/37/86/59/1051378659.db2.gz ZVEUTWOIRSHGNE-UHFFFAOYSA-N -1 3 348.358 4.034 20 0 EIADHM COc1cc(Br)cc(C)c1Nc1c(F)cc([O-])cc1F ZINC001175096867 1051380060 /nfs/dbraw/zinc/38/00/60/1051380060.db2.gz KTKBOLGVDMDHMK-UHFFFAOYSA-N -1 3 344.155 4.494 20 0 EIADHM Cc1ccc(Cl)c(S(=O)(=O)[N-][C@@H](C)C2CCCC2)c1Cl ZINC001191247845 1051411058 /nfs/dbraw/zinc/41/10/58/1051411058.db2.gz VOVXBXYGLMNETD-JTQLQIEISA-N -1 3 336.284 4.159 20 0 EIADHM [O-]c1ccc(F)c(Nc2c(Cl)nccc2Br)c1F ZINC001175265589 1051502956 /nfs/dbraw/zinc/50/29/56/1051502956.db2.gz HLZRYXNZNJMWHU-UHFFFAOYSA-N -1 3 335.535 4.225 20 0 EIADHM Fc1cc(Nc2ccc(-c3nn[n-]n3)cc2)ccc1OC1CCCC1 ZINC001175431311 1051589006 /nfs/dbraw/zinc/58/90/06/1051589006.db2.gz CELZSKPASBUIDQ-UHFFFAOYSA-N -1 3 339.374 4.071 20 0 EIADHM CC(C)(C)c1ccc(C(=O)N2CCCC3(CC(F)C3)CC2)c([O-])c1 ZINC001192322919 1051692000 /nfs/dbraw/zinc/69/20/00/1051692000.db2.gz SFIKGRXMASBOOC-UHFFFAOYSA-N -1 3 333.447 4.434 20 0 EIADHM CC(C)(C)c1ccc(C(=O)N[C@@H](c2cncc(F)c2)C2CC2)c([O-])c1 ZINC001192339955 1051695104 /nfs/dbraw/zinc/69/51/04/1051695104.db2.gz MUTHHTDLUULVBO-GOSISDBHSA-N -1 3 342.414 4.105 20 0 EIADHM O=C([N-][C@@H](c1ccccc1F)C1CC1)C(F)(F)c1ccc(F)cc1 ZINC001182891101 1051736133 /nfs/dbraw/zinc/73/61/33/1051736133.db2.gz YUABRGWUAQLTFJ-MRXNPFEDSA-N -1 3 337.316 4.324 20 0 EIADHM [O-]c1ccc(CN2CCC3(C=Cc4ccccc4O3)CC2)c(F)c1F ZINC001183096002 1051788726 /nfs/dbraw/zinc/78/87/26/1051788726.db2.gz YFBXLNCEXQKXDV-UHFFFAOYSA-N -1 3 343.373 4.111 20 0 EIADHM O=c1cc(Nc2ccc(-c3ccccc3)nc2)[n-]n1-c1ccccc1 ZINC001175833633 1051796338 /nfs/dbraw/zinc/79/63/38/1051796338.db2.gz XJQKVMMMTWNUFP-UHFFFAOYSA-N -1 3 328.375 4.384 20 0 EIADHM [O-]c1c(F)cc(Nc2cccnc2OCc2ccccc2)cc1F ZINC001175877006 1051809734 /nfs/dbraw/zinc/80/97/34/1051809734.db2.gz SQTJAWAZCNVGPI-UHFFFAOYSA-N -1 3 328.318 4.388 20 0 EIADHM CCN(Cc1nc2c3ccccc3oc2c(=O)[n-]1)c1ccc(C)cc1C ZINC000071966047 1051881829 /nfs/dbraw/zinc/88/18/29/1051881829.db2.gz CFTRFYDUJGQKHO-UHFFFAOYSA-N -1 3 347.418 4.313 20 0 EIADHM [O-]c1cc(Br)cnc1Nc1ccc(-c2ccccn2)cc1 ZINC001176036943 1051881806 /nfs/dbraw/zinc/88/18/06/1051881806.db2.gz JBQDNNFYFZMHFE-UHFFFAOYSA-N -1 3 342.196 4.355 20 0 EIADHM O=c1cc(Nc2ccc(-c3ccccn3)cc2)[n-]n1-c1ccccc1 ZINC001176039852 1051883722 /nfs/dbraw/zinc/88/37/22/1051883722.db2.gz SFXFIBYMSYNBIS-UHFFFAOYSA-N -1 3 328.375 4.384 20 0 EIADHM Cc1ccc(C(=O)NC(C)(C)c2ccc(C(F)(F)F)cc2)c([O-])c1 ZINC001176055490 1051896670 /nfs/dbraw/zinc/89/66/70/1051896670.db2.gz OYDGKLLOMGAREN-UHFFFAOYSA-N -1 3 337.341 4.385 20 0 EIADHM CCCCOc1ccc(C(=O)NCc2cccc(CC)c2)c([O-])c1 ZINC001183906156 1051922424 /nfs/dbraw/zinc/92/24/24/1051922424.db2.gz SECFGISBTCWRMG-UHFFFAOYSA-N -1 3 327.424 4.064 20 0 EIADHM O=S(=O)(CC1CCC1)[N-]c1c(F)cccc1OC1CCCCC1 ZINC001193523551 1051944324 /nfs/dbraw/zinc/94/43/24/1051944324.db2.gz HAAHRASZTXTBMS-UHFFFAOYSA-N -1 3 341.448 4.079 20 0 EIADHM O=C(c1ccc([O-])cc1C(F)(F)F)N1CCCC2(CC(F)C2)CC1 ZINC001193744893 1051979707 /nfs/dbraw/zinc/97/97/07/1051979707.db2.gz APWQGRCPTNIQFS-UHFFFAOYSA-N -1 3 345.336 4.155 20 0 EIADHM CCCCOc1ccc(C(=O)N[C@@H]2CCc3cc(F)ccc32)c([O-])c1 ZINC001184402696 1052003612 /nfs/dbraw/zinc/00/36/12/1052003612.db2.gz GOWZZQIDYCHLAO-GOSISDBHSA-N -1 3 343.398 4.128 20 0 EIADHM O=C([O-])C[C@H](NCc1cnc(-c2ccccc2)s1)c1cccs1 ZINC000671162084 1052059635 /nfs/dbraw/zinc/05/96/35/1052059635.db2.gz KNHRRVQOFJZHQL-AWEZNQCLSA-N -1 3 344.461 4.177 20 0 EIADHM O=C([O-])C[C@@H](NCc1cccc(OC2CCCC2)c1)c1cccs1 ZINC000671162229 1052074868 /nfs/dbraw/zinc/07/48/68/1052074868.db2.gz PAEUEYIFMTWBTL-QGZVFWFLSA-N -1 3 345.464 4.375 20 0 EIADHM CC(C)[C@@H]1N(C(=O)c2cc([O-])cc(C(F)(F)F)c2)CC12CCC2 ZINC000622062324 1052102089 /nfs/dbraw/zinc/10/20/89/1052102089.db2.gz DEVYZMNJEVJHAP-AWEZNQCLSA-N -1 3 327.346 4.062 20 0 EIADHM COc1c(Cl)c(Cl)sc1C(=O)Nc1ccc(F)c([O-])c1 ZINC001194557355 1052169001 /nfs/dbraw/zinc/16/90/01/1052169001.db2.gz WKOZEHAVUXOSEY-UHFFFAOYSA-N -1 3 336.171 4.161 20 0 EIADHM Cc1cccc(C)c1S(=O)(=O)[N-]c1ccc2nccc(Cl)c2c1 ZINC001194642750 1052184289 /nfs/dbraw/zinc/18/42/89/1052184289.db2.gz NNZGACMGPKXVPS-UHFFFAOYSA-N -1 3 346.839 4.306 20 0 EIADHM CCc1cccc(C(=O)Nc2ccccc2OCC(F)(F)F)c1[O-] ZINC000622289295 1052184923 /nfs/dbraw/zinc/18/49/23/1052184923.db2.gz LQJYRSVFZJKHDD-UHFFFAOYSA-N -1 3 339.313 4.148 20 0 EIADHM O=C(c1cc([O-])ccc1Cl)N1CCC(Cc2ccc(F)cc2)CC1 ZINC000622343042 1052210751 /nfs/dbraw/zinc/21/07/51/1052210751.db2.gz NRYVVKQPKNUWCG-UHFFFAOYSA-N -1 3 347.817 4.280 20 0 EIADHM CCc1cccc(C(=O)N(CC(C)C)c2ccc(OC)cc2)c1[O-] ZINC000622334933 1052213897 /nfs/dbraw/zinc/21/38/97/1052213897.db2.gz IGMIUNOPHGLVJX-UHFFFAOYSA-N -1 3 327.424 4.266 20 0 EIADHM CC(C)[C@@H]1CCCN(C(=O)c2cc([O-])cc(C(F)(F)F)c2)CC1 ZINC000622374637 1052228886 /nfs/dbraw/zinc/22/88/86/1052228886.db2.gz WIZZLBAHJHRDJY-GFCCVEGCSA-N -1 3 329.362 4.309 20 0 EIADHM CCC[C@]1(C)CCCN(C(=O)c2cc([O-])cc(C(F)(F)F)c2)C1 ZINC000622403130 1052246485 /nfs/dbraw/zinc/24/64/85/1052246485.db2.gz NPZBJHQQJNXVFY-MRXNPFEDSA-N -1 3 329.362 4.453 20 0 EIADHM CCc1ccc([O-])c(C(=O)N(C)[C@@H](CC)Cc2ccc(C)cc2)c1 ZINC000622395999 1052251800 /nfs/dbraw/zinc/25/18/00/1052251800.db2.gz AKFALOLHCBELSQ-SFHVURJKSA-N -1 3 325.452 4.356 20 0 EIADHM Cc1cc(S(=O)(=O)[N-]c2cc(Cl)ccc2F)ccc1Cl ZINC001185521374 1052255478 /nfs/dbraw/zinc/25/54/78/1052255478.db2.gz SGJUIOWETVQHPF-UHFFFAOYSA-N -1 3 334.199 4.242 20 0 EIADHM O=C(Nc1ccc([O-])c(F)c1)Nc1cc(C(F)(F)F)ccc1F ZINC001185617844 1052272879 /nfs/dbraw/zinc/27/28/79/1052272879.db2.gz TUSIUOZFHKZJQI-UHFFFAOYSA-N -1 3 332.228 4.333 20 0 EIADHM O=C(c1cc(Cc2ccccc2)ccc1[O-])N1CC2(C1)CCCCC2 ZINC000622496235 1052303299 /nfs/dbraw/zinc/30/32/99/1052303299.db2.gz VPULRRRAPJTMTB-UHFFFAOYSA-N -1 3 335.447 4.389 20 0 EIADHM CCCCOc1ccc(NC(=O)CCCc2ccc([O-])c(F)c2)cn1 ZINC000622522290 1052314558 /nfs/dbraw/zinc/31/45/58/1052314558.db2.gz SNWQIUDQMFKRNV-UHFFFAOYSA-N -1 3 346.402 4.067 20 0 EIADHM CC1(C)CCc2ccccc2[C@H](NC(=O)Cc2ccc([O-])c(F)c2)C1 ZINC000622582714 1052335957 /nfs/dbraw/zinc/33/59/57/1052335957.db2.gz ZWTPDRLRXJJQBL-GOSISDBHSA-N -1 3 341.426 4.294 20 0 EIADHM CCc1ccc(C(=O)N2CC(c3cccc(C(F)(F)F)c3)C2)c([O-])c1 ZINC000622661827 1052365567 /nfs/dbraw/zinc/36/55/67/1052365567.db2.gz STOWQGVEZVZFQD-UHFFFAOYSA-N -1 3 349.352 4.213 20 0 EIADHM CC(C)Oc1ncc(Cl)cc1NC(=O)c1cc([O-])ccc1Cl ZINC000622649236 1052370306 /nfs/dbraw/zinc/37/03/06/1052370306.db2.gz IWBFZNZBJUKEGK-UHFFFAOYSA-N -1 3 341.194 4.134 20 0 EIADHM CCCc1cc(C(=O)[N-]c2c(C)c3ccccc3nc2SC)no1 ZINC000622968333 1052558283 /nfs/dbraw/zinc/55/82/83/1052558283.db2.gz KXPFJLCIQGOAOK-UHFFFAOYSA-N -1 3 341.436 4.458 20 0 EIADHM CCCCOC(=O)c1ccc(NC(=O)c2cc([O-])ccc2Cl)cc1 ZINC000763898971 1052633322 /nfs/dbraw/zinc/63/33/22/1052633322.db2.gz MZYWBLSMHHAQEB-UHFFFAOYSA-N -1 3 347.798 4.255 20 0 EIADHM COc1cc(Cl)c(Cl)cc1C(=O)Nc1cccc([O-])c1F ZINC000179148249 1052725188 /nfs/dbraw/zinc/72/51/88/1052725188.db2.gz ZLWVGCMNYDQQIU-UHFFFAOYSA-N -1 3 330.142 4.099 20 0 EIADHM O=C(Nc1cccc([O-])c1F)c1c[nH]c2cccc(Br)c21 ZINC000180517842 1052807234 /nfs/dbraw/zinc/80/72/34/1052807234.db2.gz KADHFZOQKAKVOC-UHFFFAOYSA-N -1 3 349.159 4.027 20 0 EIADHM Cc1nn(-c2ccc(Cl)cc2)c(Cl)c1C=Cc1nccc(=O)[n-]1 ZINC000764433887 1053100677 /nfs/dbraw/zinc/10/06/77/1053100677.db2.gz GWEDZMIYLKHLBV-SREVYHEPSA-N -1 3 347.205 4.154 20 0 EIADHM COc1cc(C)c(S(=O)(=O)[N-]c2c(C)cccc2C)c(C)c1C ZINC001194835649 1053124326 /nfs/dbraw/zinc/12/43/26/1053124326.db2.gz MLAAHLGDENARBQ-UHFFFAOYSA-N -1 3 333.453 4.038 20 0 EIADHM COc1cc(C)c(S(=O)(=O)[N-]c2cc(C)ccc2C)c(C)c1C ZINC001194836039 1053126552 /nfs/dbraw/zinc/12/65/52/1053126552.db2.gz RVTYXLKTGGEGLM-UHFFFAOYSA-N -1 3 333.453 4.038 20 0 EIADHM COc1ccccc1OC(=O)Nc1c([O-])cccc1C(F)(F)F ZINC001195266820 1053352272 /nfs/dbraw/zinc/35/22/72/1053352272.db2.gz RFDYGZIUUSULNI-UHFFFAOYSA-N -1 3 327.258 4.031 20 0 EIADHM O=C([N-]Cc1ccc(C(F)F)cc1)C(F)(F)c1ccccc1F ZINC000764994419 1053407869 /nfs/dbraw/zinc/40/78/69/1053407869.db2.gz KVOWQZAGBCBTGD-UHFFFAOYSA-N -1 3 329.268 4.172 20 0 EIADHM [O-]c1cccc(Cl)c1NC(=S)NCc1cccc(Cl)c1 ZINC001195979720 1053539027 /nfs/dbraw/zinc/53/90/27/1053539027.db2.gz MGVTVXBMVRTGAN-UHFFFAOYSA-N -1 3 327.236 4.186 20 0 EIADHM Cc1cccc([O-])c1C(=O)N1CCC[C@H](c2cc3ccccc3[nH]2)C1 ZINC000624274186 1053844272 /nfs/dbraw/zinc/84/42/72/1053844272.db2.gz UUJNQAVGLWLOTN-INIZCTEOSA-N -1 3 334.419 4.202 20 0 EIADHM COc1cc(C(=O)/C=C\c2ccc(Br)s2)ccc1[O-] ZINC000213714748 1053864379 /nfs/dbraw/zinc/86/43/79/1053864379.db2.gz ZQJLRJMWQLVGKW-UTCJRWHESA-N -1 3 339.210 4.121 20 0 EIADHM CCCCc1nc(NC(=O)C=CC2CCCCC2)c(C(=O)OCC)[n-]1 ZINC001127967334 1053903600 /nfs/dbraw/zinc/90/36/00/1053903600.db2.gz WNTVNGVDGFWWOL-SEYXRHQNSA-N -1 3 347.459 4.004 20 0 EIADHM CCC(C)(C)c1ccc(CN2Cc3nc(C4CC4)[n-]c(=O)c3C2)cc1 ZINC001197466853 1053915492 /nfs/dbraw/zinc/91/54/92/1053915492.db2.gz BAYBWXGZNNPRAY-UHFFFAOYSA-N -1 3 337.467 4.263 20 0 EIADHM O=S(=O)(Cc1c(F)cccc1F)[N-]c1cc2cccccc-2c1 ZINC001197566432 1053939396 /nfs/dbraw/zinc/93/93/96/1053939396.db2.gz HZOIFGLRUKXQDF-UHFFFAOYSA-N -1 3 333.359 4.012 20 0 EIADHM CN(C(=O)c1nnc2ccccc2c1[O-])C1CC(C)(C)CC(C)(C)C1 ZINC000855569077 1053948784 /nfs/dbraw/zinc/94/87/84/1053948784.db2.gz QKBCRNGNGWZQQQ-UHFFFAOYSA-N -1 3 341.455 4.012 20 0 EIADHM CC(C)(CNC(=O)c1cc([O-])c2ccccc2c1)CC(F)(F)F ZINC000856518312 1054081315 /nfs/dbraw/zinc/08/13/15/1054081315.db2.gz LVMGLUMPOBEYJS-UHFFFAOYSA-N -1 3 325.330 4.254 20 0 EIADHM O=C(Nc1cccc(OC2CCCC2)c1)c1c[n-]c2ccccc2c1=O ZINC000033014188 1054116924 /nfs/dbraw/zinc/11/69/24/1054116924.db2.gz PWYJKPSOKCEBNL-UHFFFAOYSA-N -1 3 348.402 4.102 20 0 EIADHM Cc1ccccc1NC(=S)Nc1c([O-])cccc1Br ZINC001198427537 1054141908 /nfs/dbraw/zinc/14/19/08/1054141908.db2.gz FYCZDPOCGPWWPR-UHFFFAOYSA-N -1 3 337.242 4.272 20 0 EIADHM CC[C@H](/N=C/c1cc(Br)ccc1[O-])c1nccs1 ZINC000078022748 1054166585 /nfs/dbraw/zinc/16/65/85/1054166585.db2.gz XMIHMSWMRKGAHV-AXLKIAQESA-N -1 3 325.231 4.181 20 0 EIADHM O=C([O-])CC[C@@H]1CCCN(Cc2ccc(Oc3ccccc3)o2)C1 ZINC000871621752 1054233402 /nfs/dbraw/zinc/23/34/02/1054233402.db2.gz NPMBSYIBUQINKO-HNNXBMFYSA-N -1 3 329.396 4.149 20 0 EIADHM Cc1ccc([C@@H](C)NC(=O)c2cc([O-])cc(C(F)(F)F)c2)s1 ZINC000857440757 1054240952 /nfs/dbraw/zinc/24/09/52/1054240952.db2.gz CBWDKBPCZDLCGZ-SECBINFHSA-N -1 3 329.343 4.272 20 0 EIADHM C[C@H](CNC(=O)c1cc([O-])c2ccccc2c1)Sc1ccccc1 ZINC000472203486 1054247887 /nfs/dbraw/zinc/24/78/87/1054247887.db2.gz BZVYITUJIHIADF-CQSZACIVSA-N -1 3 337.444 4.456 20 0 EIADHM CC(C)([N-]C(=O)C(F)(F)c1ccccc1F)c1cccc(F)c1 ZINC000857453869 1054252354 /nfs/dbraw/zinc/25/23/54/1054252354.db2.gz OXEXVWYWZDGBBC-UHFFFAOYSA-N -1 3 325.305 4.108 20 0 EIADHM O=S(=O)([N-]c1cc(F)c(Cl)cc1F)c1ccc2occc2c1 ZINC001198869548 1054297327 /nfs/dbraw/zinc/29/73/27/1054297327.db2.gz FRXHTKBPXHFVSP-UHFFFAOYSA-N -1 3 343.738 4.165 20 0 EIADHM O=C(c1cc(=O)c2ccccc2[n-]1)N1CCCCC[C@@H]1c1ccco1 ZINC000265666325 1054304727 /nfs/dbraw/zinc/30/47/27/1054304727.db2.gz YMOWHFGOPIPTSM-QGZVFWFLSA-N -1 3 336.391 4.291 20 0 EIADHM C[C@@H](NCc1ccnc(OC2CCCC2)c1)c1cccc([O-])c1F ZINC000872021951 1054339259 /nfs/dbraw/zinc/33/92/59/1054339259.db2.gz GONHAOBNWSKYMA-CYBMUJFWSA-N -1 3 330.403 4.099 20 0 EIADHM COc1cc(F)c([C@H](C)N[C@H](C)c2cccc([O-])c2F)cc1OC ZINC000872033355 1054349963 /nfs/dbraw/zinc/34/99/63/1054349963.db2.gz CNMMYDDXZFOSEQ-MNOVXSKESA-N -1 3 337.366 4.099 20 0 EIADHM COCCCOc1cc(C)ccc1CN[C@H](C)c1cccc([O-])c1F ZINC000872043234 1054356204 /nfs/dbraw/zinc/35/62/04/1054356204.db2.gz VXBSRQACEIWOON-OAHLLOKOSA-N -1 3 347.430 4.106 20 0 EIADHM O=C([N-]c1c2nsnc2ccc1Cl)c1cc(F)c(F)cc1F ZINC000776960901 1054358997 /nfs/dbraw/zinc/35/89/97/1054358997.db2.gz MHDSFNVFXNQGAA-UHFFFAOYSA-N -1 3 343.717 4.014 20 0 EIADHM C[C@H](N[C@@H]1CCc2cc(F)c(F)c(F)c21)c1cccc([O-])c1F ZINC000872076712 1054381446 /nfs/dbraw/zinc/38/14/46/1054381446.db2.gz QKXURFRVAQGPTA-QPUJVOFHSA-N -1 3 325.305 4.287 20 0 EIADHM O=C(Nc1ccc(F)c([O-])c1)c1cc(-c2cccc(Cl)c2)no1 ZINC001199316633 1054390744 /nfs/dbraw/zinc/39/07/44/1054390744.db2.gz AMZVHLOUIAHFLO-UHFFFAOYSA-N -1 3 332.718 4.092 20 0 EIADHM Cc1ccc(CN2CC=C(c3ccc(F)cc3)CC2)cc1C(=O)[O-] ZINC000872157347 1054411494 /nfs/dbraw/zinc/41/14/94/1054411494.db2.gz KXRCCEJGPZSUSB-UHFFFAOYSA-N -1 3 325.383 4.122 20 0 EIADHM O=C([O-])c1ccoc1CN1CCC(Cc2ccccc2Cl)CC1 ZINC000872163540 1054416917 /nfs/dbraw/zinc/41/69/17/1054416917.db2.gz IXCQACYBEVCOCM-UHFFFAOYSA-N -1 3 333.815 4.086 20 0 EIADHM [O-]c1cc(Cl)ccc1NC(=S)Nc1ccc(-n2cccn2)cc1 ZINC001200883199 1054564592 /nfs/dbraw/zinc/56/45/92/1054564592.db2.gz FVJWHBPFQRSWQD-UHFFFAOYSA-N -1 3 344.827 4.040 20 0 EIADHM O=C(CCCc1ccc(Cl)c(Cl)c1)Nc1ncccc1[O-] ZINC000059363158 1054649529 /nfs/dbraw/zinc/64/95/29/1054649529.db2.gz BAHAHQNGPZOQGN-UHFFFAOYSA-N -1 3 325.195 4.055 20 0 EIADHM C[C@@]1(C(F)(F)F)CCN(C(=O)c2cc3sccc3c([O-])c2)C1 ZINC000874477071 1054669554 /nfs/dbraw/zinc/66/95/54/1054669554.db2.gz LZCZQFUDQYVNMR-CQSZACIVSA-N -1 3 329.343 4.021 20 0 EIADHM O=C([N-]c1cc(-c2ccccc2F)no1)c1c(F)ccc(F)c1F ZINC000776138704 1054682709 /nfs/dbraw/zinc/68/27/09/1054682709.db2.gz MVITWJNMXWNLMN-UHFFFAOYSA-N -1 3 336.244 4.150 20 0 EIADHM CCn1ccnc1[C@@H]1CCCCN1C(=O)c1cc([O-])c2ccccc2c1 ZINC000281889953 1054708182 /nfs/dbraw/zinc/70/81/82/1054708182.db2.gz SVHYLITZIRKZIS-SFHVURJKSA-N -1 3 349.434 4.129 20 0 EIADHM CC(C)c1nsc([N-]C(=O)c2cc(Cl)c(F)cc2Cl)n1 ZINC000874693476 1054718200 /nfs/dbraw/zinc/71/82/00/1054718200.db2.gz DQCSVWGUQHDUPN-UHFFFAOYSA-N -1 3 334.203 4.360 20 0 EIADHM CC(C)c1nsc([N-]C(=O)c2cc(F)c(Cl)cc2Cl)n1 ZINC000874698099 1054719441 /nfs/dbraw/zinc/71/94/41/1054719441.db2.gz RQNJGABMMOSHFS-UHFFFAOYSA-N -1 3 334.203 4.360 20 0 EIADHM CC[C@H]1CN(C(=O)c2cc(Oc3ccccc3)ccc2[O-])CCS1 ZINC001137114960 1054983034 /nfs/dbraw/zinc/98/30/34/1054983034.db2.gz VLAGFNVGCCCTLG-INIZCTEOSA-N -1 3 343.448 4.152 20 0 EIADHM O=C(Nc1ccccc1Cl)Nc1c([O-])cccc1Br ZINC001202064232 1055003625 /nfs/dbraw/zinc/00/36/25/1055003625.db2.gz QWDQXPXZEFPLBS-UHFFFAOYSA-N -1 3 341.592 4.452 20 0 EIADHM CCOc1ccccc1NC(=O)Nc1nc2c(cccc2[O-])s1 ZINC001202136784 1055045587 /nfs/dbraw/zinc/04/55/87/1055045587.db2.gz YSDWXXPWXLWZIG-UHFFFAOYSA-N -1 3 329.381 4.045 20 0 EIADHM CC(C)OC1CCC(NC(=O)c2cc3sccc3c([O-])c2)CC1 ZINC000862527576 1055077895 /nfs/dbraw/zinc/07/78/95/1055077895.db2.gz BXOAVNDGSQDBBZ-UHFFFAOYSA-N -1 3 333.453 4.073 20 0 EIADHM COc1cccc(NC(=O)Nc2c([O-])cccc2C(F)(F)F)c1 ZINC001202277675 1055121687 /nfs/dbraw/zinc/12/16/87/1055121687.db2.gz FJFKAFZQDWOOJY-UHFFFAOYSA-N -1 3 326.274 4.064 20 0 EIADHM O=C(Nc1ccc(Br)cc1)Nc1c([O-])cccc1Cl ZINC001202333222 1055142956 /nfs/dbraw/zinc/14/29/56/1055142956.db2.gz QKCIQZKCQLTVNY-UHFFFAOYSA-N -1 3 341.592 4.452 20 0 EIADHM Cc1ccc([C@@H](C)N(C)Cc2nnc(-c3ccccc3[O-])o2)c(C)c1 ZINC000877987508 1055169800 /nfs/dbraw/zinc/16/98/00/1055169800.db2.gz JYMPFDQWKYAACZ-OAHLLOKOSA-N -1 3 337.423 4.252 20 0 EIADHM Cc1ccccc1[C@@H](NCc1nnc(-c2ccccc2[O-])o1)C(C)C ZINC000878362819 1055265484 /nfs/dbraw/zinc/26/54/84/1055265484.db2.gz IVKIKWFZVBVEIE-IBGZPJMESA-N -1 3 337.423 4.238 20 0 EIADHM C[C@H](NCc1nnc(-c2ccccc2[O-])o1)c1cccc(C2CC2)c1 ZINC000878660792 1055368573 /nfs/dbraw/zinc/36/85/73/1055368573.db2.gz ZBQGTFOPSYIFTR-ZDUSSCGKSA-N -1 3 335.407 4.170 20 0 EIADHM Cc1ccccc1[C@@H]1C[C@H](C)N(C(=O)c2cc(=O)c3ccccc3[n-]2)C1 ZINC000265717331 1055801033 /nfs/dbraw/zinc/80/10/33/1055801033.db2.gz XWBYYMDUEUUTHW-JKSUJKDBSA-N -1 3 346.430 4.267 20 0 EIADHM CC[C@H](C)c1ccc(S(=O)(=O)[N-]c2ccc(OC)c(OC)c2)cc1 ZINC000007056289 1056761088 /nfs/dbraw/zinc/76/10/88/1056761088.db2.gz ZAAVOWGIHAIGMD-ZDUSSCGKSA-N -1 3 349.452 4.018 20 0 EIADHM [O-]c1ccc(CNc2nc(C(F)(F)F)nc3ccccc32)cc1F ZINC000737430418 1058199228 /nfs/dbraw/zinc/19/92/28/1058199228.db2.gz SAFRCNBNQXSJDU-UHFFFAOYSA-N -1 3 337.276 4.105 20 0 EIADHM CCCc1ncc(C(=O)[N-]c2nc(-c3ccc(F)cc3)ns2)s1 ZINC000741927930 1058465388 /nfs/dbraw/zinc/46/53/88/1058465388.db2.gz HDHVPDCKRIAJMW-UHFFFAOYSA-N -1 3 348.428 4.006 20 0 EIADHM Cc1ccc(C(=O)N(Cc2ccc(F)cc2)CC(F)(F)F)c([O-])c1 ZINC000741997044 1058499023 /nfs/dbraw/zinc/49/90/23/1058499023.db2.gz ZCMHORCWNBXSHT-UHFFFAOYSA-N -1 3 341.304 4.044 20 0 EIADHM O=c1ccnc(C=Cc2cn(-c3ccccc3)nc2-c2ccccc2)[n-]1 ZINC000742221078 1058547256 /nfs/dbraw/zinc/54/72/56/1058547256.db2.gz XQPTUWHEGMIFQG-VAWYXSNFSA-N -1 3 340.386 4.205 20 0 EIADHM Cc1nn(-c2cccc(Cl)c2)c(Cl)c1C=Cc1nccc(=O)[n-]1 ZINC000742219793 1058548008 /nfs/dbraw/zinc/54/80/08/1058548008.db2.gz FIFXDAZNUNUYBQ-WAYWQWQTSA-N -1 3 347.205 4.154 20 0 EIADHM COc1cccc(-c2noc([N-]Cc3ccc([C@H]4C[C@@H]4C)o3)n2)c1 ZINC000742394830 1058593342 /nfs/dbraw/zinc/59/33/42/1058593342.db2.gz YGPLVASYWKKJRR-NHYWBVRUSA-N -1 3 325.368 4.074 20 0 EIADHM O=C(c1cc(Cc2ccccc2)ccc1[O-])N1CCC2(CCCC2)C1 ZINC000743765656 1059113145 /nfs/dbraw/zinc/11/31/45/1059113145.db2.gz LDAVLTIKOGLPNX-UHFFFAOYSA-N -1 3 335.447 4.389 20 0 EIADHM Cc1cc(=O)[n-]c(-c2cccc(OC(=O)C[C@H](C)c3ccccc3)c2)n1 ZINC000744219405 1059334118 /nfs/dbraw/zinc/33/41/18/1059334118.db2.gz RFERPRPQSAHIJV-AWEZNQCLSA-N -1 3 348.402 4.257 20 0 EIADHM C/C(=C/C(=O)Oc1cccc(-c2nc(C)cc(=O)[n-]2)c1)C(C)(C)C ZINC000744219235 1059335523 /nfs/dbraw/zinc/33/55/23/1059335523.db2.gz OXGYCCYLMUDYAK-XFXZXTDPSA-N -1 3 326.396 4.055 20 0 EIADHM Cc1cc(=O)[n-]c(-c2cccc(OC(=O)C[C@@H](C)CC(C)C)c2)n1 ZINC000744217733 1059336207 /nfs/dbraw/zinc/33/62/07/1059336207.db2.gz OLPLGVSQTLSNQU-ZDUSSCGKSA-N -1 3 328.412 4.135 20 0 EIADHM Cc1cc(=O)[n-]c(-c2cccc(OC(=O)/C=C/C3CCCCC3)c2)n1 ZINC000744218130 1059337151 /nfs/dbraw/zinc/33/71/51/1059337151.db2.gz VNDICUQZMAMFPU-ZHACJKMWSA-N -1 3 338.407 4.200 20 0 EIADHM CC(C)(C)c1cc(Nc2c(Cl)ccc([O-])c2F)c(C(N)=O)s1 ZINC001214556603 1059559693 /nfs/dbraw/zinc/55/96/93/1059559693.db2.gz ZPJPCSHKVKTSGJ-UHFFFAOYSA-N -1 3 342.823 4.386 20 0 EIADHM CCOc1ccc(Cl)c(Nc2cc(=O)n(-c3ccccc3)[n-]2)c1 ZINC001212575429 1059896474 /nfs/dbraw/zinc/89/64/74/1059896474.db2.gz FFHJRICRQGZTEV-UHFFFAOYSA-N -1 3 329.787 4.374 20 0 EIADHM Cc1cc2cccnc2c(S(=O)(=O)[N-]c2cccc(C)c2Cl)c1 ZINC000745978254 1059950445 /nfs/dbraw/zinc/95/04/45/1059950445.db2.gz HOZZTXMSSITXFA-UHFFFAOYSA-N -1 3 346.839 4.306 20 0 EIADHM O=C([O-])C[C@@H](NCc1ccc(F)cc1C(F)(F)F)c1cccs1 ZINC000391533240 1060303351 /nfs/dbraw/zinc/30/33/51/1060303351.db2.gz SYICLYZRZQIIDE-GFCCVEGCSA-N -1 3 347.333 4.212 20 0 EIADHM [O-]c1cccnc1CNc1nnc(-c2ccccc2)c2ccccc21 ZINC001169732198 1060934739 /nfs/dbraw/zinc/93/47/39/1060934739.db2.gz KIRHYESTVVTXRF-UHFFFAOYSA-N -1 3 328.375 4.010 20 0 EIADHM [O-]c1cc(Nc2cccc(F)c2OC[C@H]2CCCO2)ccc1Cl ZINC001212595457 1060974856 /nfs/dbraw/zinc/97/48/56/1060974856.db2.gz VEOAPCCWEIERFI-GFCCVEGCSA-N -1 3 337.778 4.486 20 0 EIADHM Cc1ccc([C@H]2CCCCCN2C(=O)Cc2ccc([O-])c(F)c2)o1 ZINC000449958728 1032161124 /nfs/dbraw/zinc/16/11/24/1032161124.db2.gz IFJDYXTYJLTCKN-MRXNPFEDSA-N -1 3 331.387 4.119 20 0 EIADHM C[C@@H](c1cccc(Cl)c1)N(C)C(=O)c1c[n-]c2ccccc2c1=O ZINC000065054533 1032247432 /nfs/dbraw/zinc/24/74/32/1032247432.db2.gz XYZVXKWPKPUIBT-LBPRGKRZSA-N -1 3 340.810 4.015 20 0 EIADHM C[C@H](Oc1ccc(F)cc1Cl)C(=O)Nc1ccc(Cl)cc1[O-] ZINC000532837168 1032342281 /nfs/dbraw/zinc/34/22/81/1032342281.db2.gz MSWXYNUVBMARBA-QMMMGPOBSA-N -1 3 344.169 4.244 20 0 EIADHM C[C@@H](Oc1ccc(F)cc1Cl)C(=O)Nc1ccc(Cl)cc1[O-] ZINC000532837148 1032343521 /nfs/dbraw/zinc/34/35/21/1032343521.db2.gz MSWXYNUVBMARBA-MRVPVSSYSA-N -1 3 344.169 4.244 20 0 EIADHM CCC(CC)c1nnc([N-]C(=O)c2scnc2C(C)(C)C)s1 ZINC000176627075 1032475796 /nfs/dbraw/zinc/47/57/96/1032475796.db2.gz BTDLMLIODHEEGE-UHFFFAOYSA-N -1 3 338.502 4.448 20 0 EIADHM O=C(CCSc1ccc(F)cc1)Nc1cc(Cl)ccc1[O-] ZINC000533081595 1032480635 /nfs/dbraw/zinc/48/06/35/1032480635.db2.gz LWQJIFZJXUUVRM-UHFFFAOYSA-N -1 3 325.792 4.306 20 0 EIADHM COc1ccc(C2(C(=O)Nc3ccc(Cl)cc3[O-])CCC2)cc1 ZINC000533159924 1032514938 /nfs/dbraw/zinc/51/49/38/1032514938.db2.gz FNUIVMRUPZXEOZ-UHFFFAOYSA-N -1 3 331.799 4.115 20 0 EIADHM O=C(Nc1ccc(Cl)cc1[O-])c1cnn(-c2ccc(Cl)cc2)c1 ZINC000533160127 1032515001 /nfs/dbraw/zinc/51/50/01/1032515001.db2.gz PLNMPGQYBRXSCR-UHFFFAOYSA-N -1 3 348.189 4.137 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(NC[C@@H]3CCCCC3(F)F)nc2)n1 ZINC000450578553 1032564768 /nfs/dbraw/zinc/56/47/68/1032564768.db2.gz AUSIQSFTLALFJD-ZDUSSCGKSA-N -1 3 348.397 4.044 20 0 EIADHM C[C@@H]1C[C@H](c2ccccc2)CCN1C(=O)c1cc([O-])ccc1Cl ZINC000512422224 1032727961 /nfs/dbraw/zinc/72/79/61/1032727961.db2.gz YHKYLNRHONOJLO-UKRRQHHQSA-N -1 3 329.827 4.454 20 0 EIADHM COc1cc(C)c(S(=O)(=O)[N-]c2c(C)cccc2C)cc1Cl ZINC000432777798 1032769354 /nfs/dbraw/zinc/76/93/54/1032769354.db2.gz DVLTURLHNOULNW-UHFFFAOYSA-N -1 3 339.844 4.075 20 0 EIADHM CC(C)(C)NC(=O)c1cccc(NCc2c([O-])cccc2Cl)c1 ZINC000160214984 1018876232 /nfs/dbraw/zinc/87/62/32/1018876232.db2.gz ZGDHDFKHVGPOIK-UHFFFAOYSA-N -1 3 332.831 4.186 20 0 EIADHM CCc1ccccc1S(=O)(=O)[N-]c1ccc(OC(C)C)cc1C ZINC000547631234 1018904929 /nfs/dbraw/zinc/90/49/29/1018904929.db2.gz DIQJSBADIJXUDR-UHFFFAOYSA-N -1 3 333.453 4.145 20 0 EIADHM O=[S@@](Cc1coc(-c2cccc(Cl)c2)n1)c1ccc([O-])cc1 ZINC000108083305 1019317231 /nfs/dbraw/zinc/31/72/31/1019317231.db2.gz AHIQSBWDEVLTQW-JOCHJYFZSA-N -1 3 333.796 4.008 20 0 EIADHM CC1(C)Cc2cccc(NC(=O)CCCc3ccc([O-])c(F)c3)c2O1 ZINC000530511964 1019393030 /nfs/dbraw/zinc/39/30/30/1019393030.db2.gz HUNVCORLNFCFMK-UHFFFAOYSA-N -1 3 343.398 4.206 20 0 EIADHM CCc1ccc([O-])c(C(=O)N(C)Cc2ccccc2C(F)(F)F)c1 ZINC000500720699 1032836583 /nfs/dbraw/zinc/83/65/83/1032836583.db2.gz GGIUGTPIRJBQTO-UHFFFAOYSA-N -1 3 337.341 4.246 20 0 EIADHM Cc1cc(NC(=O)c2c(C)nc(C(C)(C)C)[n-]c2=O)ccc1Cl ZINC000655340279 1019721172 /nfs/dbraw/zinc/72/11/72/1019721172.db2.gz ZXYFMBPVGKLZQN-UHFFFAOYSA-N -1 3 333.819 4.002 20 0 EIADHM O=C(NC[C@H]1CCO[C@@H]1c1ccccc1)c1cc([O-])c2ccccc2c1 ZINC000503951676 1019871130 /nfs/dbraw/zinc/87/11/30/1019871130.db2.gz RNVURHPSGLVHLO-DYESRHJHSA-N -1 3 347.414 4.053 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1cccn1Cc1cccs1 ZINC000521337853 1019960796 /nfs/dbraw/zinc/96/07/96/1019960796.db2.gz MGSDVJAZUDMIBW-UHFFFAOYSA-N -1 3 332.812 4.209 20 0 EIADHM O=C(NCC1(c2cccc(Cl)c2)CC1)c1cc([O-])ccc1Cl ZINC000683378656 1020490463 /nfs/dbraw/zinc/49/04/63/1020490463.db2.gz QPUIXRQXTADWKV-UHFFFAOYSA-N -1 3 336.218 4.161 20 0 EIADHM Cc1ccc(SC[C@@H](C)NC(=O)c2cc([O-])ccc2Cl)cc1 ZINC000500784895 1032916605 /nfs/dbraw/zinc/91/66/05/1032916605.db2.gz DLXSQQZMZGWLOO-GFCCVEGCSA-N -1 3 335.856 4.265 20 0 EIADHM CC(=O)c1ccc(C(=O)N2CCC[C@H](c3ccccc3)CC2)cc1[O-] ZINC000579928686 1020849223 /nfs/dbraw/zinc/84/92/23/1020849223.db2.gz SQRQDYIHIZXDMO-KRWDZBQOSA-N -1 3 337.419 4.005 20 0 EIADHM Cc1nc(C(=O)[N-]c2nnc(-c3ccc(C)cc3C)s2)sc1C ZINC000683540877 1020869848 /nfs/dbraw/zinc/86/98/48/1020869848.db2.gz GOOYUKBFHXECBV-UHFFFAOYSA-N -1 3 344.465 4.148 20 0 EIADHM O=C1CCc2ccc(Nc3cccc(F)c3[O-])c(Br)c21 ZINC001210201896 1020916944 /nfs/dbraw/zinc/91/69/44/1020916944.db2.gz NIAKIEQNWUPOCL-UHFFFAOYSA-N -1 3 336.160 4.166 20 0 EIADHM CC[C@H]([N-]C(=O)C(F)(F)c1ccc(F)cc1)c1ccc(F)cc1 ZINC001266531052 1021075689 /nfs/dbraw/zinc/07/56/89/1021075689.db2.gz JTRVCQPUSPCAGA-HNNXBMFYSA-N -1 3 325.305 4.324 20 0 EIADHM O=c1[n-]nc(S[C@@H]2CCc3ccccc32)n1CCc1ccccc1 ZINC000683736545 1021225348 /nfs/dbraw/zinc/22/53/48/1021225348.db2.gz BBXQETBFJKETPP-QGZVFWFLSA-N -1 3 337.448 4.006 20 0 EIADHM O=C(Nc1ccccc1NCC(F)(F)F)c1cc([O-])ccc1Cl ZINC000431724453 1021660761 /nfs/dbraw/zinc/66/07/61/1021660761.db2.gz UBAZTUCGFYAERA-UHFFFAOYSA-N -1 3 344.720 4.272 20 0 EIADHM CN(c1cc(Br)ccc1N)c1cccc([O-])c1Cl ZINC001210854903 1021805484 /nfs/dbraw/zinc/80/54/84/1021805484.db2.gz MZKHTKDXGOOHFG-UHFFFAOYSA-N -1 3 327.609 4.158 20 0 EIADHM O=C([O-])C[C@H](NCc1ccsc1)c1cccc(C(F)(F)F)c1 ZINC000340673836 1021893579 /nfs/dbraw/zinc/89/35/79/1021893579.db2.gz DSKJIKBDNVSCSE-ZDUSSCGKSA-N -1 3 329.343 4.073 20 0 EIADHM CC(C)(COCc1ccccc1)NC(=O)c1cc([O-])c2ccccc2c1 ZINC000504527476 1021894222 /nfs/dbraw/zinc/89/42/22/1021894222.db2.gz ZOIAFNQZMCMBQT-UHFFFAOYSA-N -1 3 349.430 4.271 20 0 EIADHM COc1ncc(Nc2cc(Br)cc(F)c2[O-])cc1Cl ZINC001211049994 1021987928 /nfs/dbraw/zinc/98/79/28/1021987928.db2.gz QHYUTXVETYBRTR-UHFFFAOYSA-N -1 3 347.571 4.094 20 0 EIADHM Cc1cc(O[C@@H](C)C(=O)Nc2c([O-])cccc2Cl)ccc1Cl ZINC000580424788 1022012868 /nfs/dbraw/zinc/01/28/68/1022012868.db2.gz YQITZPHIULCYIG-JTQLQIEISA-N -1 3 340.206 4.413 20 0 EIADHM C[C@H](CN(C)Cc1coc(-c2ccc(C(=O)[O-])cc2)n1)C(C)(C)C ZINC000634697411 1022040335 /nfs/dbraw/zinc/04/03/35/1022040335.db2.gz IZERHTXZOKCOIK-CYBMUJFWSA-N -1 3 330.428 4.154 20 0 EIADHM CCC(CC)(CC)[S@](=O)Cc1cc(=O)[n-]c(-c2ccccc2)n1 ZINC000414250802 1022312875 /nfs/dbraw/zinc/31/28/75/1022312875.db2.gz XIHZCOKWVQTRFB-HSZRJFAPSA-N -1 3 332.469 4.067 20 0 EIADHM O=C([N-]c1c(F)cc(F)cc1F)c1cc(Br)cs1 ZINC000175318436 1022329454 /nfs/dbraw/zinc/32/94/54/1022329454.db2.gz XLYMFFGTEOSTIP-UHFFFAOYSA-N -1 3 336.132 4.180 20 0 EIADHM Cc1cc([C@H]2CCCN2Cc2ncccc2[O-])ccc1Br ZINC000580635974 1022334537 /nfs/dbraw/zinc/33/45/37/1022334537.db2.gz DLTMAVHGUFFKRP-MRXNPFEDSA-N -1 3 347.256 4.195 20 0 EIADHM O=S(=O)([N-]c1ccc(CCC(F)(F)F)cc1)c1ccc(F)cc1 ZINC000175775367 1022458697 /nfs/dbraw/zinc/45/86/97/1022458697.db2.gz NIWABVBJJJTHJP-UHFFFAOYSA-N -1 3 347.333 4.121 20 0 EIADHM Cc1cc(=O)[n-]c(-c2ccc(NC(=O)CC3CCCCCC3)cc2)n1 ZINC000175819168 1022473130 /nfs/dbraw/zinc/47/31/30/1022473130.db2.gz REOUHBVPKLUQTG-UHFFFAOYSA-N -1 3 339.439 4.044 20 0 EIADHM CC[C@H](C)c1ccc(S(=O)(=O)[N-]c2c(C)ccnc2Cl)cc1 ZINC000318788646 1023055134 /nfs/dbraw/zinc/05/51/34/1023055134.db2.gz YXPDJDHZCFEMCR-NSHDSACASA-N -1 3 338.860 4.358 20 0 EIADHM CCCOc1ccc(CCC(=O)Nc2c([O-])cccc2Cl)cc1 ZINC000558471801 1023073242 /nfs/dbraw/zinc/07/32/42/1023073242.db2.gz ZEAJMFDPVOXJLX-UHFFFAOYSA-N -1 3 333.815 4.406 20 0 EIADHM C[C@H](c1ccccn1)N(C)C(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000179483407 1023213462 /nfs/dbraw/zinc/21/34/62/1023213462.db2.gz CORYOXKKAITWME-OAHLLOKOSA-N -1 3 348.402 4.413 20 0 EIADHM C[C@H](c1ccncc1)N(C)C(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000179483768 1023215008 /nfs/dbraw/zinc/21/50/08/1023215008.db2.gz VWRFQQASRNCWDU-OAHLLOKOSA-N -1 3 348.402 4.413 20 0 EIADHM CCc1ccc(-c2noc(C=C([O-])c3ccccc3Cl)n2)cc1 ZINC001211647422 1023225927 /nfs/dbraw/zinc/22/59/27/1023225927.db2.gz OXXUZZJYFFPYNQ-UHFFFAOYSA-N -1 3 326.783 4.378 20 0 EIADHM CC(C)([N-]C(=O)C(F)(F)c1c(F)cccc1F)c1ccccc1 ZINC001125506210 1023280679 /nfs/dbraw/zinc/28/06/79/1023280679.db2.gz ABBXLGXQTGUJIN-UHFFFAOYSA-N -1 3 325.305 4.108 20 0 EIADHM CC(C)Sc1cccc(Cl)c1CN[C@@H](CC(F)F)C(=O)[O-] ZINC000417596067 1023368056 /nfs/dbraw/zinc/36/80/56/1023368056.db2.gz PFTLAOZMNUOABG-NSHDSACASA-N -1 3 337.819 4.039 20 0 EIADHM CC(C)c1ccc(C(=O)NCc2ncc(-c3ccccc3)o2)c([O-])c1 ZINC000613639494 1023377233 /nfs/dbraw/zinc/37/72/33/1023377233.db2.gz DYOGYGBPCBLPBY-UHFFFAOYSA-N -1 3 336.391 4.101 20 0 EIADHM O=C([O-])[C@H]1C[C@H](NCc2ccccc2C(F)(F)F)c2ccccc21 ZINC000417626008 1023386140 /nfs/dbraw/zinc/38/61/40/1023386140.db2.gz SHHOOBNRUSMUBR-HOCLYGCPSA-N -1 3 335.325 4.108 20 0 EIADHM O=C(Nc1n[n-]c(-c2cc3ccccc3o2)n1)c1cc2sccc2[nH]1 ZINC000430617780 1023422792 /nfs/dbraw/zinc/42/27/92/1023422792.db2.gz OYCUWWCBMIHFEG-UHFFFAOYSA-N -1 3 349.375 4.013 20 0 EIADHM CCCc1ccc(NC(=O)c2c[n-]c3c(C)cc(F)cc3c2=O)cc1 ZINC000160979327 1023466515 /nfs/dbraw/zinc/46/65/15/1023466515.db2.gz YTLOIQXZNXNMFK-UHFFFAOYSA-N -1 3 338.382 4.180 20 0 EIADHM O=C([O-])[C@@H]1CCN(Cc2ccc(Cl)cc2Cl)[C@@H]2CCCC[C@@H]12 ZINC000656763440 1023503366 /nfs/dbraw/zinc/50/33/66/1023503366.db2.gz FSDAHIYCBJIHFH-SQWLQELKSA-N -1 3 342.266 4.459 20 0 EIADHM O=C([O-])[C@H](c1ccc(Cl)c(Cl)c1)N1CCC[C@H](CCF)C1 ZINC000656763856 1023507070 /nfs/dbraw/zinc/50/70/70/1023507070.db2.gz RTUCXSTYZPZXDY-YGRLFVJLSA-N -1 3 334.218 4.191 20 0 EIADHM CC(C)O[C@H](CN1CC[C@H](C(=O)[O-])[C@@H]2CCCC[C@H]21)c1ccccc1 ZINC000656767171 1023507883 /nfs/dbraw/zinc/50/78/83/1023507883.db2.gz RRLLQTNHKAQFJW-VNTMZGSJSA-N -1 3 345.483 4.118 20 0 EIADHM Cc1cc(CN2CC[C@H](C(=O)[O-])[C@@H]3CCCC[C@@H]32)c2ccccc2n1 ZINC000656766100 1023509476 /nfs/dbraw/zinc/50/94/76/1023509476.db2.gz QCLKCVNRZJFVMK-BJLQDIEVSA-N -1 3 338.451 4.009 20 0 EIADHM O=C([O-])[C@@H]1CCN(Cc2c(Cl)cccc2Cl)[C@@H]2CCCC[C@@H]12 ZINC000656765797 1023509868 /nfs/dbraw/zinc/50/98/68/1023509868.db2.gz OSMZSLQXCLGMKN-HWWQOWPSSA-N -1 3 342.266 4.459 20 0 EIADHM O=C(N[C@@H]1CCc2sc(Cl)cc21)c1cc([O-])ccc1Cl ZINC000557126276 1023660998 /nfs/dbraw/zinc/66/09/98/1023660998.db2.gz HYLCGHXBCAOAJV-LLVKDONJSA-N -1 3 328.220 4.178 20 0 EIADHM CCc1cc(=O)[n-]c(CN[C@H](CC(C)(C)C)c2ccc(F)cc2)n1 ZINC000341457302 1023784057 /nfs/dbraw/zinc/78/40/57/1023784057.db2.gz OJHZDASCTHGLND-MRXNPFEDSA-N -1 3 331.435 4.151 20 0 EIADHM O=C([N-]c1c(F)cc(F)cc1F)c1sccc1Br ZINC000088722496 1024154555 /nfs/dbraw/zinc/15/45/55/1024154555.db2.gz GCCLSSPDVVVGOQ-UHFFFAOYSA-N -1 3 336.132 4.180 20 0 EIADHM COc1ccc(-c2csc3[n-]c(-c4ccc(C)o4)nc(=O)c23)cc1 ZINC000047682127 1024337284 /nfs/dbraw/zinc/33/72/84/1024337284.db2.gz VQTCSJFRYXLGDT-UHFFFAOYSA-N -1 3 338.388 4.229 20 0 EIADHM CN(Cc1ccccc1-c1ccccc1)C(=O)c1c([O-])cccc1O ZINC000092120661 1024657894 /nfs/dbraw/zinc/65/78/94/1024657894.db2.gz CBJYQMAFHKXHHG-UHFFFAOYSA-N -1 3 333.387 4.037 20 0 EIADHM Cc1oc(-c2ccsc2)nc1CN1CCC[C@@H](C(C)(C)C(=O)[O-])C1 ZINC000652499699 1024860280 /nfs/dbraw/zinc/86/02/80/1024860280.db2.gz IZXZOWQLWOACKG-CQSZACIVSA-N -1 3 348.468 4.034 20 0 EIADHM C[C@H]1CN(Cc2ccc(C(=O)[O-])c(Cl)c2)CCc2ccc(F)cc21 ZINC000652510923 1024862282 /nfs/dbraw/zinc/86/22/82/1024862282.db2.gz MEAKKCWBSGFGCT-LBPRGKRZSA-N -1 3 347.817 4.339 20 0 EIADHM Cc1cc(=O)[n-]c([C@H](C)N[C@H](c2ccc(Cl)cc2)[C@H]2C[C@@H]2C)n1 ZINC000248731327 1024876255 /nfs/dbraw/zinc/87/62/55/1024876255.db2.gz JMANHWZRNPDDGO-UMPLHGAUSA-N -1 3 331.847 4.192 20 0 EIADHM CCc1cccc(Cl)c1CNC[C@@H](CCC(=O)[O-])C(F)(F)F ZINC000663261896 1024962393 /nfs/dbraw/zinc/96/23/93/1024962393.db2.gz ODHKHVLEKQTBRA-LLVKDONJSA-N -1 3 337.769 4.035 20 0 EIADHM CC(C)(C)CN(CC(=O)[O-])Cc1ccc(Cl)cc1Br ZINC000662224718 1024974324 /nfs/dbraw/zinc/97/43/24/1024974324.db2.gz ZCOKLMOVUGJOQU-UHFFFAOYSA-N -1 3 348.668 4.035 20 0 EIADHM Cc1c(C(=O)Nc2cc(Br)ccc2[O-])ccn1C(C)C ZINC000343896648 1025038494 /nfs/dbraw/zinc/03/84/94/1025038494.db2.gz KGFAXKIERKGDHH-UHFFFAOYSA-N -1 3 337.217 4.098 20 0 EIADHM O=C([O-])CCCCCCCNCc1csc(-c2ccsc2)n1 ZINC000277117520 1025048751 /nfs/dbraw/zinc/04/87/51/1025048751.db2.gz ARYRJIMODVPFBN-UHFFFAOYSA-N -1 3 338.498 4.386 20 0 EIADHM O=C([N-]c1nc(-c2ccc(F)cc2)ns1)c1coc(C(F)F)c1 ZINC001126236875 1025136578 /nfs/dbraw/zinc/13/65/78/1025136578.db2.gz ONBOHSMQLJSAGP-UHFFFAOYSA-N -1 3 339.298 4.127 20 0 EIADHM C[C@H](/N=C/c1cc(Cl)ccc1[O-])c1ccc(N2CCOCC2)cc1 ZINC000065222215 1025238938 /nfs/dbraw/zinc/23/89/38/1025238938.db2.gz KFHXACSINYUUJP-HADWXUJASA-N -1 3 344.842 4.062 20 0 EIADHM CC[C@H](C)[C@H](NC(=O)NCc1ncccc1[O-])c1ccc(Cl)cc1 ZINC000471999160 1025289837 /nfs/dbraw/zinc/28/98/37/1025289837.db2.gz QEVVWUXJLUJMPX-SJCJKPOMSA-N -1 3 347.846 4.027 20 0 EIADHM CC[C@H](C)[C@@H](NC(=O)NCc1ncccc1[O-])c1ccc(Cl)cc1 ZINC000471999162 1025290400 /nfs/dbraw/zinc/29/04/00/1025290400.db2.gz QEVVWUXJLUJMPX-YVEFUNNKSA-N -1 3 347.846 4.027 20 0 EIADHM C[C@H]1CCc2ccccc2N1Cc1nc2c3ccccc3oc2c(=O)[n-]1 ZINC000006996457 1025307725 /nfs/dbraw/zinc/30/77/25/1025307725.db2.gz ONHGOOBEFWFNSK-ZDUSSCGKSA-N -1 3 345.402 4.011 20 0 EIADHM CC[C@H](CC(F)(F)F)Nc1ccc(-c2nc(C)c(C)c(=O)[n-]2)cn1 ZINC000546170077 1025708696 /nfs/dbraw/zinc/70/86/96/1025708696.db2.gz AZTZZEYJCQGQPW-GFCCVEGCSA-N -1 3 340.349 4.004 20 0 EIADHM CC(C)(C(=O)Nc1ccc([O-])c(C(F)(F)F)c1)c1ccc(F)cc1 ZINC000426607654 1025761934 /nfs/dbraw/zinc/76/19/34/1025761934.db2.gz KNZFRBMNUYLLQO-UHFFFAOYSA-N -1 3 341.304 4.466 20 0 EIADHM Cc1sc(-c2ccco2)nc1C(=O)Nc1cc(Cl)ccc1[O-] ZINC000111210118 1026098442 /nfs/dbraw/zinc/09/84/42/1026098442.db2.gz JNNAFJBOLBFLDX-UHFFFAOYSA-N -1 3 334.784 4.323 20 0 EIADHM Cc1cc(O[C@H](C)C(=O)Nc2cc(Cl)ccc2[O-])ccc1Cl ZINC000111210365 1026099398 /nfs/dbraw/zinc/09/93/98/1026099398.db2.gz AFXSUQJZIOELGC-SNVBAGLBSA-N -1 3 340.206 4.413 20 0 EIADHM Cc1cc([C@@H](C)N2CCC(Cc3ccccc3F)CC2)oc1C(=O)[O-] ZINC000564662439 1026124838 /nfs/dbraw/zinc/12/48/38/1026124838.db2.gz ZCBQRZLMYULFJW-CQSZACIVSA-N -1 3 345.414 4.441 20 0 EIADHM Cc1ccc(-c2nc(CN[C@@H](CC(=O)[O-])C(C)(C)C)cs2)cc1 ZINC000277479139 1026164094 /nfs/dbraw/zinc/16/40/94/1026164094.db2.gz WPTLCLNSBUBCQF-HNNXBMFYSA-N -1 3 332.469 4.098 20 0 EIADHM Cc1ccc(-c2nc(CN[C@H](CC(=O)[O-])C(C)(C)C)cs2)cc1 ZINC000277479145 1026165331 /nfs/dbraw/zinc/16/53/31/1026165331.db2.gz WPTLCLNSBUBCQF-OAHLLOKOSA-N -1 3 332.469 4.098 20 0 EIADHM O=C(Nc1nc(-c2ccccn2)cs1)c1cc([O-])c2ccccc2c1 ZINC000349688912 1026220119 /nfs/dbraw/zinc/22/01/19/1026220119.db2.gz BTTCTGZWYILQTF-UHFFFAOYSA-N -1 3 347.399 4.316 20 0 EIADHM Cc1cc(C=C2CCN(C(=O)c3cc([O-])c4ccccc4c3)CC2)no1 ZINC000375670974 1026221334 /nfs/dbraw/zinc/22/13/34/1026221334.db2.gz FIBOZQOCAYUBDE-UHFFFAOYSA-N -1 3 348.402 4.161 20 0 EIADHM CC(C)Cn1cc(NC(=O)c2cc([O-])ccc2Cl)c(C(F)F)n1 ZINC000344333071 1026247695 /nfs/dbraw/zinc/24/76/95/1026247695.db2.gz ZKACUEVFRPKRBS-UHFFFAOYSA-N -1 3 343.761 4.088 20 0 EIADHM CC(C)c1ccc2c(c1)[C@@H](NC(=O)c1c[n-]c3ccccc3c1=O)CC2 ZINC000187251478 1026362338 /nfs/dbraw/zinc/36/23/38/1026362338.db2.gz CRMLIIWKSVOQOL-FQEVSTJZSA-N -1 3 346.430 4.069 20 0 EIADHM Cc1ccc(-c2ncc(CNCc3ccc(C(=O)[O-])cc3)s2)cc1 ZINC000426685527 1026477170 /nfs/dbraw/zinc/47/71/70/1026477170.db2.gz IEMMMENWZXWZIE-UHFFFAOYSA-N -1 3 338.432 4.107 20 0 EIADHM C[C@H](CCC[C@@H](C)C(=O)[O-])NCc1csc(-c2cccs2)n1 ZINC000426705517 1026489863 /nfs/dbraw/zinc/48/98/63/1026489863.db2.gz XEEIHCCKOGPWSS-VXGBXAGGSA-N -1 3 338.498 4.241 20 0 EIADHM CC(C)COc1cccc(CN[C@H](CC(=O)[O-])c2ccsc2)c1 ZINC000426691082 1026491347 /nfs/dbraw/zinc/49/13/47/1026491347.db2.gz GCZKEPHQRQSEPU-QGZVFWFLSA-N -1 3 333.453 4.089 20 0 EIADHM Cc1ccc2[nH]c(CN[C@@H](C(=O)[O-])c3cccc(Cl)c3)cc2c1C ZINC000426725960 1026504935 /nfs/dbraw/zinc/50/49/35/1026504935.db2.gz GFWXEKPPTYMLQF-GOSISDBHSA-N -1 3 342.826 4.354 20 0 EIADHM O=C([O-])[C@H](NCc1cccc(C(F)(F)F)c1)c1cccc(Cl)c1 ZINC000426745424 1026527864 /nfs/dbraw/zinc/52/78/64/1026527864.db2.gz ZXXIHHOKIDWKAQ-CQSZACIVSA-N -1 3 343.732 4.274 20 0 EIADHM COc1cccc(CN[C@H](CC(=O)[O-])c2ccc(C(C)C)cc2)c1 ZINC000426805358 1026560574 /nfs/dbraw/zinc/56/05/74/1026560574.db2.gz ATIPFLXVWCZFPO-LJQANCHMSA-N -1 3 327.424 4.124 20 0 EIADHM O=C([O-])C[C@@H](NCc1cc2c(cccc2F)[nH]1)c1ccc(Cl)cc1 ZINC000426767739 1026560837 /nfs/dbraw/zinc/56/08/37/1026560837.db2.gz QERXDGMCNSAJNM-QGZVFWFLSA-N -1 3 346.789 4.266 20 0 EIADHM CCOc1ccc(CN[C@H](CC(=O)[O-])c2cccc(Cl)c2)cc1 ZINC000426808897 1026573392 /nfs/dbraw/zinc/57/33/92/1026573392.db2.gz SZIVVCXLDSJVHX-QGZVFWFLSA-N -1 3 333.815 4.044 20 0 EIADHM Cc1cc([C@H](NCc2ccc(Cl)c(F)c2)C(=O)[O-])ccc1Cl ZINC000426829748 1026573662 /nfs/dbraw/zinc/57/36/62/1026573662.db2.gz RITYSGNHHFUGTJ-HNNXBMFYSA-N -1 3 342.197 4.356 20 0 EIADHM O=C([O-])C[C@H](NCc1cc(F)cc(Cl)c1)c1cccc(Cl)c1 ZINC000426809678 1026573889 /nfs/dbraw/zinc/57/38/89/1026573889.db2.gz WGZPIRNURVZFGW-HNNXBMFYSA-N -1 3 342.197 4.438 20 0 EIADHM CN(Cc1ccc(Br)s1)Cc1c(F)ccc([O-])c1F ZINC000507008891 1026587980 /nfs/dbraw/zinc/58/79/80/1026587980.db2.gz WPGRZEAXVIGYAB-UHFFFAOYSA-N -1 3 348.212 4.126 20 0 EIADHM CCCCCOc1ccc(CN[C@@H](C(=O)[O-])c2ccsc2)cc1 ZINC000426831597 1026591575 /nfs/dbraw/zinc/59/15/75/1026591575.db2.gz FNGZGQYAJSRPTH-QGZVFWFLSA-N -1 3 333.453 4.233 20 0 EIADHM COc1ccc([C@@H]2CCCN2Cc2c(F)ccc([O-])c2F)cc1OC ZINC000507081778 1026632290 /nfs/dbraw/zinc/63/22/90/1026632290.db2.gz MYVACEZOSNTMBS-HNNXBMFYSA-N -1 3 349.377 4.025 20 0 EIADHM O=C(c1cc([O-])ccc1Cl)N1CCC[C@@H]1CCc1ccccc1 ZINC000582516254 1026736445 /nfs/dbraw/zinc/73/64/45/1026736445.db2.gz BUIMUZXRJMYSNW-OAHLLOKOSA-N -1 3 329.827 4.283 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1nc2ccccc2cc1Cl ZINC000582635094 1026885418 /nfs/dbraw/zinc/88/54/18/1026885418.db2.gz PVSHXVAVUWIAKB-UHFFFAOYSA-N -1 3 333.174 4.500 20 0 EIADHM CCOc1cc(CNc2cnn(C3CCCC3)c2)cc(Cl)c1[O-] ZINC000896696826 1027804636 /nfs/dbraw/zinc/80/46/36/1027804636.db2.gz JUXARZMJEVVUKA-UHFFFAOYSA-N -1 3 335.835 4.368 20 0 EIADHM C=CCN(Cc1cccs1)Cc1cc(=O)oc2c(C)c([O-])ccc12 ZINC000007615475 1027837110 /nfs/dbraw/zinc/83/71/10/1027837110.db2.gz ONOPDXBEOMGTEZ-UHFFFAOYSA-N -1 3 341.432 4.057 20 0 EIADHM CCCNc1ccc(CNC(=O)c2cc([O-])c3ccccc3c2)cc1 ZINC000583057038 1027906865 /nfs/dbraw/zinc/90/68/65/1027906865.db2.gz ZSYBQELBESNRKO-UHFFFAOYSA-N -1 3 334.419 4.297 20 0 EIADHM CCc1ncc(C(=O)[N-]c2cc(F)ccc2SCC(F)F)s1 ZINC000122705642 1027929132 /nfs/dbraw/zinc/92/91/32/1027929132.db2.gz DPQOOIUTHITJKQ-UHFFFAOYSA-N -1 3 346.399 4.454 20 0 EIADHM CC(C)(C)c1ccc(-c2nc([N-]C(=O)c3ccoc3Cl)n[nH]2)cc1 ZINC000192414378 1027940269 /nfs/dbraw/zinc/94/02/69/1027940269.db2.gz CJCZQRUZKJNHAD-UHFFFAOYSA-N -1 3 344.802 4.268 20 0 EIADHM COc1ccc(C2CCN(Cc3c(F)ccc([O-])c3F)CC2)cc1 ZINC000508504706 1027943321 /nfs/dbraw/zinc/94/33/21/1027943321.db2.gz NWVAYFFODICESD-UHFFFAOYSA-N -1 3 333.378 4.059 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)c1ccc(Oc2ccccc2)cc1 ZINC000523424977 1028083953 /nfs/dbraw/zinc/08/39/53/1028083953.db2.gz ZDDCMWNFBRZKED-UHFFFAOYSA-N -1 3 337.350 4.254 20 0 EIADHM CN(Cc1ccc(C(C)(C)C)cc1)C(=O)NCc1ccc([O-])c(F)c1 ZINC000523467775 1028132280 /nfs/dbraw/zinc/13/22/80/1028132280.db2.gz KQTUSHDKDMCQGS-UHFFFAOYSA-N -1 3 344.430 4.170 20 0 EIADHM O=C([O-])CC[C@@H]1CCCCN1Cc1coc(-c2cccc(Cl)c2)n1 ZINC000324305145 1028241845 /nfs/dbraw/zinc/24/18/45/1028241845.db2.gz XGBRCZFJCGMBNC-INIZCTEOSA-N -1 3 348.830 4.214 20 0 EIADHM C[C@@H]1CN(Cc2csc(-c3ccc(C(=O)[O-])cc3)n2)C(C)(C)C1 ZINC000583209561 1028261160 /nfs/dbraw/zinc/26/11/60/1028261160.db2.gz QUQHVPWLTMWENT-LBPRGKRZSA-N -1 3 330.453 4.129 20 0 EIADHM CC(C)c1ccc(Sc2ccc(NC(=O)c3cnn[n-]3)cc2)cc1 ZINC000523684620 1028312449 /nfs/dbraw/zinc/31/24/49/1028312449.db2.gz YUONHLVHZFPCOY-UHFFFAOYSA-N -1 3 338.436 4.332 20 0 EIADHM CC(C)c1ccc(Sc2ccc(NC(=O)c3c[n-]nn3)cc2)cc1 ZINC000523684620 1028312468 /nfs/dbraw/zinc/31/24/68/1028312468.db2.gz YUONHLVHZFPCOY-UHFFFAOYSA-N -1 3 338.436 4.332 20 0 EIADHM CC(C)c1ccc(Sc2ccc(NC(=O)c3cn[n-]n3)cc2)cc1 ZINC000523684620 1028312482 /nfs/dbraw/zinc/31/24/82/1028312482.db2.gz YUONHLVHZFPCOY-UHFFFAOYSA-N -1 3 338.436 4.332 20 0 EIADHM Cc1cc(F)cc2c(=O)c(C(=O)Nc3ccc(C(C)C)cc3)c[n-]c12 ZINC000154944689 1028329868 /nfs/dbraw/zinc/32/98/68/1028329868.db2.gz XPMULCDWIHEHTF-UHFFFAOYSA-N -1 3 338.382 4.351 20 0 EIADHM CSc1ccc([O-])c(C(=O)N(Cc2ccc(F)cc2)C2CC2)c1 ZINC000665503637 1028353363 /nfs/dbraw/zinc/35/33/63/1028353363.db2.gz RVCZHWZHCQLMAC-UHFFFAOYSA-N -1 3 331.412 4.058 20 0 EIADHM CCc1cccc(C(=O)N2CC(c3cccc(C(F)(F)F)c3)C2)c1[O-] ZINC000583308880 1028481814 /nfs/dbraw/zinc/48/18/14/1028481814.db2.gz NTTVDCBLUCUAHR-UHFFFAOYSA-N -1 3 349.352 4.213 20 0 EIADHM [O-]c1cc(Cl)cnc1O[C@@H]1CCc2c1cccc2Br ZINC001227981231 1028698902 /nfs/dbraw/zinc/69/89/02/1028698902.db2.gz UWUSXCDOIMVCHD-CYBMUJFWSA-N -1 3 340.604 4.269 20 0 EIADHM Cc1noc(C)c1[N-]C(=O)c1csc(-c2ccc(C)cc2C)n1 ZINC000522745483 1028752567 /nfs/dbraw/zinc/75/25/67/1028752567.db2.gz IJZPBMCGMAHHMI-UHFFFAOYSA-N -1 3 327.409 4.284 20 0 EIADHM [O-]c1cc2ccccc2cc1-c1nc(-c2ccc3cc[nH]c3n2)no1 ZINC000445575303 1028758798 /nfs/dbraw/zinc/75/87/98/1028758798.db2.gz PTUWFTYGFNZPFE-UHFFFAOYSA-N -1 3 328.331 4.139 20 0 EIADHM Cn1ccc(C(=O)Nc2ccc([O-])c(C(F)(F)F)c2)c1C1CCC1 ZINC000343329286 1028965445 /nfs/dbraw/zinc/96/54/45/1028965445.db2.gz BIYWMROFZIVMIJ-UHFFFAOYSA-N -1 3 338.329 4.269 20 0 EIADHM Cc1ccc(C)c([N-]S(=O)(=O)c2ccc(OC(C)C)c(C)c2)c1 ZINC000614729457 1029098888 /nfs/dbraw/zinc/09/88/88/1029098888.db2.gz AHQDZOOKUMVPOZ-UHFFFAOYSA-N -1 3 333.453 4.200 20 0 EIADHM C[C@H](Sc1ncco1)c1nc(=O)c2c(-c3ccco3)csc2[n-]1 ZINC000446069775 1029130495 /nfs/dbraw/zinc/13/04/95/1029130495.db2.gz GEWOMNLKUYIZPO-QMMMGPOBSA-N -1 3 345.405 4.498 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@H]3CCCC[C@H]3CC)nc2)n1 ZINC000524685218 1029155191 /nfs/dbraw/zinc/15/51/91/1029155191.db2.gz MTPLIHZKUCVPKA-CJNGLKHVSA-N -1 3 326.444 4.187 20 0 EIADHM CCc1ccc([O-])c(C(=O)N2CCC(OCC3CCCCC3)CC2)c1 ZINC000524741724 1029197284 /nfs/dbraw/zinc/19/72/84/1029197284.db2.gz BKLAEFDALDYFCW-UHFFFAOYSA-N -1 3 345.483 4.156 20 0 EIADHM CC(=O)c1cc(F)c([N-]C(=O)c2ccc(F)cc2Cl)c(F)c1F ZINC000536141878 1029251612 /nfs/dbraw/zinc/25/16/12/1029251612.db2.gz YNAVQBKVJMUBJX-UHFFFAOYSA-N -1 3 345.679 4.351 20 0 EIADHM CCc1nocc1C(=O)[N-]c1ccccc1SCC(F)(F)F ZINC000665924220 1029253828 /nfs/dbraw/zinc/25/38/28/1029253828.db2.gz VMKGTLXLDVJMES-UHFFFAOYSA-N -1 3 330.331 4.144 20 0 EIADHM CCC1(CC)[C@H](N(C)Cc2cccc(C(=O)[O-])c2Cl)C[C@@H]1OC ZINC000583877687 1029313526 /nfs/dbraw/zinc/31/35/26/1029313526.db2.gz VHBVXGZHTDHYCV-CABCVRRESA-N -1 3 339.863 4.064 20 0 EIADHM [O-]c1cc(Br)cc(F)c1OC1CCC(F)(F)CC1 ZINC001227588460 1029361595 /nfs/dbraw/zinc/36/15/95/1029361595.db2.gz UCAUGRKBYYIMLZ-UHFFFAOYSA-N -1 3 325.124 4.251 20 0 EIADHM Cc1cc(=O)[n-]c([C@H](C)N[C@@H](C)c2cc(F)c(Cl)cc2Cl)n1 ZINC000192722498 1029368065 /nfs/dbraw/zinc/36/80/65/1029368065.db2.gz KEXBONLPGMTERJ-IUCAKERBSA-N -1 3 344.217 4.348 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2ccc(OC(C)(C)C)cc2)c(C)c1 ZINC000525017318 1029391871 /nfs/dbraw/zinc/39/18/71/1029391871.db2.gz QDYRBOMFPGTJOY-UHFFFAOYSA-N -1 3 333.453 4.282 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(NCC3CCC(C)CC3)nc2)n1 ZINC000301183479 1029682253 /nfs/dbraw/zinc/68/22/53/1029682253.db2.gz RPAYYEIKVOASIN-UHFFFAOYSA-N -1 3 326.444 4.045 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@H](C)CCc3ccccc3)nc2)n1 ZINC000301189069 1029683538 /nfs/dbraw/zinc/68/35/38/1029683538.db2.gz VFIKNUCFXZMPAD-OAHLLOKOSA-N -1 3 348.450 4.240 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(NC[C@H]3CCC[C@@H](C)C3)nc2)n1 ZINC000301191732 1029683612 /nfs/dbraw/zinc/68/36/12/1029683612.db2.gz ZXZCFIGSUJOOSE-KGLIPLIRSA-N -1 3 326.444 4.045 20 0 EIADHM COc1ccc(CCCN(C)Cc2c(Cl)cccc2C(=O)[O-])cc1 ZINC000584236845 1029689052 /nfs/dbraw/zinc/68/90/52/1029689052.db2.gz ARGDSHWSBPIOIH-UHFFFAOYSA-N -1 3 347.842 4.111 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@@H]3CC[C@H](C)C[C@@H]3C)nc2)n1 ZINC000301248436 1029693507 /nfs/dbraw/zinc/69/35/07/1029693507.db2.gz IKGIEZTUDWAOEX-HEHGZKQESA-N -1 3 326.444 4.043 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@@H]3CCC[C@H](C)[C@H]3C)nc2)n1 ZINC000301490393 1029742743 /nfs/dbraw/zinc/74/27/43/1029742743.db2.gz ARIORJDUXZHVSS-WOSRLPQWSA-N -1 3 326.444 4.043 20 0 EIADHM Cc1cccc2ncnc(NCc3ccc([O-])c(Br)c3)c12 ZINC000301694833 1029791834 /nfs/dbraw/zinc/79/18/34/1029791834.db2.gz MEONVKQVRUAOBK-UHFFFAOYSA-N -1 3 344.212 4.018 20 0 EIADHM CC[C@@H](c1nnc([N-]C(=O)c2csnc2C)s1)c1ccccc1 ZINC000181962842 1029930548 /nfs/dbraw/zinc/93/05/48/1029930548.db2.gz ZTGOGYQRNBGGJZ-GFCCVEGCSA-N -1 3 344.465 4.097 20 0 EIADHM [O-]c1cc(Cl)c(CN2CCC3(CCOCC3)CC2)c(Cl)c1 ZINC001142114773 1029972936 /nfs/dbraw/zinc/97/29/36/1029972936.db2.gz OANAHWAFIBCAPE-UHFFFAOYSA-N -1 3 330.255 4.092 20 0 EIADHM Cc1ccc(-c2csc(CN3[C@H](C)CC(C(=O)[O-])C[C@H]3C)n2)cc1 ZINC000530173740 1030194019 /nfs/dbraw/zinc/19/40/19/1030194019.db2.gz GZWDOAVMBUTSSZ-ZIAGYGMSSA-N -1 3 344.480 4.192 20 0 EIADHM C[C@@H]1C[C@@H](C(=O)[O-])C[C@H](C)N1Cc1ncc(-c2ccc(Cl)cc2)o1 ZINC000530179843 1030199397 /nfs/dbraw/zinc/19/93/97/1030199397.db2.gz ODHVLQUCZTXYHS-DABQJJPHSA-N -1 3 348.830 4.069 20 0 EIADHM C[C@H]1CC(C(=O)[O-])C[C@H](C)N1Cc1ncc(-c2ccc(Cl)cc2)o1 ZINC000530179844 1030199984 /nfs/dbraw/zinc/19/99/84/1030199984.db2.gz ODHVLQUCZTXYHS-RYUDHWBXSA-N -1 3 348.830 4.069 20 0 EIADHM C[C@@H](CS(=O)(=O)[N-]c1ccccc1C(C)(F)F)c1ccccc1 ZINC000451090406 1030231733 /nfs/dbraw/zinc/23/17/33/1030231733.db2.gz UDBYDUHPSZYKFK-ZDUSSCGKSA-N -1 3 339.407 4.344 20 0 EIADHM Cc1ccc([O-])c(NC(=O)c2oc3ccccc3c2COC(C)C)n1 ZINC000447633095 1030232770 /nfs/dbraw/zinc/23/27/70/1030232770.db2.gz UKSNJHLVTZFUHR-UHFFFAOYSA-N -1 3 340.379 4.019 20 0 EIADHM C[C@@H]1CCN(C(=O)CCCc2ccc([O-])c(F)c2)[C@@H]2CCCC[C@H]12 ZINC000530332007 1030306652 /nfs/dbraw/zinc/30/66/52/1030306652.db2.gz QQNWSGIAZAZXOB-QGPMSJSTSA-N -1 3 333.447 4.281 20 0 EIADHM COc1ccc2sc(C(=O)Nc3cc(F)ccc3[O-])c(C)c2c1 ZINC000530658463 1030629693 /nfs/dbraw/zinc/62/96/93/1030629693.db2.gz UAVOUSGYALLJRN-UHFFFAOYSA-N -1 3 331.368 4.315 20 0 EIADHM C[C@@H]1CC[C@@H](c2ccccc2)N(C(=O)Cc2ccc([O-])c(F)c2)C1 ZINC000451691723 1030660760 /nfs/dbraw/zinc/66/07/60/1030660760.db2.gz RTPNHDWSNGLKFF-KDOFPFPSSA-N -1 3 327.399 4.074 20 0 EIADHM CCS[C@H]1CCC[C@H](NC(=O)c2cc([O-])c3ccccc3c2)C1 ZINC000527467681 1030705864 /nfs/dbraw/zinc/70/58/64/1030705864.db2.gz PERNNFVJPBIELH-HOTGVXAUSA-N -1 3 329.465 4.340 20 0 EIADHM CSc1ccc([O-])c(C(=O)N2CCSC3(CCCCC3)C2)c1 ZINC000612053538 1030835216 /nfs/dbraw/zinc/83/52/16/1030835216.db2.gz IOVSADBSDKWKQY-UHFFFAOYSA-N -1 3 337.510 4.006 20 0 EIADHM CCC(CC)c1cc(C(=O)N=c2cc(-c3cccc(F)c3)o[n-]2)on1 ZINC000448539099 1030835797 /nfs/dbraw/zinc/83/57/97/1030835797.db2.gz RMQLYJLQMBJDBK-UHFFFAOYSA-N -1 3 343.358 4.047 20 0 EIADHM Cc1nc([C@H](C)N(C)C[C@H](C)C(=O)[O-])oc1-c1ccc(Cl)cc1 ZINC000263392907 1030844139 /nfs/dbraw/zinc/84/41/39/1030844139.db2.gz YZPYRDKUFXGUKN-JQWIXIFHSA-N -1 3 336.819 4.017 20 0 EIADHM Cc1nc([C@H](C)N(C)C[C@@H](C)C(=O)[O-])oc1-c1ccc(Cl)cc1 ZINC000263392909 1030844285 /nfs/dbraw/zinc/84/42/85/1030844285.db2.gz YZPYRDKUFXGUKN-PWSUYJOCSA-N -1 3 336.819 4.017 20 0 EIADHM C[C@@H]1[C@H](CC(F)(F)F)C[C@H](C)N1C(=O)c1cc([O-])ccc1Cl ZINC000452230668 1030899944 /nfs/dbraw/zinc/89/99/44/1030899944.db2.gz KWISUTXDKXWHFR-AEJSXWLSSA-N -1 3 335.753 4.237 20 0 EIADHM C[C@@]1(C(=O)[O-])CCN(Cc2c(Cl)cccc2Oc2ccccc2)C1 ZINC000263508663 1030903683 /nfs/dbraw/zinc/90/36/83/1030903683.db2.gz MRRGTOMEDHOSSX-LJQANCHMSA-N -1 3 345.826 4.429 20 0 EIADHM C[C@@H]1C[C@@H]1c1ccc(CN2CCC(c3ccccc3C(=O)[O-])CC2)o1 ZINC000666586635 1031049481 /nfs/dbraw/zinc/04/94/81/1031049481.db2.gz SKNMHKDVUNAYPB-KUHUBIRLSA-N -1 3 339.435 4.481 20 0 EIADHM C[C@@H](N(C)Cc1ccc(C(=O)[O-])cc1Br)C(C)(C)C ZINC000226726235 1031104923 /nfs/dbraw/zinc/10/49/23/1031104923.db2.gz CMVLNYMPZWCIBJ-SNVBAGLBSA-N -1 3 328.250 4.014 20 0 EIADHM C[C@@H]1C[C@H](C(F)(F)F)CCN1C(=O)CCCc1ccc([O-])c(F)c1 ZINC000452650631 1031220028 /nfs/dbraw/zinc/22/00/28/1031220028.db2.gz VKZHQDJZHJAGGE-DGCLKSJQSA-N -1 3 347.352 4.043 20 0 EIADHM C[C@H]1C[C@H](C(F)(F)F)CCN1C(=O)CCCc1ccc([O-])c(F)c1 ZINC000452650632 1031221030 /nfs/dbraw/zinc/22/10/30/1031221030.db2.gz VKZHQDJZHJAGGE-WCQYABFASA-N -1 3 347.352 4.043 20 0 EIADHM Cc1ccc(C(=O)Nc2ccc(OCc3cccnc3)cc2)c([O-])c1C ZINC000728610424 1031312643 /nfs/dbraw/zinc/31/26/43/1031312643.db2.gz HMQSBENAETUFEO-UHFFFAOYSA-N -1 3 348.402 4.235 20 0 EIADHM O=C(Nc1ccc(Br)cc1[O-])c1ccc(F)c(Cl)c1 ZINC000532610853 1031418098 /nfs/dbraw/zinc/41/80/98/1031418098.db2.gz SOTYRERGMISBFN-UHFFFAOYSA-N -1 3 344.567 4.200 20 0 EIADHM C[C@H](Oc1ccc2ccccc2c1)C(=O)Nc1cc(F)ccc1[O-] ZINC000472440341 1031646831 /nfs/dbraw/zinc/64/68/31/1031646831.db2.gz RYEZQFRSFIXGOJ-LBPRGKRZSA-N -1 3 325.339 4.091 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N1CC[C@H](c2ccccc2F)C1 ZINC000502114484 1031685742 /nfs/dbraw/zinc/68/57/42/1031685742.db2.gz DTYOQTLLHDRXJF-HNNXBMFYSA-N -1 3 335.378 4.314 20 0 EIADHM COc1cccc(-c2nc(C3(c4cc(C)cc(C)c4)CC3)no2)c1[O-] ZINC000453306133 1031831853 /nfs/dbraw/zinc/83/18/53/1031831853.db2.gz IDSYKGNYWQXRFY-UHFFFAOYSA-N -1 3 336.391 4.148 20 0 EIADHM CCOc1cc(CN2CCC[C@@H]2c2cc(C)no2)cc(Cl)c1[O-] ZINC000459332720 1031837723 /nfs/dbraw/zinc/83/77/23/1031837723.db2.gz WNVAWFWWXNOLTP-CQSZACIVSA-N -1 3 336.819 4.078 20 0 EIADHM Cc1ccccc1OCc1nc(=O)c2c3c(sc2[n-]1)C[C@H](C)CC3 ZINC000531935111 1031843713 /nfs/dbraw/zinc/84/37/13/1031843713.db2.gz ORYSMDUADWYCGS-LLVKDONJSA-N -1 3 340.448 4.409 20 0 EIADHM CC[C@H](C)c1ccc(S(=O)(=O)[N-]c2cc(OC)ccc2F)cc1 ZINC000532037678 1031989434 /nfs/dbraw/zinc/98/94/34/1031989434.db2.gz AGIJIUVBQNZROO-LBPRGKRZSA-N -1 3 337.416 4.149 20 0 EIADHM CC(C)Oc1cccc(F)c1Nc1cc(=O)n(-c2ccccc2)[n-]1 ZINC001211775454 1033883343 /nfs/dbraw/zinc/88/33/43/1033883343.db2.gz OKCQWLJOBGMEPH-UHFFFAOYSA-N -1 3 327.359 4.248 20 0 EIADHM CC[C@H]1C[C@]1(NC(=O)c1cc([O-])ccc1Cl)c1cccc(C)c1 ZINC000512925564 1034201872 /nfs/dbraw/zinc/20/18/72/1034201872.db2.gz JPZPCDLIZCHTOA-ORAYPTAESA-N -1 3 329.827 4.409 20 0 EIADHM O=C(Nc1cccc(-c2ccccc2)c1)c1c[n-]c2ccccc2c1=O ZINC000345614478 1035263160 /nfs/dbraw/zinc/26/31/60/1035263160.db2.gz BKFBNRVWJUCNCF-UHFFFAOYSA-N -1 3 340.382 4.447 20 0 EIADHM O=C([N-]c1scnc1-c1ccccc1)c1cc(-c2ccccn2)no1 ZINC000345852891 1035316961 /nfs/dbraw/zinc/31/69/61/1035316961.db2.gz IZYQVZQHESIUOL-UHFFFAOYSA-N -1 3 348.387 4.112 20 0 EIADHM CSc1cc(C(=O)Nc2nc(C)ccc2[O-])c(Cl)cc1Cl ZINC000345924333 1035332630 /nfs/dbraw/zinc/33/26/30/1035332630.db2.gz IKVBRQWONNMOKG-UHFFFAOYSA-N -1 3 343.235 4.377 20 0 EIADHM O=C(NCCCCCc1ccc(F)cc1)c1cc([O-])ccc1Cl ZINC000501673870 1035497980 /nfs/dbraw/zinc/49/79/80/1035497980.db2.gz IAVQGPAFUYIAJG-UHFFFAOYSA-N -1 3 335.806 4.328 20 0 EIADHM CCOc1ccc(S(=O)(=O)[N-]c2cc(Cl)ccc2C)c(C)c1 ZINC000501796234 1035611187 /nfs/dbraw/zinc/61/11/87/1035611187.db2.gz KOPYCKMWZKPSKB-UHFFFAOYSA-N -1 3 339.844 4.156 20 0 EIADHM CCCCS[C@H](C)C(=O)Nc1n[n-]c(-c2cc3ccccc3o2)n1 ZINC000485125020 1035718517 /nfs/dbraw/zinc/71/85/17/1035718517.db2.gz YMVXSHVINPHTLW-LLVKDONJSA-N -1 3 344.440 4.078 20 0 EIADHM CC(C)(C)[C@H]1OCCC[C@@H]1CNC(=O)c1cc([O-])c2ccccc2c1 ZINC000575222425 1035727988 /nfs/dbraw/zinc/72/79/88/1035727988.db2.gz AEHRSXXTLITWMA-BEFAXECRSA-N -1 3 341.451 4.117 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)N1CC[C@@H](c2ccccc2F)C1 ZINC000502127459 1035857870 /nfs/dbraw/zinc/85/78/70/1035857870.db2.gz MQUBXJLOFCNGIZ-OAHLLOKOSA-N -1 3 345.389 4.009 20 0 EIADHM CCc1ccccc1NC(=O)c1c[n-]c(=NC(=O)OC(C)(C)C)s1 ZINC000905746967 1035873672 /nfs/dbraw/zinc/87/36/72/1035873672.db2.gz GHZJRTMZXOEOFV-UHFFFAOYSA-N -1 3 347.440 4.305 20 0 EIADHM O=C([O-])c1ccccc1CN1CCC[C@@H](Oc2ccccc2Cl)C1 ZINC000570934208 1035888134 /nfs/dbraw/zinc/88/81/34/1035888134.db2.gz ZOUXEMZCGRAEFL-OAHLLOKOSA-N -1 3 345.826 4.082 20 0 EIADHM CCSc1cccc(F)c1[N-]S(=O)(=O)c1ccccc1C ZINC000571577312 1036078119 /nfs/dbraw/zinc/07/81/19/1036078119.db2.gz LTVHIZBJSOHUKF-UHFFFAOYSA-N -1 3 325.430 4.047 20 0 EIADHM COc1cc(C)c([N-]S(=O)(=O)c2cccc(Cl)c2)c(C)c1C ZINC000571556279 1036086659 /nfs/dbraw/zinc/08/66/59/1036086659.db2.gz MYWHYRCOXFMQPO-UHFFFAOYSA-N -1 3 339.844 4.075 20 0 EIADHM Cc1cc(OC(F)F)c(C(=O)[N-]c2c(C)noc2C(C)C)s1 ZINC000906275313 1036182389 /nfs/dbraw/zinc/18/23/89/1036182389.db2.gz VAIVHFUBKJOYAS-UHFFFAOYSA-N -1 3 330.356 4.330 20 0 EIADHM CCC[C@@H](C)CC(=O)Nc1cccc(-c2nc(CC)cc(=O)[n-]2)c1 ZINC000498508237 1036373979 /nfs/dbraw/zinc/37/39/79/1036373979.db2.gz SQFQWCOFJHTSIE-CYBMUJFWSA-N -1 3 327.428 4.176 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@H]3CCC[C@H](C(C)C)C3)nc2)n1 ZINC000597939943 1036402523 /nfs/dbraw/zinc/40/25/23/1036402523.db2.gz PPLDFWHWLVEDJC-YOEHRIQHSA-N -1 3 340.471 4.433 20 0 EIADHM COc1cccc(C=Cc2cc(=O)[n-]c(C3CC3)n2)c1OC(C)C ZINC000485980370 1036403810 /nfs/dbraw/zinc/40/38/10/1036403810.db2.gz GPGRYNKQTSICSU-MDZDMXLPSA-N -1 3 326.396 4.026 20 0 EIADHM O=c1cc(C=Cc2csc(-c3cccs3)n2)nc(C2CC2)[n-]1 ZINC000485982144 1036408120 /nfs/dbraw/zinc/40/81/20/1036408120.db2.gz VABCICMQMRMECT-AATRIKPKSA-N -1 3 327.434 4.415 20 0 EIADHM O=c1cc(C=Cc2cc(Cl)ccc2Cl)nc(-c2ccncc2)[n-]1 ZINC000485999988 1036418584 /nfs/dbraw/zinc/41/85/84/1036418584.db2.gz DHMCTIJAUBTQFI-HNQUOIGGSA-N -1 3 344.201 4.309 20 0 EIADHM O=C([O-])c1ccc(-c2nc(CN3CCC[C@H]4CCC[C@@H]43)cs2)cc1 ZINC000572127672 1036441012 /nfs/dbraw/zinc/44/10/12/1036441012.db2.gz NOBKQSJUNJOHKM-DYVFJYSZSA-N -1 3 342.464 4.273 20 0 EIADHM O=c1cc(C=Cc2ccc(OCc3ccncc3)cc2)nc(C2CC2)[n-]1 ZINC000486077843 1036466381 /nfs/dbraw/zinc/46/63/81/1036466381.db2.gz SMHBIOGRKOHRQU-BHQIHCQQSA-N -1 3 345.402 4.204 20 0 EIADHM Cc1c(C(=O)Nc2cc(Cl)ccc2[O-])cnn1-c1ccc(C)cc1 ZINC000588925782 1036604971 /nfs/dbraw/zinc/60/49/71/1036604971.db2.gz MYNANKZYHOHRBR-UHFFFAOYSA-N -1 3 341.798 4.100 20 0 EIADHM Cc1ccc(CSCCNC(=O)c2cc([O-])ccc2Cl)cc1 ZINC000589257521 1036719537 /nfs/dbraw/zinc/71/95/37/1036719537.db2.gz HRXRNXGIONPBDZ-UHFFFAOYSA-N -1 3 335.856 4.017 20 0 EIADHM Cc1cccc(Br)c1C(=O)Nc1ccc(Cl)cc1[O-] ZINC000486799271 1036856674 /nfs/dbraw/zinc/85/66/74/1036856674.db2.gz FOJQSALWVREFEX-UHFFFAOYSA-N -1 3 340.604 4.369 20 0 EIADHM CC(C)[C@@H]1CCCCN1Cc1coc(-c2ccc(C(=O)[O-])cc2)n1 ZINC000569611712 1036896328 /nfs/dbraw/zinc/89/63/28/1036896328.db2.gz JPMSHIRAPZHDCF-KRWDZBQOSA-N -1 3 328.412 4.050 20 0 EIADHM O=C([N-]c1nc(-c2cccc3ccccc32)cs1)c1cnns1 ZINC000054149269 1037272925 /nfs/dbraw/zinc/27/29/25/1037272925.db2.gz QLIMVOFJCPNYPN-UHFFFAOYSA-N -1 3 338.417 4.067 20 0 EIADHM CC[C@H](CSc1ccccc1)NC(=O)c1cc([O-])ccc1Cl ZINC000487974787 1037314381 /nfs/dbraw/zinc/31/43/81/1037314381.db2.gz BXDUZQJRJYHMNZ-GFCCVEGCSA-N -1 3 335.856 4.346 20 0 EIADHM CCc1ccc([O-])c(C(=O)N2CCC(c3ccc(F)c(F)c3)CC2)c1 ZINC000591463499 1037439095 /nfs/dbraw/zinc/43/90/95/1037439095.db2.gz LGKXEALQNJYLNK-UHFFFAOYSA-N -1 3 345.389 4.253 20 0 EIADHM CCCn1ncc(NC(=O)c2cc([O-])c3ccccc3c2)c1C1CC1 ZINC000573438313 1037493003 /nfs/dbraw/zinc/49/30/03/1037493003.db2.gz PJWCWNSZZRQFAI-UHFFFAOYSA-N -1 3 335.407 4.282 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1ccc(-n2cc[nH]c2=S)cc1 ZINC000171742703 1037647551 /nfs/dbraw/zinc/64/75/51/1037647551.db2.gz PAYKXRDVWQYEJV-UHFFFAOYSA-N -1 3 345.811 4.146 20 0 EIADHM [O-]C(=NO[C@@H]1CCCCO1)Nc1ccc2c(c1)oc1ccccc12 ZINC000156017522 1037898798 /nfs/dbraw/zinc/89/87/98/1037898798.db2.gz IZMQGZIZJVVHCM-QGZVFWFLSA-N -1 3 326.352 4.166 20 0 EIADHM O=C([N-]O[C@@H]1CCCCO1)Nc1ccc2c(c1)oc1ccccc12 ZINC000156017522 1037898803 /nfs/dbraw/zinc/89/88/03/1037898803.db2.gz IZMQGZIZJVVHCM-QGZVFWFLSA-N -1 3 326.352 4.166 20 0 EIADHM CSc1ccc([O-])c(C(=O)N2C[C@H](c3ccc(F)cc3)C[C@@H]2C)c1 ZINC000668944198 1037939681 /nfs/dbraw/zinc/93/96/81/1037939681.db2.gz FLPHTBUGEOYDSB-GXTWGEPZSA-N -1 3 345.439 4.271 20 0 EIADHM COc1ccc([O-])c(C(=O)Nc2ccc(-c3ccco3)cc2F)c1 ZINC000489356841 1038003074 /nfs/dbraw/zinc/00/30/74/1038003074.db2.gz GKFCAOVUWYXYMZ-UHFFFAOYSA-N -1 3 327.311 4.052 20 0 EIADHM Cc1ccc(C)c(S(=O)(=O)[N-]c2ccc(OC(C)C)c(C)c2)c1 ZINC000607616713 1038241188 /nfs/dbraw/zinc/24/11/88/1038241188.db2.gz MFGFJTINSVTQHD-UHFFFAOYSA-N -1 3 333.453 4.200 20 0 EIADHM CC(F)(F)c1ccc(CNC(=O)c2cc([O-])ccc2Cl)cc1 ZINC000490296479 1038452659 /nfs/dbraw/zinc/45/26/59/1038452659.db2.gz CNGBIXXOQQDIPO-UHFFFAOYSA-N -1 3 325.742 4.087 20 0 EIADHM CCCCCOc1ccc(S(=O)(=O)[N-]c2ccc(C)c(O)c2)cc1 ZINC000462100110 1038904345 /nfs/dbraw/zinc/90/43/45/1038904345.db2.gz GCNVEKGBJUXABB-UHFFFAOYSA-N -1 3 349.452 4.070 20 0 EIADHM CC(C)c1ccc(C(=O)N2CC[C@H](C(F)(F)F)C[C@@H]2C)c([O-])c1 ZINC000456109532 1039098172 /nfs/dbraw/zinc/09/81/72/1039098172.db2.gz DKLBUSZQYBEMHG-AAEUAGOBSA-N -1 3 329.362 4.319 20 0 EIADHM O=c1cc(C(F)(F)F)nc(CNc2ccc(-c3ccccc3)cc2)[n-]1 ZINC000534175871 1039181532 /nfs/dbraw/zinc/18/15/32/1039181532.db2.gz DHJXHGHEUXBCDX-UHFFFAOYSA-N -1 3 345.324 4.480 20 0 EIADHM Cc1nc(NCc2c(F)ccc([O-])c2F)ccc1-c1ccccc1 ZINC000552256424 1039316846 /nfs/dbraw/zinc/31/68/46/1039316846.db2.gz LAHJCPAXPHKBEL-UHFFFAOYSA-N -1 3 326.346 4.075 20 0 EIADHM CC(=O)c1cccc(NC(=O)c2ccc(Oc3ccccc3)o2)c1[O-] ZINC000552287660 1039342073 /nfs/dbraw/zinc/34/20/73/1039342073.db2.gz YVVOHTXILVNJQY-UHFFFAOYSA-N -1 3 337.331 4.232 20 0 EIADHM COc1ccc2oc(C(=O)Nc3c([O-])cccc3Cl)c(C)c2c1 ZINC000552434682 1039513228 /nfs/dbraw/zinc/51/32/28/1039513228.db2.gz VTWOVTPMKGBMEZ-UHFFFAOYSA-N -1 3 331.755 4.361 20 0 EIADHM CC1(C)C[C@H](c2ccccc2)N(C(=O)c2cc(=O)c3ccccc3[n-]2)C1 ZINC000425124565 1039781775 /nfs/dbraw/zinc/78/17/75/1039781775.db2.gz UPRXAQYJBZWKBX-LJQANCHMSA-N -1 3 346.430 4.142 20 0 EIADHM CC(C)n1cc(Cl)c(NC(=O)c2cc([O-])cc(C(F)(F)F)c2)n1 ZINC000924767438 1039789713 /nfs/dbraw/zinc/78/97/13/1039789713.db2.gz VCDHGKBNNCEUAK-UHFFFAOYSA-N -1 3 347.724 4.094 20 0 EIADHM C[C@@](Cc1ccccc1)(NC(=O)c1cc([O-])ccc1Cl)C1CC1 ZINC000457047156 1039808078 /nfs/dbraw/zinc/80/80/78/1039808078.db2.gz OXHPLMVRYHKCJB-IBGZPJMESA-N -1 3 329.827 4.187 20 0 EIADHM CC(C)[C@H]1N(C(=O)CCCc2ccc([O-])c(F)c2)CC12CCCC2 ZINC000457152425 1039855970 /nfs/dbraw/zinc/85/59/70/1039855970.db2.gz XJRHZNXNSXYTJY-LJQANCHMSA-N -1 3 333.447 4.281 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)N[C@@H](C1CCCC1)C(F)(F)F ZINC000469251992 1039878123 /nfs/dbraw/zinc/87/81/23/1039878123.db2.gz ONOMVRDZKNIJDM-INIZCTEOSA-N -1 3 347.352 4.091 20 0 EIADHM Cc1[nH]nc(-c2ccccc2)c1NC(=O)c1cc([O-])c2ccccc2c1 ZINC000487078796 1039923030 /nfs/dbraw/zinc/92/30/30/1039923030.db2.gz AKNVOPFEACMIRE-UHFFFAOYSA-N -1 3 343.386 4.496 20 0 EIADHM Cc1cc(=O)[n-]c(-c2ccc(NC(=O)CCCCC(C)(C)C)cc2)n1 ZINC000553206213 1040060818 /nfs/dbraw/zinc/06/08/18/1040060818.db2.gz VATZLNACVGNTQO-UHFFFAOYSA-N -1 3 341.455 4.290 20 0 EIADHM [O-]c1cccc(CN[C@@H]2CCCc3ccccc32)c1Br ZINC000315011373 1040236790 /nfs/dbraw/zinc/23/67/90/1040236790.db2.gz KGTUJDOLBYJMBH-OAHLLOKOSA-N -1 3 332.241 4.322 20 0 EIADHM Cc1c(S(=O)(=O)[N-]c2c(C)cccc2Cl)c2ccccc2n1C ZINC000551389362 1040255254 /nfs/dbraw/zinc/25/52/54/1040255254.db2.gz IKECZBNYTYAFDF-UHFFFAOYSA-N -1 3 348.855 4.249 20 0 EIADHM C[C@H](CC(=O)c1ccccc1F)C(=O)Nc1cc(Cl)ccc1[O-] ZINC000535441013 1040273016 /nfs/dbraw/zinc/27/30/16/1040273016.db2.gz JEZQXMDQITUEEF-SNVBAGLBSA-N -1 3 335.762 4.032 20 0 EIADHM CCCc1cc(=O)[n-]c(C(=Cc2cccc(Br)c2)CC)n1 ZINC000435336647 1040288118 /nfs/dbraw/zinc/28/81/18/1040288118.db2.gz PPDFPADSVUYCGF-LCYFTJDESA-N -1 3 347.256 4.436 20 0 EIADHM CCCc1cc(=O)[n-]c(C(=Cc2ccc(Br)cc2)CC)n1 ZINC000435339936 1040296194 /nfs/dbraw/zinc/29/61/94/1040296194.db2.gz ZDZGTTGBGKVSNL-RAXLEYEMSA-N -1 3 347.256 4.436 20 0 EIADHM CC(C)(NC(=O)CCCc1ccc([O-])c(F)c1)c1ccccc1F ZINC000553725553 1040464745 /nfs/dbraw/zinc/46/47/45/1040464745.db2.gz ZBZLXZCLKCSEHO-UHFFFAOYSA-N -1 3 333.378 4.045 20 0 EIADHM CCc1ccc(-c2nc(C[S@@](=O)c3ccc([O-])cc3)cs2)cc1 ZINC000194527231 1040592376 /nfs/dbraw/zinc/59/23/76/1040592376.db2.gz KMXYHKFFAGVOSG-HSZRJFAPSA-N -1 3 343.473 4.386 20 0 EIADHM COc1ccc([O-])c(C(=O)Nc2sc(C)nc2-c2ccccc2)c1 ZINC000539839657 1040842481 /nfs/dbraw/zinc/84/24/81/1040842481.db2.gz FKGOPNNCKYVXLF-UHFFFAOYSA-N -1 3 340.404 4.085 20 0 EIADHM CC(C)[C@H](C(=O)Nc1ccc([O-])c(C(F)(F)F)c1)c1cccnc1 ZINC000436147561 1040906270 /nfs/dbraw/zinc/90/62/70/1040906270.db2.gz NJSMODNPZDHRNC-HNNXBMFYSA-N -1 3 338.329 4.184 20 0 EIADHM CC(C)c1ccc(CN(C(=O)N=c2cc3ccccn3[n-]2)C2CC2)cc1 ZINC000554416377 1041095319 /nfs/dbraw/zinc/09/53/19/1041095319.db2.gz WUFCSVNUIUELGC-UHFFFAOYSA-N -1 3 348.450 4.076 20 0 EIADHM CCc1nc(CNC/C=C\c2cc(C)c(C)cc2C)ccc1C(=O)[O-] ZINC000903997016 1041253874 /nfs/dbraw/zinc/25/38/74/1041253874.db2.gz MNZZHJYDEJAIKH-SREVYHEPSA-N -1 3 338.451 4.070 20 0 EIADHM Cc1cc(C)c(/C=C/CNCc2cc(F)c(C(=O)[O-])c(F)c2)cc1C ZINC000904016536 1041259465 /nfs/dbraw/zinc/25/94/65/1041259465.db2.gz CJJCIXWPEAALMW-SNAWJCMRSA-N -1 3 345.389 4.391 20 0 EIADHM CCCOc1ccc(S(=O)(=O)[N-]c2c(C)cc(C)cc2C)cc1 ZINC000540206655 1041283659 /nfs/dbraw/zinc/28/36/59/1041283659.db2.gz TYONVKAPESBHIK-UHFFFAOYSA-N -1 3 333.453 4.201 20 0 EIADHM Cc1cc(F)c(CN[C@@H](CCc2ccccc2)CC(=O)[O-])c(Cl)c1 ZINC000904040790 1041295723 /nfs/dbraw/zinc/29/57/23/1041295723.db2.gz VCGTWVGZFFEVAZ-HNNXBMFYSA-N -1 3 349.833 4.353 20 0 EIADHM COc1cccc2cc(CN[C@@H](CC(=O)[O-])c3cccc(C)c3)oc21 ZINC000904042544 1041298243 /nfs/dbraw/zinc/29/82/43/1041298243.db2.gz GAROSJOTCDJQTA-KRWDZBQOSA-N -1 3 339.391 4.055 20 0 EIADHM Cc1ccc2c(c1)[nH]cc2C1=CCN(C(=O)c2ccc(C)cc2[O-])CC1 ZINC000436546021 1041323805 /nfs/dbraw/zinc/32/38/05/1041323805.db2.gz DSENLWRSJYAPKC-UHFFFAOYSA-N -1 3 346.430 4.420 20 0 EIADHM CC(C)N(Cc1cccc(C(F)(F)F)c1)C(=O)c1ccccc1[O-] ZINC000436538727 1041330424 /nfs/dbraw/zinc/33/04/24/1041330424.db2.gz JOOJNNRAABLIGK-UHFFFAOYSA-N -1 3 337.341 4.462 20 0 EIADHM CCCN(CC(F)F)C(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436541816 1041336394 /nfs/dbraw/zinc/33/63/94/1041336394.db2.gz YTNQOKZQNZKNCY-UHFFFAOYSA-N -1 3 333.378 4.100 20 0 EIADHM CCCOc1ccc(CNC(=O)c2cc([O-])ccc2Cl)c(C)c1 ZINC000505848214 1041343554 /nfs/dbraw/zinc/34/35/54/1041343554.db2.gz OAXJFGDXONSJEI-UHFFFAOYSA-N -1 3 333.815 4.073 20 0 EIADHM CC(C)c1ccc(C(=O)NCCc2ccc3ccccc3n2)c([O-])c1 ZINC000436568815 1041345463 /nfs/dbraw/zinc/34/54/63/1041345463.db2.gz ZPSPISSATGCVOC-UHFFFAOYSA-N -1 3 334.419 4.036 20 0 EIADHM COc1ccc(C(=O)N(C)[C@H]2CCC[C@H]2c2ccc(C)cc2)c([O-])c1 ZINC000436591718 1041352165 /nfs/dbraw/zinc/35/21/65/1041352165.db2.gz RDQARSDKHGXNDB-HKUYNNGSSA-N -1 3 339.435 4.118 20 0 EIADHM COc1ccc2c(c1)N(C(=O)c1ccc(C)c(C)c1[O-])CCCC2 ZINC000436588244 1041362646 /nfs/dbraw/zinc/36/26/46/1041362646.db2.gz ZPQMYAAYRVPOPD-UHFFFAOYSA-N -1 3 325.408 4.001 20 0 EIADHM CC(C)c1ccc(C(=O)N2C[C@@H](C)O[C@H](c3ccsc3)C2)c([O-])c1 ZINC000436589131 1041365024 /nfs/dbraw/zinc/36/50/24/1041365024.db2.gz VNHIYUVQVBAHEP-ACJLOTCBSA-N -1 3 345.464 4.179 20 0 EIADHM O=C(c1cc(Cc2ccccc2)ccc1[O-])N1CCc2sccc2C1 ZINC000436618143 1041365569 /nfs/dbraw/zinc/36/55/69/1041365569.db2.gz MSMRWDQCTUTHOP-UHFFFAOYSA-N -1 3 349.455 4.243 20 0 EIADHM CC(C)c1ccc([C@@H]2CCCN2C(=O)c2ccc(O)cc2[O-])cc1 ZINC000436627499 1041379925 /nfs/dbraw/zinc/37/99/25/1041379925.db2.gz WLVQXQOYRFBXHR-SFHVURJKSA-N -1 3 325.408 4.199 20 0 EIADHM CC(=O)c1ccc(C(=O)N(Cc2ccccc2)CC2CCC2)cc1[O-] ZINC000436652049 1041392340 /nfs/dbraw/zinc/39/23/40/1041392340.db2.gz ZMDTUSRNFCRUKM-UHFFFAOYSA-N -1 3 337.419 4.037 20 0 EIADHM CCn1c2ccccc2nc1-c1cc(Br)c([O-])c(OC)c1 ZINC000436657513 1041400066 /nfs/dbraw/zinc/40/00/66/1041400066.db2.gz RBVJOSLKEIGTDI-UHFFFAOYSA-N -1 3 347.212 4.200 20 0 EIADHM O=C(OCc1ccccc1)c1ccc(-c2nc(-c3ccccc3)no2)[n-]1 ZINC000904239749 1041401937 /nfs/dbraw/zinc/40/19/37/1041401937.db2.gz SPQHSUSCGPQVFW-UHFFFAOYSA-N -1 3 345.358 4.089 20 0 EIADHM COc1ccc(C(=O)N2C[C@H](C)CC[C@@H]2c2ccccc2)c([O-])c1 ZINC000436657309 1041413543 /nfs/dbraw/zinc/41/35/43/1041413543.db2.gz LDMUSYVCIGNSQM-RDTXWAMCSA-N -1 3 325.408 4.014 20 0 EIADHM [O-]c1cccnc1CNc1ncnc2sc(-c3ccccc3)cc21 ZINC000480589507 1041413792 /nfs/dbraw/zinc/41/37/92/1041413792.db2.gz UYQNKNWBQXFWKI-UHFFFAOYSA-N -1 3 334.404 4.071 20 0 EIADHM CC(C)c1ccc(C(=O)NCCc2cccc3cccnc32)c([O-])c1 ZINC000436685517 1041421718 /nfs/dbraw/zinc/42/17/18/1041421718.db2.gz BHBNGPVXMWMZMU-UHFFFAOYSA-N -1 3 334.419 4.036 20 0 EIADHM CCOCc1nc(=O)c2c3c(sc2[n-]1)C[C@H](c1ccccc1)CC3 ZINC000463230620 1041437292 /nfs/dbraw/zinc/43/72/92/1041437292.db2.gz IRVPLFDTMJTLDV-CYBMUJFWSA-N -1 3 340.448 4.206 20 0 EIADHM Cc1cc(N2CCCCCC2)ccc1NC(=O)c1c([O-])cccc1O ZINC000436716436 1041441026 /nfs/dbraw/zinc/44/10/26/1041441026.db2.gz PRDVIKXMZKOVJF-UHFFFAOYSA-N -1 3 340.423 4.039 20 0 EIADHM CCC(CC)n1ccc(C(=O)Nc2ccc([O-])c(C(F)(F)F)c2)n1 ZINC000436723075 1041444440 /nfs/dbraw/zinc/44/44/40/1041444440.db2.gz SAHYDEDEZFQCLA-UHFFFAOYSA-N -1 3 341.333 4.221 20 0 EIADHM CC(C)c1nc(CCNC(=O)c2ccc(C(C)C)cc2[O-])cs1 ZINC000436725000 1041444821 /nfs/dbraw/zinc/44/48/21/1041444821.db2.gz PFKCMMCGRMMQIA-UHFFFAOYSA-N -1 3 332.469 4.068 20 0 EIADHM CCc1ccc([O-])c(C(=O)N(C)[C@@H](CC)c2ccccc2OC)c1 ZINC000436737907 1041446980 /nfs/dbraw/zinc/44/69/80/1041446980.db2.gz KLICWRVJCRUQEQ-KRWDZBQOSA-N -1 3 327.424 4.187 20 0 EIADHM C[C@H](NC(=O)c1cc(Oc2ccccc2)ccc1[O-])c1cncs1 ZINC000436738467 1041449022 /nfs/dbraw/zinc/44/90/22/1041449022.db2.gz OBDHLNQUVDLRRO-LBPRGKRZSA-N -1 3 340.404 4.132 20 0 EIADHM CN(C(=O)c1cc(OCc2ccccc2)ccc1[O-])c1ccccc1 ZINC000436753024 1041465739 /nfs/dbraw/zinc/46/57/39/1041465739.db2.gz BTHFKJUVSCSZAG-UHFFFAOYSA-N -1 3 333.387 4.248 20 0 EIADHM CCN(C(=O)c1ccc(O)cc1[O-])C(c1ccccc1)c1ccccc1 ZINC000436781805 1041469103 /nfs/dbraw/zinc/46/91/03/1041469103.db2.gz GAMSTTBVBLDHRK-UHFFFAOYSA-N -1 3 347.414 4.350 20 0 EIADHM C[C@H]1CCN(C(=O)c2cc3c(cc2[O-])CCCC3)c2c(O)cccc21 ZINC000436817067 1041486797 /nfs/dbraw/zinc/48/67/97/1041486797.db2.gz QNBXUBSHGLLHEW-ZDUSSCGKSA-N -1 3 337.419 4.131 20 0 EIADHM Cc1ccc(C(=O)N[C@@H](C)c2ccc(-c3ccncc3)cc2)c([O-])c1 ZINC000436829166 1041495434 /nfs/dbraw/zinc/49/54/34/1041495434.db2.gz AMWBCYIXFFNMLB-HNNXBMFYSA-N -1 3 332.403 4.254 20 0 EIADHM CCN(CC)[C@H](c1nc(-c2ccc([O-])cc2F)no1)c1ccccc1 ZINC000436876288 1041532456 /nfs/dbraw/zinc/53/24/56/1041532456.db2.gz XXPZXDVBECAMOP-KRWDZBQOSA-N -1 3 341.386 4.013 20 0 EIADHM CCc1ccc(-c2nc([C@H](OC)c3ccccc3Cl)no2)c([O-])c1 ZINC000436874562 1041533533 /nfs/dbraw/zinc/53/35/33/1041533533.db2.gz WGJVBFWOKWOFKU-MRXNPFEDSA-N -1 3 344.798 4.394 20 0 EIADHM COc1ccccc1[C@@H]1CC[C@@H](C)CN1C(=O)c1ccccc1[O-] ZINC000436857683 1041534544 /nfs/dbraw/zinc/53/45/44/1041534544.db2.gz BRDZOWUCKBBGEP-PBHICJAKSA-N -1 3 325.408 4.014 20 0 EIADHM CC(C)c1ccc(C(=O)N2CC[C@@H](Cc3ccc(F)cc3)C2)c([O-])c1 ZINC000436878165 1041536112 /nfs/dbraw/zinc/53/61/12/1041536112.db2.gz ITQZLQLXELVQJR-INIZCTEOSA-N -1 3 341.426 4.360 20 0 EIADHM CCc1cccc(C(=O)N(C)Cc2cccc(OC(C)C)c2)c1[O-] ZINC000538768700 1041536374 /nfs/dbraw/zinc/53/63/74/1041536374.db2.gz UCXLWFDEUIMNIU-UHFFFAOYSA-N -1 3 327.424 4.014 20 0 EIADHM CCSc1cccc(F)c1[N-]C(=O)c1cccnc1OC(C)C ZINC000484933821 1041538649 /nfs/dbraw/zinc/53/86/49/1041538649.db2.gz HLZHTGCWCVKNER-UHFFFAOYSA-N -1 3 334.416 4.372 20 0 EIADHM COc1cccc(-c2nc(Cc3cccc4ccccc43)no2)c1[O-] ZINC000436885311 1041540784 /nfs/dbraw/zinc/54/07/84/1041540784.db2.gz CDOYYPYHICMSAM-UHFFFAOYSA-N -1 3 332.359 4.195 20 0 EIADHM COc1cccc(-c2nc(C(C)(C)c3ccc(Cl)cc3)no2)c1[O-] ZINC000436883976 1041540814 /nfs/dbraw/zinc/54/08/14/1041540814.db2.gz DQLCAPCARFGUQA-UHFFFAOYSA-N -1 3 344.798 4.430 20 0 EIADHM CC[C@H](C)Oc1ccc(-c2noc(-c3cccc(OC)c3[O-])n2)cc1 ZINC000436936329 1041565388 /nfs/dbraw/zinc/56/53/88/1041565388.db2.gz BFYUXXIJAOVBLZ-LBPRGKRZSA-N -1 3 340.379 4.295 20 0 EIADHM COc1cccc(C2=CCN(C(=O)c3ccc(C(C)C)cc3[O-])C2)c1 ZINC000436966335 1041572193 /nfs/dbraw/zinc/57/21/93/1041572193.db2.gz VOIOGEJBDJTFNK-UHFFFAOYSA-N -1 3 337.419 4.064 20 0 EIADHM C[C@@H](c1noc(-c2ccccc2[O-])n1)c1ccc(Br)cc1 ZINC000436956790 1041574805 /nfs/dbraw/zinc/57/48/05/1041574805.db2.gz PCUMVERHFRKSHP-SNVBAGLBSA-N -1 3 345.196 4.357 20 0 EIADHM [O-]c1ccc(Cc2ccccc2)cc1-c1nc(-c2cscn2)no1 ZINC000436957731 1041575034 /nfs/dbraw/zinc/57/50/34/1041575034.db2.gz WYYIPWIILNABSF-UHFFFAOYSA-N -1 3 335.388 4.157 20 0 EIADHM CC(C)c1ccc(CN(C(=O)c2ccc(O)cc2[O-])C2CC2)cc1 ZINC000436989094 1041584002 /nfs/dbraw/zinc/58/40/02/1041584002.db2.gz LQRGWZRCLCJNKA-UHFFFAOYSA-N -1 3 325.408 4.026 20 0 EIADHM COc1ccc(Cl)cc1Cc1noc(-c2ccc(C)cc2[O-])n1 ZINC000436995504 1041586193 /nfs/dbraw/zinc/58/61/93/1041586193.db2.gz IPVRJFKCTQBXRR-UHFFFAOYSA-N -1 3 330.771 4.003 20 0 EIADHM C[C@H](OC(=O)c1cc2ccsc2[n-]1)C(=O)Nc1ccc(Cl)cc1 ZINC000023346258 1042139432 /nfs/dbraw/zinc/13/94/32/1042139432.db2.gz PSZYSLHFMHHIJI-VIFPVBQESA-N -1 3 348.811 4.067 20 0 EIADHM C[C@@H]1CO[C@@H](c2cccc(Cl)c2)CN1Cc1cc([O-])cc(F)c1 ZINC000438545708 1042231807 /nfs/dbraw/zinc/23/18/07/1042231807.db2.gz KKVKUFRPQVZTJD-KZULUSFZSA-N -1 3 335.806 4.147 20 0 EIADHM O=C(c1ccc(O)cc1[O-])N1CC=C(c2cccc3ccccc32)CC1 ZINC000439061763 1042478970 /nfs/dbraw/zinc/47/89/70/1042478970.db2.gz VKFBHZDLQSTSFC-UHFFFAOYSA-N -1 3 345.398 4.181 20 0 EIADHM O=C(c1ccc(O)cc1[O-])N1Cc2ccccc2C[C@@H]1c1ccccc1 ZINC000439053042 1042483499 /nfs/dbraw/zinc/48/34/99/1042483499.db2.gz FNMWMCWGILSPCA-HXUWFJFHSA-N -1 3 345.398 4.038 20 0 EIADHM CCc1nnc(-c2ccc(NCc3c([O-])cccc3Cl)cc2)o1 ZINC000152231952 1042724502 /nfs/dbraw/zinc/72/45/02/1042724502.db2.gz YVXRAYAACXJXOR-UHFFFAOYSA-N -1 3 329.787 4.270 20 0 EIADHM Cc1ccc(C)c(OC2CCN([C@H](C)c3ccc(C(=O)[O-])o3)CC2)c1 ZINC000518990487 1042787073 /nfs/dbraw/zinc/78/70/73/1042787073.db2.gz IWPDSJGXXTUMIU-OAHLLOKOSA-N -1 3 343.423 4.199 20 0 EIADHM Cc1cccc2sc([N-]C(=O)c3c(F)c(F)cc(F)c3F)nc21 ZINC000177482468 1042839465 /nfs/dbraw/zinc/83/94/65/1042839465.db2.gz YKIXQDQUHLOKAY-UHFFFAOYSA-N -1 3 340.301 4.413 20 0 EIADHM C[C@H](C(=O)[O-])[C@@H](NCc1cnc(C2CCCC2)s1)c1ccccc1 ZINC000417559462 1042877517 /nfs/dbraw/zinc/87/75/17/1042877517.db2.gz IGPLPTYFSWTWBF-SUMWQHHRSA-N -1 3 344.480 4.352 20 0 EIADHM O=C(Nc1ccc(Br)cc1[O-])C1[C@@H]2CCCCCC[C@@H]12 ZINC001141622222 1042893213 /nfs/dbraw/zinc/89/32/13/1042893213.db2.gz HPVLQBCXXNWYCP-VXGBXAGGSA-N -1 3 338.245 4.310 20 0 EIADHM O=C(/C=C/Sc1cc(F)ccc1F)Nc1cccc([O-])c1F ZINC000493342408 1042899184 /nfs/dbraw/zinc/89/91/84/1042899184.db2.gz YAQBWYONUQXVSZ-VOTSOKGWSA-N -1 3 325.311 4.054 20 0 EIADHM COc1ccc(-c2cc(C(=O)Nc3ncccc3[O-])sc2C)cc1 ZINC000022262699 1042901967 /nfs/dbraw/zinc/90/19/67/1042901967.db2.gz GFKRMUFOAYOJKF-UHFFFAOYSA-N -1 3 340.404 4.085 20 0 EIADHM O=C([N-]c1cc(Cl)cc(F)c1F)c1occc1Br ZINC000441610307 1042919046 /nfs/dbraw/zinc/91/90/46/1042919046.db2.gz KDQLQJMYVODTEC-UHFFFAOYSA-N -1 3 336.519 4.226 20 0 EIADHM CCn1ncc(C(=O)Nc2cc(Cl)ccc2[O-])c1-c1ccccc1 ZINC000427614902 1042978202 /nfs/dbraw/zinc/97/82/02/1042978202.db2.gz KDCMAJMQFPUHHS-UHFFFAOYSA-N -1 3 341.798 4.181 20 0 EIADHM Cc1cc(C)cc(-c2cc(=NC(=O)c3sccc3Cl)[nH][n-]2)c1 ZINC000493995589 1043000420 /nfs/dbraw/zinc/00/04/20/1043000420.db2.gz FPRBRSXZSSVXBM-UHFFFAOYSA-N -1 3 331.828 4.083 20 0 EIADHM Cc1ccc(-c2nc(CN3CCCC[C@@H]3CCC(=O)[O-])cs2)cc1 ZINC000324239437 1043061545 /nfs/dbraw/zinc/06/15/45/1043061545.db2.gz AQYRPHXYBMEQFT-QGZVFWFLSA-N -1 3 344.480 4.338 20 0 EIADHM O=S(=O)(/C=C/c1ccccc1Cl)[N-]c1cc(F)cc(F)c1 ZINC000727353232 1043206322 /nfs/dbraw/zinc/20/63/22/1043206322.db2.gz PUJCQGFSHHMHQZ-AATRIKPKSA-N -1 3 329.755 4.031 20 0 EIADHM Cc1csc([C@H](NC(=O)c2cc([O-])c3ccccc3c2)C2CC2)n1 ZINC000280387367 1043226153 /nfs/dbraw/zinc/22/61/53/1043226153.db2.gz NAVWHOPGZSUTGC-QGZVFWFLSA-N -1 3 338.432 4.191 20 0 EIADHM CCC(CC)(CNC(=O)NCc1ccc([O-])c(F)c1)c1ccccc1 ZINC000465976253 1043227626 /nfs/dbraw/zinc/22/76/26/1043227626.db2.gz CQQPCXARQZIWKW-UHFFFAOYSA-N -1 3 344.430 4.089 20 0 EIADHM CC(C)CCOC1CCN(C(=O)c2cc([O-])c3ccccc3c2)CC1 ZINC000280753446 1043234070 /nfs/dbraw/zinc/23/40/70/1043234070.db2.gz IAROZVLZTNCXED-UHFFFAOYSA-N -1 3 341.451 4.213 20 0 EIADHM COc1cc(F)c(NC(=O)c2cc([O-])c3ccccc3c2)cc1F ZINC000526918010 1043245912 /nfs/dbraw/zinc/24/59/12/1043245912.db2.gz GDQBZZXOKSOFEV-UHFFFAOYSA-N -1 3 329.302 4.085 20 0 EIADHM CCCCCN(CCCOC)C(=O)c1cc([O-])c2ccccc2c1 ZINC000526923550 1043246087 /nfs/dbraw/zinc/24/60/87/1043246087.db2.gz OUVUIBHJAAQETN-UHFFFAOYSA-N -1 3 329.440 4.214 20 0 EIADHM CN(Cc1cc(F)c(F)c(F)c1)C(=O)c1cc([O-])c2ccccc2c1 ZINC000526921841 1043246443 /nfs/dbraw/zinc/24/64/43/1043246443.db2.gz LIDWSUCPWYOJPU-UHFFFAOYSA-N -1 3 345.320 4.235 20 0 EIADHM Cc1[nH]c2ccccc2c1CCNC(=O)c1cc([O-])c2ccccc2c1 ZINC000527158570 1043251142 /nfs/dbraw/zinc/25/11/42/1043251142.db2.gz KTNCPGQXBFKVQA-UHFFFAOYSA-N -1 3 344.414 4.308 20 0 EIADHM CC[C@H](NC(=O)c1cc([O-])c2ccccc2c1)c1nc2ccccc2[nH]1 ZINC000527449519 1043261504 /nfs/dbraw/zinc/26/15/04/1043261504.db2.gz NRNWSWKMPJUONW-INIZCTEOSA-N -1 3 345.402 4.303 20 0 EIADHM O=C(Nc1ccc(-c2ncc[nH]2)cc1)c1cc([O-])c2ccccc2c1 ZINC000527454410 1043263108 /nfs/dbraw/zinc/26/31/08/1043263108.db2.gz DWDUQSBAFDAHFA-UHFFFAOYSA-N -1 3 329.359 4.188 20 0 EIADHM CC(C)(C)[C@@H](NC(=O)c1cc([O-])c2ccccc2c1)C(F)(F)F ZINC000527466544 1043263134 /nfs/dbraw/zinc/26/31/34/1043263134.db2.gz WQMJYKGUBICZMG-OAHLLOKOSA-N -1 3 325.330 4.252 20 0 EIADHM Cc1ccc([C@@H]2CCN(C(=O)c3cc([O-])c4ccccc4c3)C2)cc1 ZINC000527463624 1043263431 /nfs/dbraw/zinc/26/34/31/1043263431.db2.gz ZTBKCYNBBUMXTJ-GOSISDBHSA-N -1 3 331.415 4.484 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)N1CCC[C@@H]1c1ccccc1Cl ZINC000163757037 1043265179 /nfs/dbraw/zinc/26/51/79/1043265179.db2.gz YCOSDQABIOVAFV-MRXNPFEDSA-N -1 3 348.805 4.231 20 0 EIADHM COc1ccc2c(c1)oc(C(=O)[N-]c1nonc1C)c2-c1ccccc1 ZINC000727709459 1043273704 /nfs/dbraw/zinc/27/37/04/1043273704.db2.gz NOPXLOFZMJLGCP-UHFFFAOYSA-N -1 3 349.346 4.052 20 0 EIADHM CCN(CC)C(=O)c1ccc(Nc2ccc([O-])c(Cl)c2)c(OC)c1 ZINC001212470813 1043353996 /nfs/dbraw/zinc/35/39/96/1043353996.db2.gz CGLYMWMAHFBZEE-UHFFFAOYSA-N -1 3 348.830 4.280 20 0 EIADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)[C@@H](C)C3CCCC3)c2)n1 ZINC000674082510 1043395430 /nfs/dbraw/zinc/39/54/30/1043395430.db2.gz HHONAIKJCQJTLO-ZDUSSCGKSA-N -1 3 339.439 4.176 20 0 EIADHM O=C(CCC1CCCCC1)[N-]OCc1cc(-c2ccccc2)on1 ZINC000730100474 1043447610 /nfs/dbraw/zinc/44/76/10/1043447610.db2.gz KUWFCGIZQDAFDG-UHFFFAOYSA-N -1 3 328.412 4.250 20 0 EIADHM C[C@@H](CS(=O)(=O)[N-]c1cccc(Cl)c1F)c1ccccc1 ZINC000494470929 1043508305 /nfs/dbraw/zinc/50/83/05/1043508305.db2.gz GLJFLPXUOXHMMI-NSHDSACASA-N -1 3 327.808 4.025 20 0 EIADHM CSc1ccncc1[N-]C(=O)c1csc(-c2ccc(C)cc2)n1 ZINC000674258354 1043526584 /nfs/dbraw/zinc/52/65/84/1043526584.db2.gz YISPPHMIWFBCKY-UHFFFAOYSA-N -1 3 341.461 4.488 20 0 EIADHM Cc1ccc(C)c(S(=O)(=O)[N-]c2cc(Cl)cc(F)c2F)c1 ZINC000442225418 1043555579 /nfs/dbraw/zinc/55/55/79/1043555579.db2.gz YEIXKOGEPGQJNF-UHFFFAOYSA-N -1 3 331.771 4.036 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)Nc1nccc2sccc21 ZINC000682536098 1043822838 /nfs/dbraw/zinc/82/28/38/1043822838.db2.gz GZSOWYPDCPQUEN-UHFFFAOYSA-N -1 3 330.384 4.102 20 0 EIADHM CC(C)(C)CN(Cc1ccccc1)C(=O)c1nnc2ccccc2c1[O-] ZINC000732286316 1043894766 /nfs/dbraw/zinc/89/47/66/1043894766.db2.gz FIYITYCNKZLKTL-UHFFFAOYSA-N -1 3 349.434 4.024 20 0 EIADHM O=C([N-]c1c(F)cc(Cl)cc1F)c1ccoc1Br ZINC000192806226 1043970355 /nfs/dbraw/zinc/97/03/55/1043970355.db2.gz VNUCUZLWMARRRO-UHFFFAOYSA-N -1 3 336.519 4.226 20 0 EIADHM COc1cccc(Nc2cccc([O-])c2F)c1C(=O)C(F)(F)F ZINC001212554044 1044295465 /nfs/dbraw/zinc/29/54/65/1044295465.db2.gz HMQCUQXIUORDCF-UHFFFAOYSA-N -1 3 329.249 4.029 20 0 EIADHM Cc1c(F)cccc1-c1ccc(/C=C2\C(=O)[N-]C(=O)c3ccccc32)o1 ZINC000734305711 1044527350 /nfs/dbraw/zinc/52/73/50/1044527350.db2.gz DIMYSVHQVHPERV-BOPFTXTBSA-N -1 3 347.345 4.205 20 0 EIADHM CC(=O)c1cccc(NC(=O)c2cc(Cl)cc3cccnc32)c1[O-] ZINC000673526823 1044584977 /nfs/dbraw/zinc/58/49/77/1044584977.db2.gz SJJLIJVOXOZTQT-UHFFFAOYSA-N -1 3 340.766 4.049 20 0 EIADHM Cn1c(CNc2[n-]c(=O)c(Cl)cc2Cl)ccc1C(F)(F)F ZINC001162750225 1044622522 /nfs/dbraw/zinc/62/25/22/1044622522.db2.gz IATPGZAQPWNJAN-UHFFFAOYSA-N -1 3 340.132 4.063 20 0 EIADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)CC3(C)CCCC3)c2)n1 ZINC000673551169 1044717054 /nfs/dbraw/zinc/71/70/54/1044717054.db2.gz JIRPASHLQZDWMN-UHFFFAOYSA-N -1 3 339.439 4.321 20 0 EIADHM CC(C)Cc1ccc(C(=O)CCC(=O)[N-]OCc2ccccc2)cc1 ZINC000915287549 1045247449 /nfs/dbraw/zinc/24/74/49/1045247449.db2.gz MPUREUSXHNKZLD-UHFFFAOYSA-N -1 3 339.435 4.096 20 0 EIADHM CCc1noc(C)c1[N-]C(=O)c1oc2ccccc2c1CSC ZINC000611109095 1045254196 /nfs/dbraw/zinc/25/41/96/1045254196.db2.gz XGRPBIAAXQUYFV-UHFFFAOYSA-N -1 3 330.409 4.407 20 0 EIADHM CCc1onc(C)c1[N-]C(=O)c1oc2ccccc2c1CSC ZINC000611164317 1045257551 /nfs/dbraw/zinc/25/75/51/1045257551.db2.gz UQHQRCNHCOMTLZ-UHFFFAOYSA-N -1 3 330.409 4.407 20 0 EIADHM CC(C)(C)C[C@@H](NC(=O)c1c[n-]c2ccccc2c1=O)c1ccccc1 ZINC000053809389 1045399839 /nfs/dbraw/zinc/39/98/39/1045399839.db2.gz CBBFDOWKDNYJNF-LJQANCHMSA-N -1 3 348.446 4.435 20 0 EIADHM CCOc1ccc([N-]S(=O)(=O)c2cccc(Cl)c2C)c(C)c1 ZINC000614867723 1045562172 /nfs/dbraw/zinc/56/21/72/1045562172.db2.gz OKPKASAKGLEKFP-UHFFFAOYSA-N -1 3 339.844 4.156 20 0 EIADHM CCCCC[C@H]1CCCN1Cn1[n-]c(-c2ccccn2)nc1=S ZINC000767764595 1045634009 /nfs/dbraw/zinc/63/40/09/1045634009.db2.gz YYTZYGBYSVDHBA-AWEZNQCLSA-N -1 3 331.489 4.005 20 0 EIADHM O=C(Nc1ccc(Cl)cc1[O-])c1ccc(OCC(F)(F)F)cc1 ZINC000533618403 1045639294 /nfs/dbraw/zinc/63/92/94/1045639294.db2.gz IHHWWUYLFJWXOU-UHFFFAOYSA-N -1 3 345.704 4.239 20 0 EIADHM O=C(CCCOCCc1ccccc1)Nc1ccc(Cl)cc1[O-] ZINC000533615959 1045658663 /nfs/dbraw/zinc/65/86/63/1045658663.db2.gz BCAXYEOHXQLEOX-UHFFFAOYSA-N -1 3 333.815 4.024 20 0 EIADHM COc1cc(F)c(NC(=O)c2cc3sccc3c([O-])c2)cc1OC ZINC000791358581 1045728972 /nfs/dbraw/zinc/72/89/72/1045728972.db2.gz WSMGDRWWLGENDR-UHFFFAOYSA-N -1 3 347.367 4.016 20 0 EIADHM Cc1cc(=O)[n-]c(CS[C@@H](C)c2ncc(-c3ccccc3)o2)n1 ZINC000763208028 1045741827 /nfs/dbraw/zinc/74/18/27/1045741827.db2.gz HCRLAUSMRSNMSH-LBPRGKRZSA-N -1 3 327.409 4.140 20 0 EIADHM O=C(OCc1ccc(C(F)(F)F)cn1)c1cc(Cl)c(Cl)[n-]1 ZINC000768541175 1045818513 /nfs/dbraw/zinc/81/85/13/1045818513.db2.gz SYSRNBXQCKAJCB-UHFFFAOYSA-N -1 3 339.100 4.092 20 0 EIADHM Cc1cc(S(=O)(=O)[N-]c2cc(Cl)ccc2Cl)c(C)s1 ZINC000032531875 1045821665 /nfs/dbraw/zinc/82/16/65/1045821665.db2.gz IZYIIQNISNQGMI-UHFFFAOYSA-N -1 3 336.265 4.473 20 0 EIADHM COC(=O)c1cc2cc(Nc3ccc([O-])c(F)c3F)ccc2s1 ZINC001212011078 1045832556 /nfs/dbraw/zinc/83/25/56/1045832556.db2.gz PZMVKXPEPZNRDH-UHFFFAOYSA-N -1 3 335.331 4.415 20 0 EIADHM COc1cc(Br)c(Nc2ccc([O-])c(F)c2F)cc1C ZINC001212013686 1045835005 /nfs/dbraw/zinc/83/50/05/1045835005.db2.gz DVOXBASOMJWASP-UHFFFAOYSA-N -1 3 344.155 4.494 20 0 EIADHM COc1cc(Nc2ccc([O-])c(F)c2F)c(C)cc1Br ZINC001212013975 1045835752 /nfs/dbraw/zinc/83/57/52/1045835752.db2.gz SQTJBGSHSYCSON-UHFFFAOYSA-N -1 3 344.155 4.494 20 0 EIADHM COCCCNc1cccc(F)c1Nc1ccc([O-])c(F)c1F ZINC001212016282 1045839498 /nfs/dbraw/zinc/83/94/98/1045839498.db2.gz HZRQXGBPXBSICP-UHFFFAOYSA-N -1 3 326.318 4.002 20 0 EIADHM CCOC(=O)c1cnc2cccc(Nc3ccc([O-])c(F)c3F)c2c1 ZINC001212016620 1045840993 /nfs/dbraw/zinc/84/09/93/1045840993.db2.gz ZBMULJNBFHGQAP-UHFFFAOYSA-N -1 3 344.317 4.139 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N(CCc1ccccc1)C1CC1 ZINC000792103572 1045858297 /nfs/dbraw/zinc/85/82/97/1045858297.db2.gz QDUWMJFKAPCVLE-UHFFFAOYSA-N -1 3 331.415 4.393 20 0 EIADHM CCCOc1ccc([N-]S(=O)(=O)c2ccc(CC)cc2)c(C)c1 ZINC000614883354 1045905248 /nfs/dbraw/zinc/90/52/48/1045905248.db2.gz NSSVJRSIRJWFKR-UHFFFAOYSA-N -1 3 333.453 4.147 20 0 EIADHM Cc1ccc([C@H]2CCN(C(=O)CCCc3ccc([O-])c(F)c3)C2)cc1 ZINC000530336074 1046166385 /nfs/dbraw/zinc/16/63/85/1046166385.db2.gz OUPULDHOMHNGQC-SFHVURJKSA-N -1 3 341.426 4.179 20 0 EIADHM COc1cc(C)sc1C(=O)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000125382331 1046303381 /nfs/dbraw/zinc/30/33/81/1046303381.db2.gz CEFXDIOMNMLUKJ-UHFFFAOYSA-N -1 3 331.315 4.042 20 0 EIADHM COc1cc(F)c([N-]C(=O)c2cc(-c3ccc(C)cc3)no2)cc1F ZINC000125680092 1046324346 /nfs/dbraw/zinc/32/43/46/1046324346.db2.gz LAJRUIDMFOJTJJ-UHFFFAOYSA-N -1 3 344.317 4.189 20 0 EIADHM CCCCC[C@@H](C(=O)Nc1nc2c(cccc2C(=O)OC)[n-]1)C(C)C ZINC001127417797 1046326798 /nfs/dbraw/zinc/32/67/98/1046326798.db2.gz BRGUZDQQJAJQKO-CYBMUJFWSA-N -1 3 345.443 4.141 20 0 EIADHM O=C(CCCc1cccs1)[N-]OCc1ccc(C(F)(F)F)cc1 ZINC000746522393 1046552645 /nfs/dbraw/zinc/55/26/45/1046552645.db2.gz LBSNZRNKOQYCEH-UHFFFAOYSA-N -1 3 343.370 4.338 20 0 EIADHM COc1ccc([O-])c(C(=O)N(C)c2ccc(Oc3ccccc3)cc2)c1 ZINC000533873059 1046577536 /nfs/dbraw/zinc/57/75/36/1046577536.db2.gz VQRYRFZSBDPZPW-UHFFFAOYSA-N -1 3 349.386 4.470 20 0 EIADHM [O-]c1cccc(CNc2cccc3c2OCCC3)c1Br ZINC000459431236 1046663761 /nfs/dbraw/zinc/66/37/61/1046663761.db2.gz DQUDWPVQOQUTMB-UHFFFAOYSA-N -1 3 334.213 4.092 20 0 EIADHM CC[C@@H](NCc1cccc([O-])c1Br)c1c(C)noc1C ZINC000459443710 1046674493 /nfs/dbraw/zinc/67/44/93/1046674493.db2.gz QEOFTEATCFEUKV-GFCCVEGCSA-N -1 3 339.233 4.000 20 0 EIADHM CCOc1cc(CNc2cnn(CC(C)C)c2C)cc(Cl)c1[O-] ZINC000459468392 1046703494 /nfs/dbraw/zinc/70/34/94/1046703494.db2.gz RNOGZTBNHWOEJH-UHFFFAOYSA-N -1 3 337.851 4.217 20 0 EIADHM C[C@H]1C[C@H](c2cccnc2)N(Cc2cccc([O-])c2Br)C1 ZINC000459489723 1046714998 /nfs/dbraw/zinc/71/49/98/1046714998.db2.gz UOTYIDNZCYHQPZ-SWLSCSKDSA-N -1 3 347.256 4.133 20 0 EIADHM O=C(Nc1ccc(OC(F)(F)F)cc1[O-])C(F)(F)c1ccccc1 ZINC000785657017 1046736278 /nfs/dbraw/zinc/73/62/78/1046736278.db2.gz KXTXLJKHCFRAIU-UHFFFAOYSA-N -1 3 347.239 4.021 20 0 EIADHM O=C(OCc1cc(Cl)cc2cccnc21)c1cc2occc2[n-]1 ZINC000786031086 1046803602 /nfs/dbraw/zinc/80/36/02/1046803602.db2.gz LKSFOVGDVCXIMD-UHFFFAOYSA-N -1 3 326.739 4.320 20 0 EIADHM C[C@@H](OC(=O)c1cc2occc2[n-]1)C(=O)Nc1cccc2ccccc21 ZINC000786030931 1046804042 /nfs/dbraw/zinc/80/40/42/1046804042.db2.gz JBMOBJYNHLYNFB-GFCCVEGCSA-N -1 3 348.358 4.098 20 0 EIADHM CC(C)c1ccccc1NC(=O)[C@H](C)OC(=O)c1cc2occc2[n-]1 ZINC000786029861 1046804069 /nfs/dbraw/zinc/80/40/69/1046804069.db2.gz QZBRFIZWIXMFIJ-LBPRGKRZSA-N -1 3 340.379 4.068 20 0 EIADHM O=C(OCc1csc(-c2ccc(F)cc2)n1)c1cc2occc2[n-]1 ZINC000786030867 1046804173 /nfs/dbraw/zinc/80/41/73/1046804173.db2.gz ZJJQKGMXDWKWCA-UHFFFAOYSA-N -1 3 342.351 4.381 20 0 EIADHM Cc1oc(-c2ccsc2)nc1COC(=O)c1cc2occc2[n-]1 ZINC000786031397 1046804245 /nfs/dbraw/zinc/80/42/45/1046804245.db2.gz PXCAZNRTWSBBRB-UHFFFAOYSA-N -1 3 328.349 4.143 20 0 EIADHM CC[C@@](C)(NC(=O)CCCc1ccc([O-])c(F)c1)c1ccccc1 ZINC000786918138 1046881388 /nfs/dbraw/zinc/88/13/88/1046881388.db2.gz STBSHIYNKGCPQL-HXUWFJFHSA-N -1 3 329.415 4.296 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)NC1(c2ccc(Cl)cc2)CCC1 ZINC000497784167 1047067040 /nfs/dbraw/zinc/06/70/40/1047067040.db2.gz IAXQYVNLKNQJSS-UHFFFAOYSA-N -1 3 348.805 4.063 20 0 EIADHM O=C(NCCc1cc2ccccc2[nH]1)c1cc2sccc2c([O-])c1 ZINC000788305467 1047152850 /nfs/dbraw/zinc/15/28/50/1047152850.db2.gz BHLXQUFPBIQDQB-UHFFFAOYSA-N -1 3 336.416 4.061 20 0 EIADHM COc1ccc(F)cc1[C@H](C)NC(=O)c1cc2sccc2c([O-])c1 ZINC000788283384 1047157267 /nfs/dbraw/zinc/15/72/67/1047157267.db2.gz OXNVXPUUTQLLLD-JTQLQIEISA-N -1 3 345.395 4.246 20 0 EIADHM COc1ccccc1-c1cc(C(=O)[N-]c2ccc(F)c(F)c2F)no1 ZINC000918141867 1047355584 /nfs/dbraw/zinc/35/55/84/1047355584.db2.gz YYOMHIUTLCVZSL-UHFFFAOYSA-N -1 3 348.280 4.020 20 0 EIADHM C[C@H](C(=O)Nc1ccc([O-])c(C(F)(F)F)c1)c1ccc(F)c(F)c1 ZINC000476150360 1047378546 /nfs/dbraw/zinc/37/85/46/1047378546.db2.gz JYQYDFUWIDQOJU-QMMMGPOBSA-N -1 3 345.267 4.431 20 0 EIADHM CCCC(O)(CCC)CC(=O)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000476164216 1047393194 /nfs/dbraw/zinc/39/31/94/1047393194.db2.gz QQBWSFLVBRLMDK-UHFFFAOYSA-N -1 3 333.350 4.071 20 0 EIADHM O=C(Nc1cccc([O-])c1F)c1csc(-c2ccc(F)cc2)n1 ZINC000129678009 1047465039 /nfs/dbraw/zinc/46/50/39/1047465039.db2.gz PYFWSEYUASNWGI-UHFFFAOYSA-N -1 3 332.331 4.046 20 0 EIADHM O=C(/C=C/c1csc(Br)c1)Nc1cccc([O-])c1F ZINC000129749346 1047500696 /nfs/dbraw/zinc/50/06/96/1047500696.db2.gz ODUMSTDXQWCBTI-SNAWJCMRSA-N -1 3 342.189 4.007 20 0 EIADHM Fc1ccccc1[N-]c1nnc(SCOC2CCCC2)s1 ZINC000808012459 1047583599 /nfs/dbraw/zinc/58/35/99/1047583599.db2.gz OYJBMPRPJSTQLJ-UHFFFAOYSA-N -1 3 325.434 4.430 20 0 EIADHM CC(C)[C@H](OC(=O)c1cc2ccsc2[n-]1)C(=O)c1ccccc1 ZINC000918939609 1047704873 /nfs/dbraw/zinc/70/48/73/1047704873.db2.gz HEMDPXXEKBXJIT-INIZCTEOSA-N -1 3 327.405 4.294 20 0 EIADHM Cc1ccc([N-]S(=O)(=O)c2ccc(CC(C)C)cc2)c(C)c1O ZINC000071977222 1047819742 /nfs/dbraw/zinc/81/97/42/1047819742.db2.gz VIYLEUPQELMBMN-UHFFFAOYSA-N -1 3 333.453 4.008 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2ccc(F)c(C(F)(F)F)c2)cc1C ZINC000072043240 1047824498 /nfs/dbraw/zinc/82/44/98/1047824498.db2.gz RSQSEHFKXHMXNT-UHFFFAOYSA-N -1 3 347.333 4.262 20 0 EIADHM [O-]C(=NO[C@@H]1CCCCO1)Nc1ccc(SC2CCCC2)cc1 ZINC000154983353 1047843142 /nfs/dbraw/zinc/84/31/42/1047843142.db2.gz JRVYAVCHHSHAIH-MRXNPFEDSA-N -1 3 336.457 4.301 20 0 EIADHM O=C([N-]O[C@@H]1CCCCO1)Nc1ccc(SC2CCCC2)cc1 ZINC000154983353 1047843146 /nfs/dbraw/zinc/84/31/46/1047843146.db2.gz JRVYAVCHHSHAIH-MRXNPFEDSA-N -1 3 336.457 4.301 20 0 EIADHM O=C(OCc1cccc(OC(F)F)c1)c1cc(Cl)c(Cl)[n-]1 ZINC000747925732 1047904626 /nfs/dbraw/zinc/90/46/26/1047904626.db2.gz IKWXNPAURAFWAY-UHFFFAOYSA-N -1 3 336.121 4.280 20 0 EIADHM CC(F)(F)C(=O)[N-]CC1(c2cc(C(F)(F)F)ccc2Cl)CC1 ZINC000808467329 1047976713 /nfs/dbraw/zinc/97/67/13/1047976713.db2.gz ZBSITJQVTGUQGN-UHFFFAOYSA-N -1 3 341.707 4.162 20 0 EIADHM Cc1ccc([O-])c(C(=O)Nc2ccnn2[C@H]2CCCc3ccccc32)c1 ZINC001143720382 1048163522 /nfs/dbraw/zinc/16/35/22/1048163522.db2.gz BQGVXPLNENNOKX-SFHVURJKSA-N -1 3 347.418 4.075 20 0 EIADHM Cc1cccc(N(C)C(=O)c2cc(Oc3ccccc3)ccc2[O-])n1 ZINC000556950476 1048299387 /nfs/dbraw/zinc/29/93/87/1048299387.db2.gz ZTLFKXXBCPBYBI-UHFFFAOYSA-N -1 3 334.375 4.165 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)[C@H]1C[C@H]1c1cccc2ccccc21 ZINC000132666832 1048404532 /nfs/dbraw/zinc/40/45/32/1048404532.db2.gz VAXYOYNZFCLSDO-ROUUACIJSA-N -1 3 335.378 4.104 20 0 EIADHM Cc1cc(-c2csc(NC(=O)c3cc(C)ccc3[O-])n2)c(C)o1 ZINC001144394816 1048629477 /nfs/dbraw/zinc/62/94/77/1048629477.db2.gz WWSHMDAAISDIOY-UHFFFAOYSA-N -1 3 328.393 4.286 20 0 EIADHM Cc1cccc([O-])c1C(=O)NCC(c1ccccc1)c1ccccc1 ZINC001135464731 1048741648 /nfs/dbraw/zinc/74/16/48/1048741648.db2.gz QBQJZVVZJFUJPB-UHFFFAOYSA-N -1 3 331.415 4.263 20 0 EIADHM C[C@H]1C[C@@H]1c1ccc(C[N-]C(=O)C(F)(F)c2cccc(Cl)c2)o1 ZINC000921004284 1048835597 /nfs/dbraw/zinc/83/55/97/1048835597.db2.gz CNIMXMYTHOGUOW-HZMBPMFUSA-N -1 3 339.769 4.465 20 0 EIADHM CC(C)c1nsc(COC(=O)c2cc3cc(Cl)sc3[n-]2)n1 ZINC000810675029 1048844460 /nfs/dbraw/zinc/84/44/60/1048844460.db2.gz KUZVHWLREQKIPU-UHFFFAOYSA-N -1 3 341.845 4.215 20 0 EIADHM C/C(=C/CN(C)[C@@H](C)c1sc(-c2ccccc2)nc1C)C(=O)[O-] ZINC000846250679 1048849983 /nfs/dbraw/zinc/84/99/83/1048849983.db2.gz QFXQYNIZUFTJKB-HCYCVZQXSA-N -1 3 330.453 4.142 20 0 EIADHM Cc1nc(C(C)C)sc1[C@H](C)N(C)Cc1ccccc1CC(=O)[O-] ZINC000846258377 1048852023 /nfs/dbraw/zinc/85/20/23/1048852023.db2.gz QISAJQFCMDDJKV-AWEZNQCLSA-N -1 3 346.496 4.395 20 0 EIADHM O=C([O-])CC[C@@H]1CCCCN1Cc1ncc(-c2ccccc2)s1 ZINC000846280410 1048852995 /nfs/dbraw/zinc/85/29/95/1048852995.db2.gz DPTJDJNVGTWWCD-HNNXBMFYSA-N -1 3 330.453 4.029 20 0 EIADHM CC(=O)c1ccc(C(=O)N[C@H](c2ccc(Cl)cc2)C2CC2)cc1[O-] ZINC001135689567 1048859153 /nfs/dbraw/zinc/85/91/53/1048859153.db2.gz HWFMCCNJFJITQV-SFHVURJKSA-N -1 3 343.810 4.129 20 0 EIADHM C[C@]1(CCNC(=O)c2cc3sccc3c([O-])c2)C[C@@]1(F)Cl ZINC000846401270 1048861314 /nfs/dbraw/zinc/86/13/14/1048861314.db2.gz SOOIIRLUSUNRRK-GJZGRUSLSA-N -1 3 327.808 4.041 20 0 EIADHM CC1(C)CN(C(=O)c2cc3sccc3c([O-])c2)[C@@H]1c1cccnc1 ZINC000816802702 1048863640 /nfs/dbraw/zinc/86/36/40/1048863640.db2.gz VQDNNKOPYSKWQP-QGZVFWFLSA-N -1 3 338.432 4.225 20 0 EIADHM CSc1cccnc1[N-]C(=O)c1cc(Cl)nc(C(F)(F)F)c1 ZINC001144820595 1048863626 /nfs/dbraw/zinc/86/36/26/1048863626.db2.gz JMMAHXBOOCJTRL-UHFFFAOYSA-N -1 3 347.749 4.123 20 0 EIADHM CSc1cccnc1[N-]C(=O)c1cc(C)c(Br)s1 ZINC001144820325 1048863736 /nfs/dbraw/zinc/86/37/36/1048863736.db2.gz FNTGJDJKVUPAHA-UHFFFAOYSA-N -1 3 343.271 4.188 20 0 EIADHM CC[C@H](C)CO[N-]C(=O)[C@H]1CC=CC[C@H]1c1nc2ccccc2s1 ZINC000816976802 1048883855 /nfs/dbraw/zinc/88/38/55/1048883855.db2.gz KFQDPQMXXURSSI-SOUVJXGZSA-N -1 3 344.480 4.440 20 0 EIADHM Cc1sc2[n-]c([C@H](C)OC(=O)[C@@H]3CC[C@@H]4C[C@@H]4C3)nc(=O)c2c1C ZINC000817200802 1048912061 /nfs/dbraw/zinc/91/20/61/1048912061.db2.gz ILPCOQDXFDUZLN-WKSBVSIWSA-N -1 3 346.452 4.054 20 0 EIADHM C[C@@H]1CCc2ccccc2N1C(=O)CCCc1ccc([O-])c(F)c1 ZINC001135896721 1048957514 /nfs/dbraw/zinc/95/75/14/1048957514.db2.gz JXOQWIZGVWVKAI-CQSZACIVSA-N -1 3 327.399 4.222 20 0 EIADHM CC(F)(F)c1ccc(C[N-]C(=O)C(F)(F)c2ccccc2F)cc1 ZINC000817462191 1048973092 /nfs/dbraw/zinc/97/30/92/1048973092.db2.gz HYXUNKHMGWKLOM-UHFFFAOYSA-N -1 3 343.295 4.346 20 0 EIADHM CCc1cccc(C(=O)N2CCCC[C@H]2Cc2ccccc2F)c1[O-] ZINC001146201542 1049009192 /nfs/dbraw/zinc/00/91/92/1049009192.db2.gz QWUDSGDXWVMYDZ-KRWDZBQOSA-N -1 3 341.426 4.331 20 0 EIADHM Cc1ccc(C(=O)N[C@H](C)c2nc(-c3ccccc3)cs2)c([O-])c1 ZINC000078554398 1049250957 /nfs/dbraw/zinc/25/09/57/1049250957.db2.gz LUEPESPHXAFNSG-CYBMUJFWSA-N -1 3 338.432 4.315 20 0 EIADHM CCO[C@H]1C[C@H](NC(=O)c2cc([O-])c3ccccc3c2)C12CCCC2 ZINC001148553448 1049333452 /nfs/dbraw/zinc/33/34/52/1049333452.db2.gz QFPIATYCZMHFHA-OALUTQOASA-N -1 3 339.435 4.013 20 0 EIADHM CCc1ccc(C(=O)N[C@@H]2CC(C)(C)Cc3oc(C)cc32)c([O-])c1 ZINC001136256401 1049359046 /nfs/dbraw/zinc/35/90/46/1049359046.db2.gz YJOCUJGZPCUKPB-MRXNPFEDSA-N -1 3 327.424 4.300 20 0 EIADHM O=C(CCCc1cc(Cl)sc1Cl)[N-]OC/C=C/Cl ZINC000812400477 1049451194 /nfs/dbraw/zinc/45/11/94/1049451194.db2.gz MNPIWCAIXXPDEY-GORDUTHDSA-N -1 3 328.648 4.178 20 0 EIADHM O=C(C[C@H](Cc1ccccc1)c1ccccc1)[N-]OC/C=C\Cl ZINC000812403916 1049451810 /nfs/dbraw/zinc/45/18/10/1049451810.db2.gz UEVLTMNSTFGJAW-IKPBFSQCSA-N -1 3 329.827 4.203 20 0 EIADHM CSc1ccc([O-])c(C(=O)N2CCC[C@@H]2c2cccc(F)c2)c1 ZINC001136329803 1049478140 /nfs/dbraw/zinc/47/81/40/1049478140.db2.gz OUEFZWUJMXQVPR-MRXNPFEDSA-N -1 3 331.412 4.231 20 0 EIADHM CC(C)[C@H](SCc1ccccc1)C(=O)NCc1ccc([O-])c(F)c1 ZINC000610011826 1049491169 /nfs/dbraw/zinc/49/11/69/1049491169.db2.gz TYGANSQASINAEE-SFHVURJKSA-N -1 3 347.455 4.106 20 0 EIADHM O=C1[N-]C(=O)C(=CNc2ccccc2-c2cccs2)c2ccccc21 ZINC000812547871 1049511372 /nfs/dbraw/zinc/51/13/72/1049511372.db2.gz DWNJQGYLOFXRJA-VBKFSLOCSA-N -1 3 346.411 4.138 20 0 EIADHM CC(C)(C)c1ncc(/C=C\C(=O)Nc2c([O-])cccc2Cl)s1 ZINC000820511032 1049517937 /nfs/dbraw/zinc/51/79/37/1049517937.db2.gz VNPJBEKKQGQHOE-FPLPWBNLSA-N -1 3 336.844 4.452 20 0 EIADHM CN(CC1CCCC1)C(=O)c1cc(CCc2ccccc2)ccc1[O-] ZINC001136435564 1049625461 /nfs/dbraw/zinc/62/54/61/1049625461.db2.gz OLMAYYVIDSKUIW-UHFFFAOYSA-N -1 3 337.463 4.440 20 0 EIADHM CCc1cc(=O)[n-]c(CN2CC3(CCCCC3)[C@H]2c2ccccc2)n1 ZINC001170966684 1049643269 /nfs/dbraw/zinc/64/32/69/1049643269.db2.gz GOUOVSJVZLOISB-HXUWFJFHSA-N -1 3 337.467 4.252 20 0 EIADHM CCC[C@H]1CCCC[C@H]1NC(=O)c1c[n-]c2c(Cl)cccc2c1=O ZINC001136622266 1049790436 /nfs/dbraw/zinc/79/04/36/1049790436.db2.gz CZRCAHFKBOIZHY-BLLLJJGKSA-N -1 3 346.858 4.270 20 0 EIADHM CCC[C@H]1CCCC[C@@H]1NC(=O)c1c[n-]c2c(Cl)cccc2c1=O ZINC001136622267 1049790797 /nfs/dbraw/zinc/79/07/97/1049790797.db2.gz CZRCAHFKBOIZHY-LRDDRELGSA-N -1 3 346.858 4.270 20 0 EIADHM O=C(NCCc1cccc2cccnc21)c1cc2sccc2c([O-])c1 ZINC001136698181 1049834723 /nfs/dbraw/zinc/83/47/23/1049834723.db2.gz XXFXAKKUMYEBCW-UHFFFAOYSA-N -1 3 348.427 4.128 20 0 EIADHM CCc1cccc(C(=O)Nc2cccc(Oc3ccncc3)c2)c1[O-] ZINC001136730535 1049853818 /nfs/dbraw/zinc/85/38/18/1049853818.db2.gz SYGDVMDVAXNHHF-UHFFFAOYSA-N -1 3 334.375 4.394 20 0 EIADHM CSc1ccc([O-])c(C(=O)N2CC[C@@](C)(c3cccc(F)c3)C2)c1 ZINC000616516690 1049903248 /nfs/dbraw/zinc/90/32/48/1049903248.db2.gz NCEONYLYDRXDFO-LJQANCHMSA-N -1 3 345.439 4.057 20 0 EIADHM CC(C)CCc1nnc([N-]C(=O)c2csc(-c3ccoc3)n2)s1 ZINC000617096526 1049949823 /nfs/dbraw/zinc/94/98/23/1049949823.db2.gz YCJVESRONKLEKJ-UHFFFAOYSA-N -1 3 348.453 4.096 20 0 EIADHM Cc1cccc(C)c1[C@H]1CCCN1C(=O)c1cc(=O)c2ccccc2[n-]1 ZINC000617176027 1049963300 /nfs/dbraw/zinc/96/33/00/1049963300.db2.gz UTUQEBWWXXJOSE-LJQANCHMSA-N -1 3 346.430 4.122 20 0 EIADHM O=c1cc(Nc2ccc(CNc3ccccc3)cc2)nc(C2CC2)[n-]1 ZINC001212297856 1049992854 /nfs/dbraw/zinc/99/28/54/1049992854.db2.gz JARPKBBIVIJUND-UHFFFAOYSA-N -1 3 332.407 4.415 20 0 EIADHM Cc1cc(F)c([N-]S(=O)(=O)c2cccc(F)c2C)cc1Cl ZINC001185836447 1050167805 /nfs/dbraw/zinc/16/78/05/1050167805.db2.gz MQRKBQDWIRTKST-UHFFFAOYSA-N -1 3 331.771 4.036 20 0 EIADHM CC(=O)Oc1ccc(NC(=O)c2cccc(C)c2[O-])c2ccccc12 ZINC001150094094 1050176969 /nfs/dbraw/zinc/17/69/69/1050176969.db2.gz KAZKNSDAXLSBSO-UHFFFAOYSA-N -1 3 335.359 4.031 20 0 EIADHM C[C@H](CCc1ccccc1)C(=O)Nc1cc(Br)ccc1[O-] ZINC001186023141 1050217217 /nfs/dbraw/zinc/21/72/17/1050217217.db2.gz WOAIYMMYJGNBHD-GFCCVEGCSA-N -1 3 348.240 4.362 20 0 EIADHM [O-]c1cncc(-c2nc(-c3ccc(Oc4ccc(F)cc4)cc3)no2)c1 ZINC001212708650 1050329277 /nfs/dbraw/zinc/32/92/77/1050329277.db2.gz NIDRQVCDYDSEQR-UHFFFAOYSA-N -1 3 349.321 4.436 20 0 EIADHM COc1c(Cl)cc(C(=O)Nc2ccc(F)c([O-])c2)cc1Cl ZINC001187916068 1050641222 /nfs/dbraw/zinc/64/12/22/1050641222.db2.gz VTNKXIHOJIMIHH-UHFFFAOYSA-N -1 3 330.142 4.099 20 0 EIADHM C[C@H](NCc1cccc([O-])c1Br)c1cc2cnccc2o1 ZINC001179429520 1050689732 /nfs/dbraw/zinc/68/97/32/1050689732.db2.gz DCVBSMUPXWWKIE-JTQLQIEISA-N -1 3 347.212 4.147 20 0 EIADHM Cc1cc(CSc2nnc([N-]c3ccccc3F)s2)sn1 ZINC001188114363 1050701722 /nfs/dbraw/zinc/70/17/22/1050701722.db2.gz GCDBDEKBAMZMKF-UHFFFAOYSA-N -1 3 338.458 4.478 20 0 EIADHM Cc1cc(=O)[n-]c(CSc2nc3ccccc3n2CCC(C)C)n1 ZINC001188143617 1050710986 /nfs/dbraw/zinc/71/09/86/1050710986.db2.gz BLDKBLNACNTHNS-UHFFFAOYSA-N -1 3 342.468 4.179 20 0 EIADHM COc1ccc(OC)c(NC(=O)Nc2ccc(C)c([O-])c2Cl)c1 ZINC001188345580 1050749096 /nfs/dbraw/zinc/74/90/96/1050749096.db2.gz CYGSFSQVNMJIEP-UHFFFAOYSA-N -1 3 336.775 4.015 20 0 EIADHM Cc1ccc(Nc2ccc(C(=O)NCC(C)C)cc2)c(Cl)c1[O-] ZINC001174078863 1050752896 /nfs/dbraw/zinc/75/28/96/1050752896.db2.gz MOTJQXGULYNPQQ-UHFFFAOYSA-N -1 3 332.831 4.483 20 0 EIADHM [O-]c1c(F)cc(Br)cc1Nc1cccc(-n2cccn2)c1 ZINC001174302342 1050870822 /nfs/dbraw/zinc/87/08/22/1050870822.db2.gz ABPGWFNVWCXCMF-UHFFFAOYSA-N -1 3 348.175 4.223 20 0 EIADHM O=C([N-]OC1CCCC1)C12C[C@H]3C[C@@H](C1)CC(C(F)(F)F)(C3)C2 ZINC000775280232 1051033691 /nfs/dbraw/zinc/03/36/91/1051033691.db2.gz PDIVMFJJBZUBEO-RJAIZQQDSA-N -1 3 331.378 4.126 20 0 EIADHM Cc1cc(S(=O)(=O)[N-]C[C@@H]2CCC[C@H](C)[C@H]2C)sc1Cl ZINC001189793724 1051066925 /nfs/dbraw/zinc/06/69/25/1051066925.db2.gz LSHYNRZLWLYPHK-WCQGTBRESA-N -1 3 335.922 4.061 20 0 EIADHM Cc1cc([N-]S(=O)(=O)Cc2ccc(F)cc2F)c(F)cc1Cl ZINC001189824795 1051071490 /nfs/dbraw/zinc/07/14/90/1051071490.db2.gz NNKPWEGRFLSLSB-UHFFFAOYSA-N -1 3 349.761 4.008 20 0 EIADHM Cc1ccc(CSc2nc(NC(=O)[C@H](C)CC(C)C)n[n-]2)cc1 ZINC001180843182 1051087344 /nfs/dbraw/zinc/08/73/44/1051087344.db2.gz MAWAMHIGEQLFQP-CYBMUJFWSA-N -1 3 332.473 4.026 20 0 EIADHM CCOC(=O)Cc1ccc(Nc2c(F)cc([O-])cc2F)c(Cl)c1 ZINC001175099410 1051345842 /nfs/dbraw/zinc/34/58/42/1051345842.db2.gz FOOWLKJAKIYRTE-UHFFFAOYSA-N -1 3 341.741 4.173 20 0 EIADHM CCOC(=O)c1nc(C)oc1[N-]C(=O)Nc1ccc(C(C)(C)C)cc1 ZINC001191131339 1051377461 /nfs/dbraw/zinc/37/74/61/1051377461.db2.gz GXMPJNWMPVUCDN-UHFFFAOYSA-N -1 3 345.399 4.101 20 0 EIADHM CCCCc1ccc(S(=O)(=O)[N-]c2ccnc(C3CC3)c2)cc1 ZINC001191233634 1051406630 /nfs/dbraw/zinc/40/66/30/1051406630.db2.gz XWLYMOGPBGFQJF-UHFFFAOYSA-N -1 3 330.453 4.102 20 0 EIADHM Cc1ccc(Oc2ccc(NC([O-])=NO[C@H]3CCCCO3)cc2)cc1 ZINC000775449323 1051433458 /nfs/dbraw/zinc/43/34/58/1051433458.db2.gz BOGOVZOPNXJYMO-SFHVURJKSA-N -1 3 342.395 4.367 20 0 EIADHM Cc1ccc(Oc2ccc(NC(=O)[N-]O[C@H]3CCCCO3)cc2)cc1 ZINC000775449323 1051433463 /nfs/dbraw/zinc/43/34/63/1051433463.db2.gz BOGOVZOPNXJYMO-SFHVURJKSA-N -1 3 342.395 4.367 20 0 EIADHM O=C(Nc1c[nH]nc1-c1ccccc1)c1cc2sccc2c([O-])c1 ZINC000774067254 1051438499 /nfs/dbraw/zinc/43/84/99/1051438499.db2.gz SVZGBLRTQIBISR-UHFFFAOYSA-N -1 3 335.388 4.249 20 0 EIADHM CC1(C)CCC(C)(C[N-]S(=O)(=O)c2cccc(Cl)c2F)CC1 ZINC001191397146 1051439473 /nfs/dbraw/zinc/43/94/73/1051439473.db2.gz WJGUMAYPSLZFPN-UHFFFAOYSA-N -1 3 347.883 4.364 20 0 EIADHM [O-]c1ccc(F)c(Nc2cnc(Br)c(Cl)c2)c1F ZINC001175263219 1051500232 /nfs/dbraw/zinc/50/02/32/1051500232.db2.gz HHMRPFGWYGJIAF-UHFFFAOYSA-N -1 3 335.535 4.225 20 0 EIADHM [O-]c1ccc(F)c(Nc2nc(Cl)ccc2Br)c1F ZINC001175263568 1051500093 /nfs/dbraw/zinc/50/00/93/1051500093.db2.gz KWKFKNGBRUELFI-UHFFFAOYSA-N -1 3 335.535 4.225 20 0 EIADHM COC(=O)c1ccc(-c2cccc(Nc3c(F)ccc([O-])c3F)c2)o1 ZINC001175264226 1051500608 /nfs/dbraw/zinc/50/06/08/1051500608.db2.gz CHZHQAFNODRPEI-UHFFFAOYSA-N -1 3 345.301 4.461 20 0 EIADHM [O-]c1ccc(F)c(Nc2ncccc2OCc2ccccc2)c1F ZINC001175262040 1051501253 /nfs/dbraw/zinc/50/12/53/1051501253.db2.gz YUYSMIKGUOLYPS-UHFFFAOYSA-N -1 3 328.318 4.388 20 0 EIADHM O=C(NC1CCCCC1)c1cccc(Nc2c(F)ccc([O-])c2F)c1 ZINC001175268352 1051502697 /nfs/dbraw/zinc/50/26/97/1051502697.db2.gz KWRMZPISJCECAT-UHFFFAOYSA-N -1 3 346.377 4.477 20 0 EIADHM CN(C)[C@@H]1CCOc2c(Nc3ccc(C(=O)[O-])c(Cl)c3)cccc21 ZINC001175319797 1051530201 /nfs/dbraw/zinc/53/02/01/1051530201.db2.gz AEKCYAAJECVLPM-MRXNPFEDSA-N -1 3 346.814 4.167 20 0 EIADHM [O-]C(=NO[C@H]1CCCCO1)Nc1ccc(-c2ccccc2)cc1F ZINC000775489302 1051577334 /nfs/dbraw/zinc/57/73/34/1051577334.db2.gz XTAAIZVRNYOLIF-KRWDZBQOSA-N -1 3 330.359 4.072 20 0 EIADHM O=C([N-]O[C@H]1CCCCO1)Nc1ccc(-c2ccccc2)cc1F ZINC000775489302 1051577349 /nfs/dbraw/zinc/57/73/49/1051577349.db2.gz XTAAIZVRNYOLIF-KRWDZBQOSA-N -1 3 330.359 4.072 20 0 EIADHM c1cc(Nc2ccc(-c3nn[n-]n3)cc2)cc2c1OC1(CCCCC1)O2 ZINC001175429385 1051587272 /nfs/dbraw/zinc/58/72/72/1051587272.db2.gz JLVSHXCSYSWLGS-UHFFFAOYSA-N -1 3 349.394 4.042 20 0 EIADHM Cc1nc(-c2ccc(Nc3ccc(-c4nn[n-]n4)cc3)cc2)cs1 ZINC001175429374 1051588835 /nfs/dbraw/zinc/58/88/35/1051588835.db2.gz IZACGFBXICNKTO-UHFFFAOYSA-N -1 3 334.408 4.042 20 0 EIADHM Cc1c2ccccc2oc1[C@H](C)NC(=O)NCc1ccc([O-])c(F)c1 ZINC000157106257 1051599532 /nfs/dbraw/zinc/59/95/32/1051599532.db2.gz GDJFTKAHZVHNCS-LBPRGKRZSA-N -1 3 342.370 4.146 20 0 EIADHM CCCCOc1ccc(C(=O)NCCc2ccc(C)cc2C)c([O-])c1 ZINC001182474854 1051616618 /nfs/dbraw/zinc/61/66/18/1051616618.db2.gz UTBYHIHQKJDZNW-UHFFFAOYSA-N -1 3 341.451 4.160 20 0 EIADHM Cc1cc(CC(=O)Nc2ccc(F)c([O-])c2)cc(C(F)(F)F)c1 ZINC001182673132 1051663632 /nfs/dbraw/zinc/66/36/32/1051663632.db2.gz AOFIIFSLILEFSZ-UHFFFAOYSA-N -1 3 327.277 4.040 20 0 EIADHM Cc1ccc(C(=O)Nc2cc(CCc3ccccc3)ccn2)c([O-])c1 ZINC001182879252 1051728987 /nfs/dbraw/zinc/72/89/87/1051728987.db2.gz TXVGYFZOOUOHTK-UHFFFAOYSA-N -1 3 332.403 4.133 20 0 EIADHM COc1cccc([C@H](C)NC(=O)Nc2cc3ccccc3cc2[O-])c1 ZINC001192882183 1051833259 /nfs/dbraw/zinc/83/32/59/1051833259.db2.gz ATCJKVSHLJPPSG-ZDUSSCGKSA-N -1 3 336.391 4.437 20 0 EIADHM O=C(Nc1ccc(C(F)(F)F)cc1[O-])N[C@@H]1CCc2ccccc21 ZINC001192995220 1051843147 /nfs/dbraw/zinc/84/31/47/1051843147.db2.gz ISTJITFILWXIGC-CYBMUJFWSA-N -1 3 336.313 4.220 20 0 EIADHM [O-]c1cccc(Nc2ccccc2OC(F)F)c1Br ZINC001176014281 1051874832 /nfs/dbraw/zinc/87/48/32/1051874832.db2.gz HJSGPQNJHQILOL-UHFFFAOYSA-N -1 3 330.128 4.500 20 0 EIADHM CC(C)CCc1ccccc1[N-]S(=O)(=O)c1ccc2c(c1)CCO2 ZINC000621548525 1051891412 /nfs/dbraw/zinc/89/14/12/1051891412.db2.gz NQKKMJFMWGLTAJ-UHFFFAOYSA-N -1 3 345.464 4.011 20 0 EIADHM CCOC(=O)c1ncsc1[N-]c1c(F)ccc2ccc(C)nc21 ZINC001176115353 1051916883 /nfs/dbraw/zinc/91/68/83/1051916883.db2.gz YDHANCXQRQISLW-UHFFFAOYSA-N -1 3 331.372 4.059 20 0 EIADHM CC(C)c1ccc([N-]S(=O)(=O)CC2CCC2)c(C(F)(F)F)c1 ZINC001193524057 1051944038 /nfs/dbraw/zinc/94/40/38/1051944038.db2.gz WOVHVVVLKOPIBT-UHFFFAOYSA-N -1 3 335.391 4.371 20 0 EIADHM C/C=C/C[C@H]1CCCN(C(=O)c2ccc(OCCCC)cc2[O-])C1 ZINC001184099593 1051947844 /nfs/dbraw/zinc/94/78/44/1051947844.db2.gz YIUJJIBYHWMGIJ-WMHVBEDNSA-N -1 3 331.456 4.390 20 0 EIADHM C[C@@H](NC(=O)c1ccc([O-])cc1C(F)(F)F)c1cc(F)cc(F)c1 ZINC001193758228 1051991055 /nfs/dbraw/zinc/99/10/55/1051991055.db2.gz MMRZOGWCQCOXSG-MRVPVSSYSA-N -1 3 345.267 4.180 20 0 EIADHM Cc1cc(O)cc([O-])c1C(=O)N[C@H](c1ccccc1)C1CCCC1 ZINC001193945994 1052043578 /nfs/dbraw/zinc/04/35/78/1052043578.db2.gz LZPFWTLNDCTKAX-LJQANCHMSA-N -1 3 325.408 4.068 20 0 EIADHM [O-]c1c(F)cc(Br)cc1Nc1cc(O)cc(Cl)c1 ZINC001176625881 1052146946 /nfs/dbraw/zinc/14/69/46/1052146946.db2.gz RAZQKSWFRIAXEJ-UHFFFAOYSA-N -1 3 332.556 4.396 20 0 EIADHM CCc1ccc(C(=O)Nc2ccccc2OCC(F)(F)F)c([O-])c1 ZINC000622289175 1052183065 /nfs/dbraw/zinc/18/30/65/1052183065.db2.gz GXYJAVQUKGFKMC-UHFFFAOYSA-N -1 3 339.313 4.148 20 0 EIADHM Cc1ccc([N-]S(=O)(=O)c2c(C)cccc2C)cc1OC(F)F ZINC001194642462 1052184169 /nfs/dbraw/zinc/18/41/69/1052184169.db2.gz FRJFVTZBEAMCST-UHFFFAOYSA-N -1 3 341.379 4.014 20 0 EIADHM CCc1ccc([O-])c(C(=O)Nc2ccccc2OCC(F)(F)F)c1 ZINC000622289292 1052184712 /nfs/dbraw/zinc/18/47/12/1052184712.db2.gz LJYNZMDCCITWSR-UHFFFAOYSA-N -1 3 339.313 4.148 20 0 EIADHM Cc1nc(C2CCCCC2)sc1C(=O)[N-]c1nc(C2CC2)no1 ZINC000775606067 1052185817 /nfs/dbraw/zinc/18/58/17/1052185817.db2.gz QOIPBHXSTADDAK-UHFFFAOYSA-N -1 3 332.429 4.012 20 0 EIADHM C[C@@H](N(C)C(=O)c1cc(Cc2ccccc2)ccc1[O-])C(C)(C)C ZINC000622296978 1052191516 /nfs/dbraw/zinc/19/15/16/1052191516.db2.gz KWZBZCMJASNYPW-OAHLLOKOSA-N -1 3 325.452 4.490 20 0 EIADHM CN(CCC1CCCCC1)C(=O)c1cc([O-])cc(C(F)(F)F)c1 ZINC000622344531 1052219198 /nfs/dbraw/zinc/21/91/98/1052219198.db2.gz VJICYSPKWWLIDE-UHFFFAOYSA-N -1 3 329.362 4.453 20 0 EIADHM CCC[C@@]1(C)CCCN(C(=O)c2cc([O-])cc(C(F)(F)F)c2)C1 ZINC000622403129 1052246368 /nfs/dbraw/zinc/24/63/68/1052246368.db2.gz NPZBJHQQJNXVFY-INIZCTEOSA-N -1 3 329.362 4.453 20 0 EIADHM O=S(=O)([N-]C[C@@H]1CCCC(F)(F)C1)c1cc2ccccc2s1 ZINC001185486242 1052250234 /nfs/dbraw/zinc/25/02/34/1052250234.db2.gz NPZGCQKBTBLESP-LLVKDONJSA-N -1 3 345.436 4.005 20 0 EIADHM CC1([N-]S(=O)(=O)c2cc3ccccc3s2)CCC(F)(F)CC1 ZINC001185486296 1052250757 /nfs/dbraw/zinc/25/07/57/1052250757.db2.gz PWNQLBQOWIFVDC-UHFFFAOYSA-N -1 3 345.436 4.148 20 0 EIADHM CC[C@H](Cc1ccc(C)cc1)N(CC)C(=O)Cc1ccc([O-])c(F)c1 ZINC000622395382 1052252526 /nfs/dbraw/zinc/25/25/26/1052252526.db2.gz MBMHMWUUHOHBRS-GOSISDBHSA-N -1 3 343.442 4.252 20 0 EIADHM C[C@@H](N[C@@H](C)c1cc(Br)cc(F)c1[O-])c1ccccn1 ZINC000184845747 1052254866 /nfs/dbraw/zinc/25/48/66/1052254866.db2.gz DKBZYETYGAZOHL-VHSXEESVSA-N -1 3 339.208 4.101 20 0 EIADHM O=C(Nc1ccc(F)c([O-])c1)Nc1cc(C(F)(F)F)ccc1F ZINC001185618083 1052266746 /nfs/dbraw/zinc/26/67/46/1052266746.db2.gz YULKWEMRYBTJQR-UHFFFAOYSA-N -1 3 332.228 4.333 20 0 EIADHM CC(C)C[C@@H]1CCCN(C(=O)c2cc([O-])cc(C(F)(F)F)c2)C1 ZINC000622433776 1052269105 /nfs/dbraw/zinc/26/91/05/1052269105.db2.gz PZDTVSSXWJIQFW-LBPRGKRZSA-N -1 3 329.362 4.309 20 0 EIADHM O=C(Nc1cc(F)cc(Cl)c1)c1cc([O-])cc(C(F)(F)F)c1 ZINC000622444927 1052279907 /nfs/dbraw/zinc/27/99/07/1052279907.db2.gz ZAIIBZLBEJYQDG-UHFFFAOYSA-N -1 3 333.668 4.456 20 0 EIADHM CCC1(CC)CCN(C(=O)c2cc([O-])cc(C(F)(F)F)c2)CC1 ZINC000622523179 1052314465 /nfs/dbraw/zinc/31/44/65/1052314465.db2.gz YLFWTZDOVJBQCR-UHFFFAOYSA-N -1 3 329.362 4.453 20 0 EIADHM CC(C)N(C)c1ccccc1NC(=O)CCCc1ccc([O-])c(F)c1 ZINC000622579399 1052332734 /nfs/dbraw/zinc/33/27/34/1052332734.db2.gz CTMSVNBHHVQYBE-UHFFFAOYSA-N -1 3 344.430 4.337 20 0 EIADHM O=C(Cc1ccc([O-])c(F)c1)NCc1ccc(C2CCCCC2)cc1 ZINC000622616098 1052363140 /nfs/dbraw/zinc/36/31/40/1052363140.db2.gz NQVMVFIVHKWNKX-UHFFFAOYSA-N -1 3 341.426 4.438 20 0 EIADHM C[C@H](NCc1cccc2c1OCO2)c1ccc(Cl)c(Cl)c1[O-] ZINC000185099776 1052425372 /nfs/dbraw/zinc/42/53/72/1052425372.db2.gz DZBXULOMLSQMBO-VIFPVBQESA-N -1 3 340.206 4.279 20 0 EIADHM Cc1cc(=O)[n-]c([C@@H](C)N[C@@H](C)c2ccc(SC(C)C)cc2)n1 ZINC000192731818 1052634162 /nfs/dbraw/zinc/63/41/62/1052634162.db2.gz ZTABGHVUWSJXPO-UONOGXRCSA-N -1 3 331.485 4.403 20 0 EIADHM O=C(Nc1ncccc1[O-])c1ccccc1SCc1cccs1 ZINC000192735624 1052635620 /nfs/dbraw/zinc/63/56/20/1052635620.db2.gz AHIYKELORSWKGA-UHFFFAOYSA-N -1 3 342.445 4.393 20 0 EIADHM CCc1noc(C)c1[N-]C(=O)c1sc(C)nc1-c1ccccc1 ZINC000178845906 1052714135 /nfs/dbraw/zinc/71/41/35/1052714135.db2.gz HUYSCRRUBFTYOM-UHFFFAOYSA-N -1 3 327.409 4.230 20 0 EIADHM O=C(Nc1cccc([O-])c1F)c1ccc(-n2cnc3ccccc32)cc1 ZINC000179152754 1052725124 /nfs/dbraw/zinc/72/51/24/1052725124.db2.gz RRPBZUKLVUXZQF-UHFFFAOYSA-N -1 3 347.349 4.123 20 0 EIADHM C[C@H](NCc1cc(=O)oc2cc([O-])c(Cl)cc12)c1ccccc1 ZINC000794561686 1053080601 /nfs/dbraw/zinc/08/06/01/1053080601.db2.gz IPEIPJIZDZYSRH-NSHDSACASA-N -1 3 329.783 4.003 20 0 EIADHM CC(C)(NCc1cc(=O)oc2cc([O-])c(Cl)cc12)c1cccs1 ZINC000794570391 1053098571 /nfs/dbraw/zinc/09/85/71/1053098571.db2.gz QPBVPOGOLJUHAB-UHFFFAOYSA-N -1 3 349.839 4.238 20 0 EIADHM CC(C)c1nn(-c2ccccc2)c(Cl)c1C=Cc1nccc(=O)[n-]1 ZINC000764436212 1053101948 /nfs/dbraw/zinc/10/19/48/1053101948.db2.gz QYYXHUPCIXCRPQ-HJWRWDBZSA-N -1 3 340.814 4.315 20 0 EIADHM CCCCCCOc1ccc(C=Cc2nccc(=O)[n-]2)cc1OC ZINC000764436909 1053103715 /nfs/dbraw/zinc/10/37/15/1053103715.db2.gz XMXCDGAETPYHDY-CSKARUKUSA-N -1 3 328.412 4.320 20 0 EIADHM Cc1c([O-])ccc2c(CN(c3ccccc3)[C@@H]3C[C@@H]3C)cc(=O)oc12 ZINC001195045417 1053242805 /nfs/dbraw/zinc/24/28/05/1053242805.db2.gz IZVCKGQAAZNPIO-SCLBCKFNSA-N -1 3 335.403 4.222 20 0 EIADHM Cc1ccc(NS(=O)(=O)c2cccc(C(C)C)c2)c(Cl)c1[O-] ZINC001195155913 1053305262 /nfs/dbraw/zinc/30/52/62/1053305262.db2.gz BQRSFZIXPMWCMJ-UHFFFAOYSA-N -1 3 339.844 4.278 20 0 EIADHM CCc1ccccc1[C@@H](CC(=O)[O-])NCc1cnc(C2CCC2)s1 ZINC000864529454 1053306752 /nfs/dbraw/zinc/30/67/52/1053306752.db2.gz XLIMOYZOLSOWAR-QGZVFWFLSA-N -1 3 344.480 4.279 20 0 EIADHM Cc1cc(=O)[n-]c(-c2cccc(OC(=O)[C@@H]3CCCC4(CC4)C3)c2)n1 ZINC000850860092 1053374845 /nfs/dbraw/zinc/37/48/45/1053374845.db2.gz CTCGFSONNWFTCN-OAHLLOKOSA-N -1 3 338.407 4.033 20 0 EIADHM CC(C)(C(=O)[O-])[C@H]1CCCN(Cc2ccc(F)cc2C(F)(F)F)C1 ZINC000325413728 1053436571 /nfs/dbraw/zinc/43/65/71/1053436571.db2.gz FOSWSURWVFKEGY-LBPRGKRZSA-N -1 3 347.352 4.167 20 0 EIADHM CCCc1cc(=O)[n-]c(C(=Cc2cccnc2Br)CC)n1 ZINC000865223240 1053444677 /nfs/dbraw/zinc/44/46/77/1053444677.db2.gz GDLJLVZGSLVTJT-PKNBQFBNSA-N -1 3 348.244 4.243 20 0 EIADHM [O-]c1ccc(Br)cc1NC(=S)Nc1ccccc1F ZINC001195772851 1053476854 /nfs/dbraw/zinc/47/68/54/1053476854.db2.gz AMNNKQWDIPDNPD-UHFFFAOYSA-N -1 3 341.205 4.103 20 0 EIADHM CC(C)c1cccc(C(C)C)c1NC(=O)c1nnc2ccccc2c1[O-] ZINC000110059709 1053494340 /nfs/dbraw/zinc/49/43/40/1053494340.db2.gz KLEGHEQDLVHSKQ-UHFFFAOYSA-N -1 3 349.434 4.422 20 0 EIADHM CC[C@H](C)CO[N-]C(=O)CCc1ncc(-c2ccc(Cl)cc2)o1 ZINC000794850558 1053548249 /nfs/dbraw/zinc/54/82/49/1053548249.db2.gz DQRGOBBBSHBXTM-LBPRGKRZSA-N -1 3 336.819 4.022 20 0 EIADHM CCC[C@H](CCc1ccccc1)NC(=O)c1cc(=O)c2ccccc2[n-]1 ZINC000265955385 1053590001 /nfs/dbraw/zinc/59/00/01/1053590001.db2.gz DVSFIKONLTUZSB-QGZVFWFLSA-N -1 3 348.446 4.472 20 0 EIADHM CC1(C)Cc2ccccc2N1Cc1cc(=O)[n-]c(-c2ccccc2)n1 ZINC001196632698 1053717750 /nfs/dbraw/zinc/71/77/50/1053717750.db2.gz WWGYGAODSJBRHH-UHFFFAOYSA-N -1 3 331.419 4.191 20 0 EIADHM O=C(Nc1cnn(Cc2ccccc2)c1)c1cc([O-])c2ccccc2c1 ZINC000471800378 1053842809 /nfs/dbraw/zinc/84/28/09/1053842809.db2.gz RFTLQDRMZLRTKN-UHFFFAOYSA-N -1 3 343.386 4.043 20 0 EIADHM CC(=O)c1cccc([O-])c1NC(=O)c1cc(C)c(OC(C)C)c(C)c1 ZINC001197238361 1053859311 /nfs/dbraw/zinc/85/93/11/1053859311.db2.gz HKXQNXJIVFBEBA-UHFFFAOYSA-N -1 3 341.407 4.251 20 0 EIADHM CCc1nc([N-]C(=O)c2conc2C(F)(F)F)sc1C(C)(C)C ZINC000854917550 1053859781 /nfs/dbraw/zinc/85/97/81/1053859781.db2.gz FTMVJTNFTYGKJL-UHFFFAOYSA-N -1 3 347.362 4.262 20 0 EIADHM CC(C)C(=O)Nc1ccc(Nc2nc3c(cccc3[O-])s2)cc1 ZINC001197500060 1053926818 /nfs/dbraw/zinc/92/68/18/1053926818.db2.gz AMQARFLMZAUPAC-UHFFFAOYSA-N -1 3 327.409 4.340 20 0 EIADHM Cc1cc(Cl)c2ccccc2c1NC([O-])=NO[C@@H]1CCCCO1 ZINC000775786038 1053989627 /nfs/dbraw/zinc/98/96/27/1053989627.db2.gz RFTQUXIFNUOOPS-OAHLLOKOSA-N -1 3 334.803 4.381 20 0 EIADHM Cc1cc(Cl)c2ccccc2c1NC(=O)[N-]O[C@@H]1CCCCO1 ZINC000775786038 1053989636 /nfs/dbraw/zinc/98/96/36/1053989636.db2.gz RFTQUXIFNUOOPS-OAHLLOKOSA-N -1 3 334.803 4.381 20 0 EIADHM O=C(Nc1nc(C2CCCCC2)cs1)c1[n-]cnc1C(F)(F)F ZINC000869702056 1054024802 /nfs/dbraw/zinc/02/48/02/1054024802.db2.gz XIPONNPEMWDRGO-UHFFFAOYSA-N -1 3 344.362 4.185 20 0 EIADHM O=C(Nc1nc(C2CCCCC2)cs1)c1nc[n-]c1C(F)(F)F ZINC000869702056 1054024816 /nfs/dbraw/zinc/02/48/16/1054024816.db2.gz XIPONNPEMWDRGO-UHFFFAOYSA-N -1 3 344.362 4.185 20 0 EIADHM CCCc1nc(CO[N-]C(=O)Cc2cccc3ccccc32)cs1 ZINC000114185423 1054066058 /nfs/dbraw/zinc/06/60/58/1054066058.db2.gz YNUCIBFWMLCXQV-UHFFFAOYSA-N -1 3 340.448 4.039 20 0 EIADHM O=C(Nc1ccc(OC2CCCC2)cc1)c1c[n-]c2ccccc2c1=O ZINC000033014063 1054117380 /nfs/dbraw/zinc/11/73/80/1054117380.db2.gz CVEFZHBNVLITHD-UHFFFAOYSA-N -1 3 348.402 4.102 20 0 EIADHM O=C([N-]OCCCC(F)(F)F)C1(Cc2cccc(Cl)c2)CC1 ZINC000871216739 1054170231 /nfs/dbraw/zinc/17/02/31/1054170231.db2.gz DXPXWISJPNGJTN-UHFFFAOYSA-N -1 3 335.753 4.053 20 0 EIADHM O=C(Nc1cc2ccccc2cc1[O-])c1ccc2c(c1)CCCC2=O ZINC001198905660 1054309164 /nfs/dbraw/zinc/30/91/64/1054309164.db2.gz BVRIXLXXQZOHOP-UHFFFAOYSA-N -1 3 331.371 4.317 20 0 EIADHM COc1ccc(S(=O)(=O)[N-]c2cc3ccccc3cc2C)c(C)c1 ZINC001198951828 1054311217 /nfs/dbraw/zinc/31/12/17/1054311217.db2.gz YZFVPJROJXITRA-UHFFFAOYSA-N -1 3 341.432 4.266 20 0 EIADHM COc1cc(C)c([C@@H](C)N[C@H](C)c2cccc([O-])c2F)cc1OC ZINC000872022891 1054337284 /nfs/dbraw/zinc/33/72/84/1054337284.db2.gz MTMDLQBREFYGTO-CHWSQXEVSA-N -1 3 333.403 4.269 20 0 EIADHM O=C(OCc1csc(-c2ccco2)n1)c1cccc(Cl)c1[O-] ZINC000775935896 1054351264 /nfs/dbraw/zinc/35/12/64/1054351264.db2.gz QCXOMLMMRQTRHA-UHFFFAOYSA-N -1 3 335.768 4.119 20 0 EIADHM CC(C)Cn1ncc(N[C@@H](C)c2cccc([O-])c2F)c1C(F)F ZINC000872060532 1054370638 /nfs/dbraw/zinc/37/06/38/1054370638.db2.gz QOJZCHVHMHYGPM-JTQLQIEISA-N -1 3 327.350 4.495 20 0 EIADHM CCOc1ccc2c(c1)[C@@H](N[C@@H](C)c1cccc([O-])c1F)CCO2 ZINC000872062895 1054372546 /nfs/dbraw/zinc/37/25/46/1054372546.db2.gz LNTGNQMQZCIEEA-LRDDRELGSA-N -1 3 331.387 4.104 20 0 EIADHM C[C@H](NCc1ccc(OC(F)F)cc1F)c1cccc([O-])c1F ZINC000872090481 1054384365 /nfs/dbraw/zinc/38/43/65/1054384365.db2.gz CAGPLDKKPZIFJE-VIFPVBQESA-N -1 3 329.293 4.123 20 0 EIADHM C[C@H](NCc1cc(F)ccc1OC(F)F)c1cccc([O-])c1F ZINC000872089198 1054384837 /nfs/dbraw/zinc/38/48/37/1054384837.db2.gz UZTZJASUPHWVGM-VIFPVBQESA-N -1 3 329.293 4.123 20 0 EIADHM O=C([O-])c1csc(CN2CCC(c3cccc(F)c3F)CC2)c1 ZINC000872159990 1054413507 /nfs/dbraw/zinc/41/35/07/1054413507.db2.gz WDPNVKUIADWNJG-UHFFFAOYSA-N -1 3 337.391 4.104 20 0 EIADHM O=C([N-]c1nc(-c2ccco2)cs1)c1cc(-c2ccccc2)no1 ZINC000047171056 1054428988 /nfs/dbraw/zinc/42/89/88/1054428988.db2.gz JOZVDHIMEUACFW-UHFFFAOYSA-N -1 3 337.360 4.310 20 0 EIADHM CC(C)c1ccc(C(=O)Nc2cc([O-])cc(Cl)c2)c(Cl)n1 ZINC001199703111 1054447159 /nfs/dbraw/zinc/44/71/59/1054447159.db2.gz LNWYASDFULAENZ-UHFFFAOYSA-N -1 3 325.195 4.470 20 0 EIADHM [O-]C(=NO[C@H]1CCCCO1)Nc1ccc(-c2cccc(F)c2)c(F)c1 ZINC000124420730 1054499543 /nfs/dbraw/zinc/49/95/43/1054499543.db2.gz NAVUQOQYZQJUMR-KRWDZBQOSA-N -1 3 348.349 4.212 20 0 EIADHM O=C([N-]O[C@H]1CCCCO1)Nc1ccc(-c2cccc(F)c2)c(F)c1 ZINC000124420730 1054499552 /nfs/dbraw/zinc/49/95/52/1054499552.db2.gz NAVUQOQYZQJUMR-KRWDZBQOSA-N -1 3 348.349 4.212 20 0 EIADHM CC(C)Cc1csc2[n-]c(CO[C@H]3CCCC[C@@H]3C)nc(=O)c12 ZINC000063579634 1054817306 /nfs/dbraw/zinc/81/73/06/1054817306.db2.gz FGHSWQTTYYRGII-JSGCOSHPSA-N -1 3 334.485 4.278 20 0 EIADHM Cc1scc(CNCc2cccc([O-])c2Br)c1C ZINC000399823073 1054867245 /nfs/dbraw/zinc/86/72/45/1054867245.db2.gz GPHASUZQCGBGJU-UHFFFAOYSA-N -1 3 326.259 4.123 20 0 EIADHM O=C(Nc1c([O-])cccc1C(F)(F)F)N[C@@H]1C[C@H]1c1ccccc1 ZINC001201937040 1054944939 /nfs/dbraw/zinc/94/49/39/1054944939.db2.gz YANUXORQANJTPY-WCQYABFASA-N -1 3 336.313 4.089 20 0 EIADHM O=C([N-]c1cc(C(F)(F)F)no1)Nc1ccccc1C(F)(F)F ZINC001202156111 1055060421 /nfs/dbraw/zinc/06/04/21/1055060421.db2.gz DXULOIFWTRFCOS-UHFFFAOYSA-N -1 3 339.195 4.356 20 0 EIADHM Cc1cccc(NC(=O)Nc2cc(Br)c(C)cc2[O-])c1 ZINC001202314605 1055136623 /nfs/dbraw/zinc/13/66/23/1055136623.db2.gz HQQLOHVRLXWGHZ-UHFFFAOYSA-N -1 3 335.201 4.416 20 0 EIADHM O=C([N-]c1cc(-c2ccco2)no1)Nc1ccc(Br)cc1 ZINC001202326980 1055141112 /nfs/dbraw/zinc/14/11/12/1055141112.db2.gz YPFGSQQZGGLPJT-UHFFFAOYSA-N -1 3 348.156 4.341 20 0 EIADHM CC(C)[C@@H]1c2ccccc2CCN1Cc1nnc(-c2ccccc2[O-])o1 ZINC000878195128 1055202551 /nfs/dbraw/zinc/20/25/51/1055202551.db2.gz NVAYWVNXVGSFJU-HXUWFJFHSA-N -1 3 349.434 4.198 20 0 EIADHM O=C(NCC1(C(F)(F)F)CCCC1)c1cc2sccc2c([O-])c1 ZINC000863507809 1055217301 /nfs/dbraw/zinc/21/73/01/1055217301.db2.gz FVHIKEFBDUCZEP-UHFFFAOYSA-N -1 3 343.370 4.459 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)N1CCC(CC(F)(F)F)CC1 ZINC000671915194 1055680639 /nfs/dbraw/zinc/68/06/39/1055680639.db2.gz KMEARDOYPOJCNS-UHFFFAOYSA-N -1 3 347.352 4.045 20 0 EIADHM O=C(Nc1ccc(-n2ccnc2)c(F)c1)c1cc([O-])c2ccccc2c1 ZINC000353100647 1055820659 /nfs/dbraw/zinc/82/06/59/1055820659.db2.gz ZUQFZUDDQFMFLH-UHFFFAOYSA-N -1 3 347.349 4.123 20 0 EIADHM CCc1nc([C@@H](C)NC(=O)c2cc([O-])c3ccccc3c2)cs1 ZINC000354208141 1056379828 /nfs/dbraw/zinc/37/98/28/1056379828.db2.gz OHVOHZVLNFRKME-LLVKDONJSA-N -1 3 326.421 4.055 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1csc(-c2ccccc2)n1 ZINC000111210173 1056771052 /nfs/dbraw/zinc/77/10/52/1056771052.db2.gz IQDHUASRJMDXNV-UHFFFAOYSA-N -1 3 330.796 4.421 20 0 EIADHM Cc1ccc(C)c(C(=O)CCC(=O)Nc2cc(Cl)ccc2[O-])c1 ZINC000111210719 1056772815 /nfs/dbraw/zinc/77/28/15/1056772815.db2.gz SZEDGJOMWQBLBS-UHFFFAOYSA-N -1 3 331.799 4.264 20 0 EIADHM Cc1cc(=O)[n-]c(-c2cccc(OC(=O)CCC3CCCC3)c2)n1 ZINC000744218104 1059335346 /nfs/dbraw/zinc/33/53/46/1059335346.db2.gz UNVVIYQEYOUHKB-UHFFFAOYSA-N -1 3 326.396 4.033 20 0 EIADHM CC(=CC(=O)Oc1cccc(-c2nc(C)cc(=O)[n-]2)c1)c1ccccc1 ZINC000744218196 1059336887 /nfs/dbraw/zinc/33/68/87/1059336887.db2.gz KHPLUPZPQLBONR-KAMYIIQDSA-N -1 3 346.386 4.167 20 0 EIADHM O=C(Oc1ccc(OC(F)(F)F)cc1)c1cc2ccsc2[n-]1 ZINC000744332574 1059401950 /nfs/dbraw/zinc/40/19/50/1059401950.db2.gz KABQZSHHNXCZTE-UHFFFAOYSA-N -1 3 327.283 4.347 20 0 EIADHM COc1cc(Cl)ccc1S(=O)(=O)[N-]c1cccc(C)c1Cl ZINC000745978587 1059948497 /nfs/dbraw/zinc/94/84/97/1059948497.db2.gz NIWXCPHIUCDFLN-UHFFFAOYSA-N -1 3 346.235 4.111 20 0 EIADHM CCOc1cc(Nc2cc(=O)n(-c3ccccc3)[n-]2)ccc1Cl ZINC001212578940 1060261682 /nfs/dbraw/zinc/26/16/82/1060261682.db2.gz IFYCOTRKUCJMRH-UHFFFAOYSA-N -1 3 329.787 4.374 20 0 EIADHM Cc1ccccc1[C@@H](C)N(C)C(=O)c1cc([O-])cc(Br)c1 ZINC001169218589 1060697600 /nfs/dbraw/zinc/69/76/00/1060697600.db2.gz WLRFRMXQPVSVGX-GFCCVEGCSA-N -1 3 348.240 4.296 20 0 EIADHM COC(=O)c1cc(Cl)nc(Cl)c1Nc1ccc(Cl)c([O-])c1 ZINC001212589336 1060774746 /nfs/dbraw/zinc/77/47/46/1060774746.db2.gz GIIWQQQFHWRNIZ-UHFFFAOYSA-N -1 3 347.585 4.278 20 0 EIADHM COc1ccc(-n2ncc(C)c2Nc2ccc(Cl)c([O-])c2)cc1 ZINC001212590219 1060818954 /nfs/dbraw/zinc/81/89/54/1060818954.db2.gz AOUSRVLTPVUZRC-UHFFFAOYSA-N -1 3 329.787 4.292 20 0 EIADHM [O-]c1cc(Nc2cn3c(cccc3Br)n2)ccc1Cl ZINC001212591388 1060858378 /nfs/dbraw/zinc/85/83/78/1060858378.db2.gz JSIXDJSOJIWQSN-UHFFFAOYSA-N -1 3 338.592 4.199 20 0 EIADHM O=C(/C=C\c1ccc(-c2ccc(F)cc2)s1)[N-]OCC(F)(F)F ZINC000766764143 1060884117 /nfs/dbraw/zinc/88/41/17/1060884117.db2.gz JPPJAEBVJATGTD-VURMDHGXSA-N -1 3 345.317 4.178 20 0 EIADHM COC(=O)c1cc(OC)c(Nc2ccc(Cl)c([O-])c2)cc1Cl ZINC001212593992 1060914358 /nfs/dbraw/zinc/91/43/58/1060914358.db2.gz OXHDWQJPQBTOHI-UHFFFAOYSA-N -1 3 342.178 4.238 20 0 EIADHM Cc1cc(Br)c(Cl)cc1NCc1ncccc1[O-] ZINC001169730644 1060933127 /nfs/dbraw/zinc/93/31/27/1060933127.db2.gz GEGQWUFDNSUQSG-UHFFFAOYSA-N -1 3 327.609 4.124 20 0 EIADHM Cc1c(C)c(-c2ccc(Cl)cc2)nnc1NCc1ncccc1[O-] ZINC001169730802 1060934934 /nfs/dbraw/zinc/93/49/34/1060934934.db2.gz ITUYEXCPKWGLCX-UHFFFAOYSA-N -1 3 340.814 4.127 20 0 EIADHM Nc1cc2c(ccn2-c2ccc(Cl)c([O-])c2)cc1Br ZINC001212594354 1060937312 /nfs/dbraw/zinc/93/73/12/1060937312.db2.gz XPBUXECTNHDPBG-UHFFFAOYSA-N -1 3 337.604 4.334 20 0 EIADHM [O-]c1cc(Nc2c(F)cccc2OC[C@H]2CCCO2)ccc1Cl ZINC001212594870 1060971895 /nfs/dbraw/zinc/97/18/95/1060971895.db2.gz ALHAVQXSBZFVBI-GFCCVEGCSA-N -1 3 337.778 4.486 20 0 EIADHM O=C(c1cc2sccc2c([O-])c1)N1CCc2cc(Cl)ccc21 ZINC000804346947 1061090164 /nfs/dbraw/zinc/09/01/64/1061090164.db2.gz YXQNQCCLAOICNP-UHFFFAOYSA-N -1 3 329.808 4.463 20 0 EIADHM Cc1ccc(C(=O)N2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)c([O-])c1 ZINC000767195465 1061141847 /nfs/dbraw/zinc/14/18/47/1061141847.db2.gz PJMSSDPSVYMJGP-AWEZNQCLSA-N -1 3 349.352 4.349 20 0 EIADHM O=C([O-])C[C@H]1CCCCN1CCSc1cc(Cl)ccc1Cl ZINC000038027916 213192939 /nfs/dbraw/zinc/19/29/39/213192939.db2.gz XQPLNGNIROFACR-GFCCVEGCSA-N -1 3 348.295 4.415 20 0 EIADHM Cc1ccc(-c2csc3[n-]c(-c4ccccn4)nc(=O)c23)cc1C ZINC000020369427 212123489 /nfs/dbraw/zinc/12/34/89/212123489.db2.gz XEUKCHJOBYJDSZ-UHFFFAOYSA-N -1 3 333.416 4.330 20 0 EIADHM COc1cc(CNc2ccc(C)c(F)c2)cc(Br)c1[O-] ZINC000019955674 212089705 /nfs/dbraw/zinc/08/97/05/212089705.db2.gz JALLCEICUHFNRU-UHFFFAOYSA-N -1 3 340.192 4.223 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2ccc(OC(C)C)cc2C)c(C)c1 ZINC000614863612 1032102468 /nfs/dbraw/zinc/10/24/68/1032102468.db2.gz JPIOZDWGROWWQI-UHFFFAOYSA-N -1 3 333.453 4.200 20 0 EIADHM COC(=O)c1cnc(S[C@H](C)c2ccc(C(F)(F)F)cc2)[n-]1 ZINC000193540020 1032157654 /nfs/dbraw/zinc/15/76/54/1032157654.db2.gz NTFLCQLVTBXHEJ-MRVPVSSYSA-N -1 3 330.331 4.068 20 0 EIADHM Cc1cccc2c(CCC(=O)Nc3ccc(Cl)cc3[O-])c[nH]c21 ZINC000532837801 1032343175 /nfs/dbraw/zinc/34/31/75/1032343175.db2.gz SFHLYBWHGSRZHR-UHFFFAOYSA-N -1 3 328.799 4.407 20 0 EIADHM CCC(CC)(CNC(=O)c1c[n-]c2ccccc2c1=O)c1ccccc1 ZINC000173392138 1032361409 /nfs/dbraw/zinc/36/14/09/1032361409.db2.gz AGINVAKEWNPMCH-UHFFFAOYSA-N -1 3 348.446 4.016 20 0 EIADHM CC(C)c1ccc(SCC(=O)NCc2ccc([O-])c(F)c2)cc1 ZINC000532868299 1032365768 /nfs/dbraw/zinc/36/57/68/1032365768.db2.gz FNQBVLKXFSZCPN-UHFFFAOYSA-N -1 3 333.428 4.063 20 0 EIADHM CCCn1ccc2ccc(NC(=O)c3c[n-]c4ccccc4c3=O)cc21 ZINC000175274957 1032429314 /nfs/dbraw/zinc/42/93/14/1032429314.db2.gz OBUZLEKQJPGNLL-UHFFFAOYSA-N -1 3 345.402 4.145 20 0 EIADHM CCN(Cc1nc2c3ccccc3oc2c(=O)[n-]1)c1ccccc1F ZINC000533342787 1032667652 /nfs/dbraw/zinc/66/76/52/1032667652.db2.gz MEUSWWNAWSZGEL-UHFFFAOYSA-N -1 3 337.354 4.247 20 0 EIADHM Cc1cc(C(C#N)=C([O-])C=Cc2ccc(C(C)(C)C)cc2)nc(C)n1 ZINC000049405702 1018725221 /nfs/dbraw/zinc/72/52/21/1018725221.db2.gz POXDJUQMHPTNJT-VEGGFIAOSA-N -1 3 333.435 4.281 20 0 EIADHM CCCCCc1nnc([N-]C(=O)c2cc(C)oc2C(F)(F)F)s1 ZINC000274499748 1018729382 /nfs/dbraw/zinc/72/93/82/1018729382.db2.gz KFPJMWVSQOBVEY-UHFFFAOYSA-N -1 3 347.362 4.443 20 0 EIADHM FC(F)(F)c1cc(Cl)ccc1-c1noc(-c2cc(Cl)n[n-]2)n1 ZINC001213500183 1018816768 /nfs/dbraw/zinc/81/67/68/1018816768.db2.gz AVCCJVHRQJHTLE-UHFFFAOYSA-N -1 3 349.099 4.452 20 0 EIADHM CC(C)n1ncc(C(=O)Nc2cccc([O-])c2F)c1-c1ccccc1 ZINC000683136068 1018890074 /nfs/dbraw/zinc/89/00/74/1018890074.db2.gz AKHRLOUQUBFXOP-UHFFFAOYSA-N -1 3 339.370 4.228 20 0 EIADHM O=C(Nc1ccc(Cl)cc1[O-])c1cccc(Oc2ccncc2)c1 ZINC000153556836 1018922490 /nfs/dbraw/zinc/92/24/90/1018922490.db2.gz JUUYQBZHVLZOEE-UHFFFAOYSA-N -1 3 340.766 4.485 20 0 EIADHM O=C(Nc1cc(F)ccc1[O-])c1ccc(Cl)c(C(F)(F)F)c1 ZINC000533477261 1032794998 /nfs/dbraw/zinc/79/49/98/1032794998.db2.gz TXNOYHCMECURMJ-UHFFFAOYSA-N -1 3 333.668 4.456 20 0 EIADHM CCCc1cc(=O)[n-]c(C(=Cc2nccn2-c2ccccc2)CC)n1 ZINC000579790629 1018981004 /nfs/dbraw/zinc/98/10/04/1018981004.db2.gz AJSTXQOTFAZQOD-SQFISAMPSA-N -1 3 334.423 4.271 20 0 EIADHM COc1ccc([O-])c(-c2nc(-c3cccc(C(F)(F)F)c3)no2)c1 ZINC000109036979 1019363322 /nfs/dbraw/zinc/36/33/22/1019363322.db2.gz COHXZZBVILSUAO-UHFFFAOYSA-N -1 3 336.269 4.137 20 0 EIADHM C[C@H](Oc1ccc(Cl)cc1)C(=O)Nc1ccc(Cl)cc1[O-] ZINC000430261802 1019803875 /nfs/dbraw/zinc/80/38/75/1019803875.db2.gz WMRQPHCLDUIJFT-VIFPVBQESA-N -1 3 326.179 4.105 20 0 EIADHM COc1ccccc1[C@@H]1CCCN1C(=O)c1cc([O-])ccc1Cl ZINC000339856200 1019941399 /nfs/dbraw/zinc/94/13/99/1019941399.db2.gz DMZIHRLZOHITJQ-INIZCTEOSA-N -1 3 331.799 4.032 20 0 EIADHM O=C([N-]c1ncccc1Cl)c1cc(-c2cccc(Cl)c2)no1 ZINC000179972495 1020005907 /nfs/dbraw/zinc/00/59/07/1020005907.db2.gz PZPIQQIOCKISIR-UHFFFAOYSA-N -1 3 334.162 4.296 20 0 EIADHM CC(C)CCc1nnc([N-]C(=O)c2ccsc2C(F)(F)F)s1 ZINC000628040056 1020020959 /nfs/dbraw/zinc/02/09/59/1020020959.db2.gz OOUPFUGVJUAQLY-UHFFFAOYSA-N -1 3 349.403 4.459 20 0 EIADHM CCCCc1nnc([N-]C(=O)c2sc(C)cc2OC(F)F)s1 ZINC000510168344 1020342796 /nfs/dbraw/zinc/34/27/96/1020342796.db2.gz RCDVAJGCWWQWMC-UHFFFAOYSA-N -1 3 347.412 4.104 20 0 EIADHM O=C(CCCCC(=O)c1ccc(F)cc1)Nc1cccc([O-])c1F ZINC000547977774 1021047240 /nfs/dbraw/zinc/04/72/40/1021047240.db2.gz FDKVLPZTQOFNOD-UHFFFAOYSA-N -1 3 333.334 4.052 20 0 EIADHM CN(C)c1cccc([C@@H]2CCCN2C(=O)c2cc([O-])ccc2Cl)c1 ZINC000340473853 1021085009 /nfs/dbraw/zinc/08/50/09/1021085009.db2.gz HLGZHAXYCCOICW-SFHVURJKSA-N -1 3 344.842 4.089 20 0 EIADHM Cc1cc([C@H](C)NCc2ncc(Br)cc2[O-])c(C)s1 ZINC000892510429 1021312326 /nfs/dbraw/zinc/31/23/26/1021312326.db2.gz YDFGIAPWIGNYDE-VIFPVBQESA-N -1 3 341.274 4.079 20 0 EIADHM CC(C)c1ccc(-c2nc(CN[C@@H](C)[C@H](C)C(=O)[O-])cs2)cc1 ZINC000580085647 1021628510 /nfs/dbraw/zinc/62/85/10/1021628510.db2.gz WUMSVIBBJGYFLG-STQMWFEESA-N -1 3 332.469 4.132 20 0 EIADHM COc1ccc(CCC/N=C/c2cc(Cl)ccc2[O-])cc1OC ZINC000064925451 1021836717 /nfs/dbraw/zinc/83/67/17/1021836717.db2.gz AIGKQQUEPATHNK-UDWIEESQSA-N -1 3 333.815 4.115 20 0 EIADHM O=C(N[C@@H]1CCC[C@@H]1Cc1ccccc1)c1cc([O-])ccc1Cl ZINC000431793642 1021862870 /nfs/dbraw/zinc/86/28/70/1021862870.db2.gz ZUZPKTJVOYUPAN-RDTXWAMCSA-N -1 3 329.827 4.187 20 0 EIADHM O=C([O-])[C@H](NCc1cc(F)cc(Cl)c1)c1ccc(Cl)cc1 ZINC000756333947 1022070976 /nfs/dbraw/zinc/07/09/76/1022070976.db2.gz VKQWKEWHMXAQNU-CQSZACIVSA-N -1 3 328.170 4.048 20 0 EIADHM CCCc1cc(=O)[n-]c(C(=Cc2cc3c(c(Cl)c2)OCO3)CC)n1 ZINC000684033495 1022396626 /nfs/dbraw/zinc/39/66/26/1022396626.db2.gz NIPDVIIBBKUACX-WUXMJOGZSA-N -1 3 346.814 4.055 20 0 EIADHM O=C(NCC1(Cc2ccccc2)CCC1)c1cc([O-])ccc1Cl ZINC000431858300 1022420415 /nfs/dbraw/zinc/42/04/15/1022420415.db2.gz CELQCNSBNTUSOY-UHFFFAOYSA-N -1 3 329.827 4.188 20 0 EIADHM CCCCCc1nnc([N-]C(=O)c2cc3cc(F)ccc3o2)s1 ZINC000522737315 1022842086 /nfs/dbraw/zinc/84/20/86/1022842086.db2.gz HZWGNWWFQIGSPW-UHFFFAOYSA-N -1 3 333.388 4.408 20 0 EIADHM CSc1ccccc1[N-]S(=O)(=O)Cc1cccc(Cl)c1 ZINC000549718781 1033095230 /nfs/dbraw/zinc/09/52/30/1033095230.db2.gz AXEGBSSTGQJTKC-UHFFFAOYSA-N -1 3 327.858 4.004 20 0 EIADHM O=C([O-])c1cc(CN2CCC(Cc3cccc(F)c3)CC2)cs1 ZINC000584639185 1023145477 /nfs/dbraw/zinc/14/54/77/1023145477.db2.gz ZLVMDFWYMGJTGY-UHFFFAOYSA-N -1 3 333.428 4.040 20 0 EIADHM COc1cc(C)cc(Nc2cc(Br)cc(F)c2[O-])c1 ZINC001211732198 1033110898 /nfs/dbraw/zinc/11/08/98/1033110898.db2.gz WPRGFBQSZFMKQE-UHFFFAOYSA-N -1 3 326.165 4.354 20 0 EIADHM COc1cc(-c2noc(C=C([O-])c3ccccc3Cl)n2)ccc1C ZINC001211647589 1023231669 /nfs/dbraw/zinc/23/16/69/1023231669.db2.gz XEVZUQXFUCFLBG-UHFFFAOYSA-N -1 3 342.782 4.132 20 0 EIADHM CN(C[C@H]1CCc2ccccc21)[C@@H](C(=O)[O-])c1c(F)cccc1Cl ZINC000659803514 1023283544 /nfs/dbraw/zinc/28/35/44/1023283544.db2.gz JQDJNYYMWDFUAE-FZKQIMNGSA-N -1 3 347.817 4.267 20 0 EIADHM O=C([O-])C[C@@H](NCc1cc(F)cc(C(F)(F)F)c1)c1cccs1 ZINC000322751025 1023309723 /nfs/dbraw/zinc/30/97/23/1023309723.db2.gz XGXYNPHQSSVYJN-GFCCVEGCSA-N -1 3 347.333 4.212 20 0 EIADHM COc1ccc([C@H](CCC(=O)[O-])NCc2cc(Cl)cs2)cc1 ZINC000417579216 1023363541 /nfs/dbraw/zinc/36/35/41/1023363541.db2.gz PDLDNLCCYVXNCR-HNNXBMFYSA-N -1 3 339.844 4.106 20 0 EIADHM O=C(Nc1cccc([O-])c1F)C1(c2ccc(C(F)(F)F)cc2)CC1 ZINC000188948903 1023377620 /nfs/dbraw/zinc/37/76/20/1023377620.db2.gz BQZBPKZWNZPVCT-UHFFFAOYSA-N -1 3 339.288 4.220 20 0 EIADHM Cc1cc2cc(CN[C@@H]3C[C@H](C(=O)[O-])c4ccccc43)oc2cc1C ZINC000417631275 1023383221 /nfs/dbraw/zinc/38/32/21/1023383221.db2.gz RYURYVBQMXINDT-RBUKOAKNSA-N -1 3 335.403 4.452 20 0 EIADHM COCc1nc(C(=O)[N-]c2c(F)cc(F)cc2-c2ccccc2)co1 ZINC000548191730 1023404583 /nfs/dbraw/zinc/40/45/83/1023404583.db2.gz DHLZTFYTQIZZSK-UHFFFAOYSA-N -1 3 344.317 4.019 20 0 EIADHM O=C(Nc1ccc2c(c1)C(=O)CCC2)c1cc([O-])ccc1C(F)(F)F ZINC000189224950 1023416112 /nfs/dbraw/zinc/41/61/12/1023416112.db2.gz AOYKZEQLBDFLHL-UHFFFAOYSA-N -1 3 349.308 4.182 20 0 EIADHM Cc1ccc(-c2csc3[n-]c(-c4ncccc4C)nc(=O)c23)s1 ZINC000042781224 1023470886 /nfs/dbraw/zinc/47/08/86/1023470886.db2.gz JIQKVZIUJQHHAO-UHFFFAOYSA-N -1 3 339.445 4.392 20 0 EIADHM O=C([O-])[C@@H]1CCN(Cc2ccc(Cl)cc2Cl)[C@H]2CCCC[C@H]12 ZINC000656763437 1023503374 /nfs/dbraw/zinc/50/33/74/1023503374.db2.gz FSDAHIYCBJIHFH-FMKPAKJESA-N -1 3 342.266 4.459 20 0 EIADHM O=C([O-])[C@@H]1CCN(Cc2ccc(Cl)c(Cl)c2)[C@@H]2CCCC[C@H]12 ZINC000656764928 1023509605 /nfs/dbraw/zinc/50/96/05/1023509605.db2.gz LRTODGJOYWRETO-XJKCOSOUSA-N -1 3 342.266 4.459 20 0 EIADHM CCc1nc(C(C)C)ccc1CN1CC[C@H](C(=O)[O-])[C@@H]2CCCC[C@@H]21 ZINC000656769392 1023512381 /nfs/dbraw/zinc/51/23/81/1023512381.db2.gz ZBBNIKDAPSTWEQ-ZWOKBUDYSA-N -1 3 344.499 4.233 20 0 EIADHM O=C([O-])c1ccc(CN2CCCCC[C@@H]2/C=C/c2cccs2)nc1 ZINC000581731561 1023655210 /nfs/dbraw/zinc/65/52/10/1023655210.db2.gz GGIHUXSNQJHNLH-OAGJVSPASA-N -1 3 342.464 4.299 20 0 EIADHM CC(C)(C)c1ccc(S(=O)(=O)[N-]c2cc(F)c(F)cc2F)cc1 ZINC000517924091 1023744046 /nfs/dbraw/zinc/74/40/46/1023744046.db2.gz ZSJSEPLWMGBXHB-UHFFFAOYSA-N -1 3 343.370 4.202 20 0 EIADHM Cc1ccc(Cl)c(S(=O)(=O)[N-][C@H](C)c2ccccc2)c1Cl ZINC000500418537 1023813992 /nfs/dbraw/zinc/81/39/92/1023813992.db2.gz BSZMDQAZPCYFOI-LLVKDONJSA-N -1 3 344.263 4.341 20 0 EIADHM Cc1ccc(Cl)c(S(=O)(=O)[N-][C@@H](C)c2ccccc2)c1Cl ZINC000500424307 1023817143 /nfs/dbraw/zinc/81/71/43/1023817143.db2.gz BSZMDQAZPCYFOI-NSHDSACASA-N -1 3 344.263 4.341 20 0 EIADHM O=C(Nc1cc(F)ccc1[O-])c1ccc(Cl)c(Br)c1 ZINC000511790928 1023886286 /nfs/dbraw/zinc/88/62/86/1023886286.db2.gz ZYNQXQRYKRGLAQ-UHFFFAOYSA-N -1 3 344.567 4.200 20 0 EIADHM Cc1ccc([N-]S(=O)(=O)c2ccc(C(C)(C)C)cc2)c(C)c1O ZINC000047383651 1023887929 /nfs/dbraw/zinc/88/79/29/1023887929.db2.gz OIHJMFFIBGKSLU-UHFFFAOYSA-N -1 3 333.453 4.107 20 0 EIADHM c1ccc2c(c1)-c1ccccc1C2Nc1ccccc1-c1nnn[n-]1 ZINC001167776679 1024009401 /nfs/dbraw/zinc/00/94/01/1024009401.db2.gz QISCTTVEKPDIIZ-UHFFFAOYSA-N -1 3 325.375 4.049 20 0 EIADHM c1ccc2c(c1)-c1ccccc1C2Nc1ccccc1-c1nn[n-]n1 ZINC001167776679 1024009419 /nfs/dbraw/zinc/00/94/19/1024009419.db2.gz QISCTTVEKPDIIZ-UHFFFAOYSA-N -1 3 325.375 4.049 20 0 EIADHM O=S(=O)([N-]c1ccc(F)cc1Cl)c1ccc(F)cc1Cl ZINC000044253557 1024112052 /nfs/dbraw/zinc/11/20/52/1024112052.db2.gz XIBUYIHBGSUADT-UHFFFAOYSA-N -1 3 338.162 4.072 20 0 EIADHM [O-]c1ccccc1-c1nc(-c2cc(F)cc(Br)c2)no1 ZINC000091332305 1024253597 /nfs/dbraw/zinc/25/35/97/1024253597.db2.gz HAGBZYDVQZWGBS-UHFFFAOYSA-N -1 3 335.132 4.011 20 0 EIADHM O=C(N[C@H]1CC[C@H](c2cccc(F)c2)C1)c1cc([O-])ccc1Cl ZINC000510904886 1024771270 /nfs/dbraw/zinc/77/12/70/1024771270.db2.gz COQSNGXRZQYSQZ-JSGCOSHPSA-N -1 3 333.790 4.251 20 0 EIADHM O=C([O-])C[C@H](NCc1ccc(C(F)(F)F)cc1)c1ccsc1 ZINC000276923567 1024776891 /nfs/dbraw/zinc/77/68/91/1024776891.db2.gz AJABQPXCNRLSHD-ZDUSSCGKSA-N -1 3 329.343 4.073 20 0 EIADHM O=C([O-])CC[C@H]1CCCN(CCc2cc(Cl)ccc2Cl)C1 ZINC000652495913 1024853771 /nfs/dbraw/zinc/85/37/71/1024853771.db2.gz GBWYRKMLPRCMAR-GFCCVEGCSA-N -1 3 330.255 4.113 20 0 EIADHM O=C([O-])CC[C@H](CNCc1cc(Cl)ccc1Cl)C(F)(F)F ZINC000663261013 1024964790 /nfs/dbraw/zinc/96/47/90/1024964790.db2.gz GXUBPGDCCZLEKA-SECBINFHSA-N -1 3 344.160 4.126 20 0 EIADHM O=C([O-])CC[C@H](CNCc1c(Cl)oc2ccccc21)C(F)(F)F ZINC000663262985 1024968344 /nfs/dbraw/zinc/96/83/44/1024968344.db2.gz WXBRSOMSJBSMIE-SECBINFHSA-N -1 3 349.736 4.219 20 0 EIADHM CSc1ccc([O-])c(C(=O)N2CC[C@H](C(F)(F)F)C(C)(C)C2)c1 ZINC000613923735 1025547415 /nfs/dbraw/zinc/54/74/15/1025547415.db2.gz OPIUOCIXXDWAJN-ZDUSSCGKSA-N -1 3 347.402 4.165 20 0 EIADHM CCOc1ccccc1[C@H](CC(C)C)NCc1nc(CC)cc(=O)[n-]1 ZINC000342245106 1025570015 /nfs/dbraw/zinc/57/00/15/1025570015.db2.gz PMRBGINQNOQORP-KRWDZBQOSA-N -1 3 343.471 4.020 20 0 EIADHM CCc1ccc(C(=O)Nc2ccnc(OCc3ccccc3)c2)c([O-])c1 ZINC001143428226 1025602377 /nfs/dbraw/zinc/60/23/77/1025602377.db2.gz GIGVUUQVRNBJJP-UHFFFAOYSA-N -1 3 348.402 4.181 20 0 EIADHM [O-]c1cc(F)cc(CN[C@@H]2COc3c2ccc(Cl)c3Cl)c1 ZINC000472074921 1025658372 /nfs/dbraw/zinc/65/83/72/1025658372.db2.gz SYFXRPGKGVADAV-CYBMUJFWSA-N -1 3 328.170 4.061 20 0 EIADHM Cc1ccc([C@@H](C)N(C)Cc2nc(=O)c3sccc3[n-]2)c(C)c1 ZINC000299005019 1025669504 /nfs/dbraw/zinc/66/95/04/1025669504.db2.gz MZNQCXVOXOEOJG-CYBMUJFWSA-N -1 3 327.453 4.207 20 0 EIADHM CC[C@@H](c1ccc(Cl)cc1)N1CC[C@@](C(=O)[O-])(C(F)(F)F)C1 ZINC000315815566 1025783047 /nfs/dbraw/zinc/78/30/47/1025783047.db2.gz DZWILUMNJSBZOX-GXTWGEPZSA-N -1 3 335.753 4.130 20 0 EIADHM COc1ccc(S(=O)(=O)[N-]c2cccc(C(F)F)c2)c(C)c1C ZINC000604972096 1025827623 /nfs/dbraw/zinc/82/76/23/1025827623.db2.gz VFKLXNXUUJHBHU-UHFFFAOYSA-N -1 3 341.379 4.050 20 0 EIADHM COC(=O)c1cc(NC(=O)c2cc([O-])c3ccccc3c2)c(C)cc1C ZINC000473210705 1025886660 /nfs/dbraw/zinc/88/66/60/1025886660.db2.gz UZRQCEAOVJNBBJ-UHFFFAOYSA-N -1 3 349.386 4.201 20 0 EIADHM [O-]c1ccc(F)c(CNc2ccc3oc(C(F)(F)F)nc3c2)c1F ZINC000512142932 1026125357 /nfs/dbraw/zinc/12/53/57/1026125357.db2.gz BVJFVSVZKDETCT-UHFFFAOYSA-N -1 3 344.239 4.443 20 0 EIADHM O=C([O-])c1ccc(CN2CC[C@@H](C(F)(F)F)C3(CCC3)C2)s1 ZINC000563282393 1026328175 /nfs/dbraw/zinc/32/81/75/1026328175.db2.gz KTSGJGQMODDENM-GFCCVEGCSA-N -1 3 333.375 4.001 20 0 EIADHM O=C([O-])C[C@H](NCc1cccc(-c2ccccn2)c1)c1ccsc1 ZINC000426672229 1026426864 /nfs/dbraw/zinc/42/68/64/1026426864.db2.gz QADRPBWBSXUKMA-SFHVURJKSA-N -1 3 338.432 4.116 20 0 EIADHM O=C([O-])C[C@H](NCc1cc(Cl)cc2cccnc21)c1ccsc1 ZINC000426689521 1026492527 /nfs/dbraw/zinc/49/25/27/1026492527.db2.gz ZFXOMRYNDJQMML-HNNXBMFYSA-N -1 3 346.839 4.255 20 0 EIADHM Cc1cc2[nH]c(CN[C@@H](C(=O)[O-])c3cccc(Cl)c3)cc2c(C)c1 ZINC000426731731 1026512798 /nfs/dbraw/zinc/51/27/98/1026512798.db2.gz GEVSQCFUDMWGBB-GOSISDBHSA-N -1 3 342.826 4.354 20 0 EIADHM COc1ccc2c(c1)N(C(=O)c1cc([O-])c3ccccc3c1)CCC2 ZINC001167877321 1026515721 /nfs/dbraw/zinc/51/57/21/1026515721.db2.gz UEJUDNKRIYEFKA-UHFFFAOYSA-N -1 3 333.387 4.147 20 0 EIADHM COc1cccc([C@H](CC(=O)[O-])NCc2ccc(CC(C)C)cc2)c1 ZINC000426790070 1026564797 /nfs/dbraw/zinc/56/47/97/1026564797.db2.gz AEWPHTXLUCGSLY-FQEVSTJZSA-N -1 3 341.451 4.199 20 0 EIADHM O=C([O-])[C@H](NCc1cc(Cl)cc(Cl)c1)c1cccc(F)c1 ZINC000426809581 1026574083 /nfs/dbraw/zinc/57/40/83/1026574083.db2.gz VUNPSUGTZUSIOM-CQSZACIVSA-N -1 3 328.170 4.048 20 0 EIADHM CCc1ccc([C@H](NCc2cccc(C(F)(F)F)c2)C(=O)[O-])cc1 ZINC000426818639 1026577050 /nfs/dbraw/zinc/57/70/50/1026577050.db2.gz SIMJVSIGCIIOIQ-INIZCTEOSA-N -1 3 337.341 4.183 20 0 EIADHM Cc1cc([C@@H](NCc2cccc(OC(C)C)c2)C(=O)[O-])ccc1Cl ZINC000426824814 1026583918 /nfs/dbraw/zinc/58/39/18/1026583918.db2.gz ODVHFFQKCIMBDP-GOSISDBHSA-N -1 3 347.842 4.351 20 0 EIADHM O=C([O-])c1ccc2c(c1)CN(CCCc1ccccc1Cl)CC2 ZINC000582426635 1026615909 /nfs/dbraw/zinc/61/59/09/1026615909.db2.gz XGMTWIQXZMJYGM-UHFFFAOYSA-N -1 3 329.827 4.029 20 0 EIADHM [O-]c1ccc(F)c(CNc2cccc(Oc3ccccn3)c2)c1F ZINC000512279250 1026643596 /nfs/dbraw/zinc/64/35/96/1026643596.db2.gz RYXVCAUCLJHVEP-UHFFFAOYSA-N -1 3 328.318 4.470 20 0 EIADHM [O-]c1cccc(Nc2cc(Cl)cc(CO)c2)c1Br ZINC001216440580 1026725737 /nfs/dbraw/zinc/72/57/37/1026725737.db2.gz VGXNABSIMKLWMS-UHFFFAOYSA-N -1 3 328.593 4.044 20 0 EIADHM COc1ccc(S(=O)(=O)[N-]c2cc(C)ccc2F)c2ccccc12 ZINC000511149821 1026752146 /nfs/dbraw/zinc/75/21/46/1026752146.db2.gz JRXRATCKUZUUOJ-UHFFFAOYSA-N -1 3 345.395 4.097 20 0 EIADHM CCOc1ccc([N-]S(=O)(=O)c2c(C)c(C)cc(C)c2C)c(C)c1 ZINC000511154702 1026776260 /nfs/dbraw/zinc/77/62/60/1026776260.db2.gz KDXADRMRLUPPDP-UHFFFAOYSA-N -1 3 347.480 4.428 20 0 EIADHM CC(C)[C@@H](C(=O)Nc1ccc([O-])c(C(F)(F)F)c1)c1ccncc1 ZINC000500525305 1026819927 /nfs/dbraw/zinc/81/99/27/1026819927.db2.gz NUDXDTJRSKFXPW-OAHLLOKOSA-N -1 3 338.329 4.184 20 0 EIADHM O=C(Cc1ccccc1Cl)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000440999366 1027179124 /nfs/dbraw/zinc/17/91/24/1027179124.db2.gz DESRSZMVOVXUGK-UHFFFAOYSA-N -1 3 329.705 4.246 20 0 EIADHM Cc1cccc([C@@H]2CCCCCN2C(=O)N=c2cc3ccccn3[n-]2)c1 ZINC000548772833 1027404077 /nfs/dbraw/zinc/40/40/77/1027404077.db2.gz XHUZNSXYIAJDNN-IBGZPJMESA-N -1 3 348.450 4.214 20 0 EIADHM CC(C)(C(=O)Nc1cc(Br)ccc1[O-])c1ccccc1 ZINC000532283874 1027533967 /nfs/dbraw/zinc/53/39/67/1027533967.db2.gz SUAHHJFUJYAOAM-UHFFFAOYSA-N -1 3 334.213 4.071 20 0 EIADHM C[C@H](OCC(F)(F)F)c1noc(-c2cc3ccccc3cc2[O-])n1 ZINC000896606001 1027696317 /nfs/dbraw/zinc/69/63/17/1027696317.db2.gz FRJUZULFXJJBEP-VIFPVBQESA-N -1 3 338.285 4.235 20 0 EIADHM CC[C@H](C(=O)Nc1ccc([O-])c(C(F)(F)F)c1)c1c(C)noc1C ZINC000342956591 1027774732 /nfs/dbraw/zinc/77/47/32/1027774732.db2.gz YCIAXWRJILQMBC-NSHDSACASA-N -1 3 342.317 4.148 20 0 EIADHM Cc1sc(-c2ccco2)nc1C(=O)[N-]c1nnc(C(C)(C)C)s1 ZINC000079241764 1027855137 /nfs/dbraw/zinc/85/51/37/1027855137.db2.gz NSFNRBGDWRRAPE-UHFFFAOYSA-N -1 3 348.453 4.113 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)N[C@H]1CCCC[C@H]1c1ccccc1 ZINC000523462700 1028133161 /nfs/dbraw/zinc/13/31/61/1028133161.db2.gz JTJPPFUEUUAJNA-WMZOPIPTSA-N -1 3 342.414 4.057 20 0 EIADHM CCc1ccc([C@H](NC(=O)NCc2ccc([O-])c(F)c2)C(C)C)cc1 ZINC000523470861 1028135803 /nfs/dbraw/zinc/13/58/03/1028135803.db2.gz QTLLZQRFMYPCEM-LJQANCHMSA-N -1 3 344.430 4.290 20 0 EIADHM CC[C@@H](NC(=O)NCc1ccc([O-])c(F)c1)c1ccc(Cl)s1 ZINC000523468473 1028136853 /nfs/dbraw/zinc/13/68/53/1028136853.db2.gz KDSXYAIZXSGUAR-LLVKDONJSA-N -1 3 342.823 4.197 20 0 EIADHM CCC(CC)c1nnc([N-]C(=O)c2ccc(C(C)=O)cc2F)s1 ZINC000346204568 1028330405 /nfs/dbraw/zinc/33/04/05/1028330405.db2.gz LLUCPZSLLXVOJR-UHFFFAOYSA-N -1 3 335.404 4.036 20 0 EIADHM C[C@H](c1ccc2c(c1)CCC2)N(C)Cc1nc(=O)c2sccc2[n-]1 ZINC000445496897 1028663112 /nfs/dbraw/zinc/66/31/12/1028663112.db2.gz YNBUQOCYPZCMDI-GFCCVEGCSA-N -1 3 339.464 4.079 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2cc(F)ccc2Cl)c(Cl)c1 ZINC000524113655 1028669500 /nfs/dbraw/zinc/66/95/00/1028669500.db2.gz BHPYWNQCMLVXNA-UHFFFAOYSA-N -1 3 334.199 4.242 20 0 EIADHM Cc1ccc(C(=O)Nc2ccc(N(C)C)cc2C(F)(F)F)c([O-])c1 ZINC000192601212 1028678720 /nfs/dbraw/zinc/67/87/20/1028678720.db2.gz DIGFSBRNHLOQNF-UHFFFAOYSA-N -1 3 338.329 4.038 20 0 EIADHM O=C(c1ccncc1)c1ccc(Nc2cc(F)c([O-])c(F)c2)cc1 ZINC001213384272 1028724059 /nfs/dbraw/zinc/72/40/59/1028724059.db2.gz BQWBORPYCVWOBE-UHFFFAOYSA-N -1 3 326.302 4.040 20 0 EIADHM COc1cccc(-c2nc(Cc3ccc(Cl)cc3C)no2)c1[O-] ZINC000445601543 1028766658 /nfs/dbraw/zinc/76/66/58/1028766658.db2.gz RBXSULYDQPQWAD-UHFFFAOYSA-N -1 3 330.771 4.003 20 0 EIADHM CCCC[C@@H](CC)CC(=O)Nc1ccc(-c2nc(C)cc(=O)[n-]2)cc1 ZINC000524209024 1028772697 /nfs/dbraw/zinc/77/26/97/1028772697.db2.gz VYGPFSYGLBUELW-OAHLLOKOSA-N -1 3 341.455 4.290 20 0 EIADHM CCn1c2ccccc2nc1[C@@H]1CCCN1C(=O)c1ccc(C)cc1[O-] ZINC000157317379 1028802967 /nfs/dbraw/zinc/80/29/67/1028802967.db2.gz XVQNCVKTYKHCJE-SFHVURJKSA-N -1 3 349.434 4.048 20 0 EIADHM CC(C)(C)n1cc(-c2noc(-c3cc4ccccc4cc3[O-])n2)cn1 ZINC000445643377 1028813652 /nfs/dbraw/zinc/81/36/52/1028813652.db2.gz VOHXOUBRLGZMJR-UHFFFAOYSA-N -1 3 334.379 4.214 20 0 EIADHM CC(C)c1ccc(-c2nc(-c3cnn(C(C)(C)C)c3)no2)c([O-])c1 ZINC000445644998 1028813788 /nfs/dbraw/zinc/81/37/88/1028813788.db2.gz LGVLJIMZONDDCC-UHFFFAOYSA-N -1 3 326.400 4.184 20 0 EIADHM COc1cc(NC(=O)c2cc([O-])ccc2Cl)ccc1OC(C)C ZINC000346907986 1028814458 /nfs/dbraw/zinc/81/44/58/1028814458.db2.gz DPRHEOTXWAPGDV-UHFFFAOYSA-N -1 3 335.787 4.094 20 0 EIADHM Cn1nc(C2CCCC2)cc1NC(=O)c1cc([O-])c2ccccc2c1 ZINC000329445276 1029184228 /nfs/dbraw/zinc/18/42/28/1029184228.db2.gz BHTJCXMKQNXVLF-UHFFFAOYSA-N -1 3 335.407 4.189 20 0 EIADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)CCCC(C)(C)C)c2)n1 ZINC000103381248 1029196296 /nfs/dbraw/zinc/19/62/96/1029196296.db2.gz DUVFMIPOAXUIDW-UHFFFAOYSA-N -1 3 341.455 4.154 20 0 EIADHM CC(C)c1ccc(-c2nc([C@@H]3CCOC4(CCC4)C3)no2)c([O-])c1 ZINC000897111365 1029427353 /nfs/dbraw/zinc/42/73/53/1029427353.db2.gz WWVCBOHIJKSNNJ-CQSZACIVSA-N -1 3 328.412 4.382 20 0 EIADHM CC(C)N(Cc1csc(-c2ccc(C(=O)[O-])cc2)n1)C1CCC1 ZINC000583999716 1029488197 /nfs/dbraw/zinc/48/81/97/1029488197.db2.gz WNNWWVBWRMNPMJ-UHFFFAOYSA-N -1 3 330.453 4.271 20 0 EIADHM Cc1cccc([N-]S(=O)(=O)c2ccc(F)cc2Cl)c1Cl ZINC000525310054 1029565435 /nfs/dbraw/zinc/56/54/35/1029565435.db2.gz PKGWGTYSDXJPQW-UHFFFAOYSA-N -1 3 334.199 4.242 20 0 EIADHM Cc1ccc(Cl)c([N-]S(=O)(=O)c2cc(C)c(F)cc2F)c1C ZINC000446968355 1029662002 /nfs/dbraw/zinc/66/20/02/1029662002.db2.gz XUGPSKFJWGBIFL-UHFFFAOYSA-N -1 3 345.798 4.344 20 0 EIADHM Cc1cc([N-]S(=O)(=O)c2ccc3c(c2)CCC3)ccc1OC(C)C ZINC000525532352 1029671702 /nfs/dbraw/zinc/67/17/02/1029671702.db2.gz LIMJATQXMYLNMO-UHFFFAOYSA-N -1 3 345.464 4.072 20 0 EIADHM O=c1nc(-c2scnc2C2CC2)[n-]c2sc3c(c21)CCCC3 ZINC000584390171 1029811908 /nfs/dbraw/zinc/81/19/08/1029811908.db2.gz BQIQLWMSAFSBPT-UHFFFAOYSA-N -1 3 329.450 4.277 20 0 EIADHM CC[C@@H](C)n1ncc(C(=O)Nc2ccc(Cl)cc2[O-])c1C1CC1 ZINC000089867841 1029859197 /nfs/dbraw/zinc/85/91/97/1029859197.db2.gz WSCSYGIBKJXFLU-SNVBAGLBSA-N -1 3 333.819 4.343 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@@H](C)CCC=C(C)C)nc2)n1 ZINC000450680908 1029895418 /nfs/dbraw/zinc/89/54/18/1029895418.db2.gz ZGBABLVZJCISFV-AWEZNQCLSA-N -1 3 326.444 4.353 20 0 EIADHM CCOc1cccc2cc([C@H](C)NCc3cccc(C(=O)[O-])c3)oc21 ZINC000262946085 1029908842 /nfs/dbraw/zinc/90/88/42/1029908842.db2.gz AGDBCUAHYMBECC-ZDUSSCGKSA-N -1 3 339.391 4.381 20 0 EIADHM O=C(Cc1ccc([O-])c(F)c1)N1CCC(c2ccc(Cl)cc2)CC1 ZINC000450740985 1029943341 /nfs/dbraw/zinc/94/33/41/1029943341.db2.gz VYGNBCPWAHSLAE-UHFFFAOYSA-N -1 3 347.817 4.133 20 0 EIADHM O=S(=O)([N-]c1ccc(-c2ccco2)cc1F)c1ccc(F)cc1 ZINC000447257995 1029945825 /nfs/dbraw/zinc/94/58/25/1029945825.db2.gz PYIJBDAIFRYXLL-UHFFFAOYSA-N -1 3 335.331 4.026 20 0 EIADHM CCc1cccc(C(=O)Nc2cc(NC(=O)C(C)C)ccc2C)c1[O-] ZINC000093969789 1030001240 /nfs/dbraw/zinc/00/12/40/1030001240.db2.gz QAMQHSHELKHWSQ-UHFFFAOYSA-N -1 3 340.423 4.110 20 0 EIADHM Cc1cc(Cl)ccc1[N-]S(=O)(=O)c1ccc(OC(C)C)cc1 ZINC000096659481 1030019921 /nfs/dbraw/zinc/01/99/21/1030019921.db2.gz IHRFYAQFMCYROT-UHFFFAOYSA-N -1 3 339.844 4.236 20 0 EIADHM C[C@@H](c1ccc(Cl)cc1Cl)N1CCC(c2n[n-]c(=O)o2)CC1 ZINC000450915976 1030107091 /nfs/dbraw/zinc/10/70/91/1030107091.db2.gz RXNYPMIIQWMJDD-VIFPVBQESA-N -1 3 342.226 4.023 20 0 EIADHM COC(=O)c1nc2nc(-c3cc(C(C)C)ccc3Cl)ccc2[n-]1 ZINC001204693353 1030329691 /nfs/dbraw/zinc/32/96/91/1030329691.db2.gz KKHGTDYSHSYZNU-UHFFFAOYSA-N -1 3 329.787 4.188 20 0 EIADHM COC(=O)c1nc2ccc(-c3cc(C(C)C)ccc3Cl)[n-]c-2n1 ZINC001204693353 1030329707 /nfs/dbraw/zinc/32/97/07/1030329707.db2.gz KKHGTDYSHSYZNU-UHFFFAOYSA-N -1 3 329.787 4.188 20 0 EIADHM Cc1cc(=O)[n-]c([C@@H](C)N[C@@H](c2ccc(F)c(Cl)c2)C2CC2)n1 ZINC000451354031 1030430675 /nfs/dbraw/zinc/43/06/75/1030430675.db2.gz MBLQQMPQPLYUAA-QLJPJBMISA-N -1 3 335.810 4.085 20 0 EIADHM O=C(/C=C/c1ccc(-c2ccccc2Cl)s1)[N-]OCC(F)F ZINC000760141976 1030628916 /nfs/dbraw/zinc/62/89/16/1030628916.db2.gz NLGRVTYPVAAWLP-SOFGYWHQSA-N -1 3 343.782 4.395 20 0 EIADHM O=C(NCCc1c[nH]c2cc(Cl)ccc12)c1cc([O-])ccc1Cl ZINC000685661548 1030653679 /nfs/dbraw/zinc/65/36/79/1030653679.db2.gz ZLHGBHVULNJNOW-UHFFFAOYSA-N -1 3 349.217 4.153 20 0 EIADHM O=C(Nc1ccc2oc3ccccc3c2c1)c1cccc2n[n-]nc21 ZINC000527357681 1030666558 /nfs/dbraw/zinc/66/65/58/1030666558.db2.gz WNPWWJYDFIOVRK-UHFFFAOYSA-N -1 3 328.331 4.110 20 0 EIADHM CC[C@@H](C(=O)Nc1cc(Br)ccc1[O-])c1ccccc1 ZINC000530916551 1030808673 /nfs/dbraw/zinc/80/86/73/1030808673.db2.gz IMNFESGDDDUNOY-CYBMUJFWSA-N -1 3 334.213 4.287 20 0 EIADHM CCc1cccc(C(=O)N2CCC(OC3CCC(C)CC3)CC2)c1[O-] ZINC000530955029 1030819594 /nfs/dbraw/zinc/81/95/94/1030819594.db2.gz OOIWLHRIJZVETF-UHFFFAOYSA-N -1 3 345.483 4.155 20 0 EIADHM Cc1nc([C@@H](C)N(C)C[C@@H](C)C(=O)[O-])oc1-c1ccc(Cl)cc1 ZINC000263392911 1030843680 /nfs/dbraw/zinc/84/36/80/1030843680.db2.gz YZPYRDKUFXGUKN-ZYHUDNBSSA-N -1 3 336.819 4.017 20 0 EIADHM CSc1ccc([O-])c(C(=O)N2CC[C@@H](c3ccccc3)[C@H]2C)c1 ZINC000612072112 1030846781 /nfs/dbraw/zinc/84/67/81/1030846781.db2.gz VGVYHPPRZKUVKN-CZUORRHYSA-N -1 3 327.449 4.132 20 0 EIADHM [O-]c1cccc(CN[C@H](c2ccccn2)C2CCC2)c1Br ZINC000527769977 1030850167 /nfs/dbraw/zinc/85/01/67/1030850167.db2.gz CIXHRKKMRBVJHN-KRWDZBQOSA-N -1 3 347.256 4.181 20 0 EIADHM CSc1ccc([O-])c(C(=O)N2CC(Cc3ccccc3Cl)C2)c1 ZINC000612127765 1030975655 /nfs/dbraw/zinc/97/56/55/1030975655.db2.gz TUBMUIPPQJLFDG-UHFFFAOYSA-N -1 3 347.867 4.082 20 0 EIADHM CCc1cccc(C(=O)N2CCC(c3ccccc3F)CC2)c1[O-] ZINC000531435801 1031246166 /nfs/dbraw/zinc/24/61/66/1031246166.db2.gz QFAVJIXWBZWQSH-UHFFFAOYSA-N -1 3 327.399 4.114 20 0 EIADHM C[C@@H](/N=C/c1cc(Cl)ccc1[O-])c1cccc(N2CCCC2=O)c1 ZINC000065829861 1031296554 /nfs/dbraw/zinc/29/65/54/1031296554.db2.gz WSFTXQIBBYGZJV-LNOXHEFASA-N -1 3 342.826 4.353 20 0 EIADHM Cc1cnc(F)c([C@@H](C)Oc2cccc([O-])c2Br)c1 ZINC001229141662 1031512282 /nfs/dbraw/zinc/51/22/82/1031512282.db2.gz LTTHHHWHRBPQGU-SECBINFHSA-N -1 3 326.165 4.137 20 0 EIADHM O=S(=O)([N-]c1cccc(Cl)c1F)c1cccc2ccccc21 ZINC000389655450 1031801430 /nfs/dbraw/zinc/80/14/30/1031801430.db2.gz PZWNBBSFJHVOHK-UHFFFAOYSA-N -1 3 335.787 4.433 20 0 EIADHM O=C(Nc1ccc(Br)cc1[O-])c1nc2ccccc2s1 ZINC000536586374 1031812144 /nfs/dbraw/zinc/81/21/44/1031812144.db2.gz LAKLTRYREVGVNP-UHFFFAOYSA-N -1 3 349.209 4.017 20 0 EIADHM C[C@@H](c1cccc(Br)c1)[S@@](=O)c1ccc([O-])cc1 ZINC000129808408 1031813266 /nfs/dbraw/zinc/81/32/66/1031813266.db2.gz JADDSIKKSNIGPW-YPMLDQLKSA-N -1 3 325.227 4.024 20 0 EIADHM CSc1ccc([O-])c(C(=O)N2CCC[C@H]2Cc2cccc(F)c2)c1 ZINC000666693717 1031865350 /nfs/dbraw/zinc/86/53/50/1031865350.db2.gz YBEFLSDYJTZLDC-HNNXBMFYSA-N -1 3 345.439 4.101 20 0 EIADHM CCOCc1cccc(NCc2cccc([O-])c2Br)c1 ZINC000459346623 1031876525 /nfs/dbraw/zinc/87/65/25/1031876525.db2.gz FFWGLMQSHSRZJX-UHFFFAOYSA-N -1 3 336.229 4.303 20 0 EIADHM CCOc1cc(CNc2cc(OC)ccc2F)cc(Cl)c1[O-] ZINC000459361508 1031915865 /nfs/dbraw/zinc/91/58/65/1031915865.db2.gz IPUJDJXOMPJDAL-UHFFFAOYSA-N -1 3 325.767 4.204 20 0 EIADHM CCCc1ccccc1[N-]S(=O)(=O)c1cc(C)c(OC)c(C)c1 ZINC000512589647 1033445963 /nfs/dbraw/zinc/44/59/63/1033445963.db2.gz ZLMDPAZVSZMLLT-UHFFFAOYSA-N -1 3 333.453 4.065 20 0 EIADHM O=C([N-]C1(c2cccc(Cl)c2)CCC1)C(F)(F)c1nccs1 ZINC000843723025 1033478576 /nfs/dbraw/zinc/47/85/76/1033478576.db2.gz WZKLNKDDQLPJKT-UHFFFAOYSA-N -1 3 342.798 4.084 20 0 EIADHM Cc1onc(-c2ccc(F)cc2)c1C(=O)Nc1cc(Cl)ccc1[O-] ZINC000067145391 1033710018 /nfs/dbraw/zinc/71/00/18/1033710018.db2.gz WNIJZOXADQLORI-UHFFFAOYSA-N -1 3 346.745 4.400 20 0 EIADHM CSc1ccccc1CN(C)C(=O)CCCc1ccc([O-])c(F)c1 ZINC000473471473 1033772518 /nfs/dbraw/zinc/77/25/18/1033772518.db2.gz NWYRPJJTJGATHN-UHFFFAOYSA-N -1 3 347.455 4.235 20 0 EIADHM Cc1ccc([O-])c(C(=O)Nc2cc(-c3cncc(F)c3)ccc2C)c1 ZINC000512733665 1033826138 /nfs/dbraw/zinc/82/61/38/1033826138.db2.gz MUYZACZNWMFBEO-UHFFFAOYSA-N -1 3 336.366 4.462 20 0 EIADHM CCOc1cc(CNc2cc(OC)cc(OC)c2)cc(Cl)c1[O-] ZINC000512984888 1034282898 /nfs/dbraw/zinc/28/28/98/1034282898.db2.gz LHMPHPWKEQSIRI-UHFFFAOYSA-N -1 3 337.803 4.074 20 0 EIADHM CCOc1ccc(S(=O)(=O)[N-]c2ccccc2C(C)C)c(C)c1 ZINC000501819998 1035622903 /nfs/dbraw/zinc/62/29/03/1035622903.db2.gz DEIYRRRIITTWIF-UHFFFAOYSA-N -1 3 333.453 4.318 20 0 EIADHM Cc1cc(S(=O)(=O)[N-]C[C@@H]2CCCC(C)(C)C2)sc1Cl ZINC001212177591 1035667313 /nfs/dbraw/zinc/66/73/13/1035667313.db2.gz RPNUWJMCRMNIMG-LLVKDONJSA-N -1 3 335.922 4.205 20 0 EIADHM O=C([O-])[C@@H]1C[C@H](NCc2ccc(C(F)(F)F)s2)c2ccccc21 ZINC000905014099 1035707210 /nfs/dbraw/zinc/70/72/10/1035707210.db2.gz ZINRMSUOMFLFNN-OLZOCXBDSA-N -1 3 341.354 4.170 20 0 EIADHM COc1cc(-c2nc3cc(Cl)c(Cl)cc3c(=O)[n-]2)ccc1F ZINC000485353102 1035844875 /nfs/dbraw/zinc/84/48/75/1035844875.db2.gz FCENQOOPOGKSFH-UHFFFAOYSA-N -1 3 339.153 4.045 20 0 EIADHM CC(C)[C@H](c1ccc(F)cc1)N(C)C(=O)NCc1ccc([O-])c(F)c1 ZINC000434134499 1035875436 /nfs/dbraw/zinc/87/54/36/1035875436.db2.gz XNFDDAPATXFGRL-GOSISDBHSA-N -1 3 348.393 4.209 20 0 EIADHM [O-]c1cc2c(cc1-c1nc(-c3ccc4sccc4c3)no1)OCO2 ZINC000436932527 1036043951 /nfs/dbraw/zinc/04/39/51/1036043951.db2.gz NXCLRCJLRMRHFC-UHFFFAOYSA-N -1 3 338.344 4.053 20 0 EIADHM O=C1CCCCN1c1cccc(NCc2c([O-])cccc2Cl)c1 ZINC000156590065 1036049464 /nfs/dbraw/zinc/04/94/64/1036049464.db2.gz OVYSANBKLRYMBH-UHFFFAOYSA-N -1 3 330.815 4.175 20 0 EIADHM O=C([O-])[C@H](c1ccccc1F)N1CC[C@@H](C(F)(F)F)C2(CCC2)C1 ZINC000571811389 1036262118 /nfs/dbraw/zinc/26/21/18/1036262118.db2.gz UUHMQWPKSQKIOZ-KGLIPLIRSA-N -1 3 345.336 4.006 20 0 EIADHM Cc1cccc(N(C)C(=O)c2c[n-]c(=NC(=O)OC(C)(C)C)s2)c1 ZINC000906520531 1036315763 /nfs/dbraw/zinc/31/57/63/1036315763.db2.gz FBITVJMFYVNBQV-UHFFFAOYSA-N -1 3 347.440 4.075 20 0 EIADHM Cc1cc(NC(=O)c2c[n-]c3ccccc3c2=O)cc(C)c1Cl ZINC000669635364 1036383638 /nfs/dbraw/zinc/38/36/38/1036383638.db2.gz NZMHIGMULJTPAJ-UHFFFAOYSA-N -1 3 326.783 4.051 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@@H]3CCC[C@@H](C(C)C)C3)nc2)n1 ZINC000597939939 1036402156 /nfs/dbraw/zinc/40/21/56/1036402156.db2.gz PPLDFWHWLVEDJC-RHSMWYFYSA-N -1 3 340.471 4.433 20 0 EIADHM O=C([O-])[C@H](c1c(F)cccc1Cl)N1CCC[C@@]2(CC=CCC2)C1 ZINC000572127908 1036438322 /nfs/dbraw/zinc/43/83/22/1036438322.db2.gz ZBVJPSISMDXFEN-WMZOPIPTSA-N -1 3 337.822 4.427 20 0 EIADHM CCSc1cccc(C=Cc2cc(=O)[n-]c(-c3ccncc3)n2)c1 ZINC000486055297 1036457845 /nfs/dbraw/zinc/45/78/45/1036457845.db2.gz YUSTXMYONMWMAN-SREVYHEPSA-N -1 3 335.432 4.114 20 0 EIADHM O=C(Nc1ccc([O-])c(C(F)(F)F)c1)c1c[nH]c(C(F)(F)F)c1 ZINC000486106853 1036488878 /nfs/dbraw/zinc/48/88/78/1036488878.db2.gz PACWKKYQGWEEOI-UHFFFAOYSA-N -1 3 338.207 4.010 20 0 EIADHM CC1(C)CCN(Cc2nc(=O)c3c(-c4ccco4)csc3[n-]2)CC1 ZINC000588904536 1036566500 /nfs/dbraw/zinc/56/65/00/1036566500.db2.gz DHMYVZLUOJMWMT-UHFFFAOYSA-N -1 3 343.452 4.279 20 0 EIADHM CSc1ccc([O-])c(C(=O)N(C)[C@H]2CCCc3nc(C)sc32)c1 ZINC000668600649 1036606099 /nfs/dbraw/zinc/60/60/99/1036606099.db2.gz XPGANMOJDDEJSF-AWEZNQCLSA-N -1 3 348.493 4.029 20 0 EIADHM CSCc1cc(F)ccc1CNCc1cccc([O-])c1Cl ZINC000590186238 1037005931 /nfs/dbraw/zinc/00/59/31/1037005931.db2.gz BLAWVFRFUFFDIE-UHFFFAOYSA-N -1 3 325.836 4.338 20 0 EIADHM CCC[C@H]1CCCC[C@H]1C[N-]S(=O)(=O)c1cc(F)ccc1Cl ZINC001212163374 1037052557 /nfs/dbraw/zinc/05/25/57/1037052557.db2.gz VKMRCDQXLHJIPX-STQMWFEESA-N -1 3 347.883 4.364 20 0 EIADHM Cc1nc(-c2ccccn2)sc1C(=O)Nc1cc(Cl)ccc1[O-] ZINC000067145359 1037186909 /nfs/dbraw/zinc/18/69/09/1037186909.db2.gz DCBWHRYQLNGSDI-UHFFFAOYSA-N -1 3 345.811 4.125 20 0 EIADHM Cc1ccccc1[C@H](C(C)C)N(C)C(=O)c1cc(=O)c2ccccc2[n-]1 ZINC000487818546 1037244142 /nfs/dbraw/zinc/24/41/42/1037244142.db2.gz ODLPZPKTVZJIKY-NRFANRHFSA-N -1 3 348.446 4.306 20 0 EIADHM CSc1ccc([O-])c(C(=O)N2CCSC[C@@H]2c2ccccc2)c1 ZINC000668812264 1037309272 /nfs/dbraw/zinc/30/92/72/1037309272.db2.gz KBJLNKXUEOCLNV-MRXNPFEDSA-N -1 3 345.489 4.044 20 0 EIADHM S=c1[n-]nc(CCC2CCCC2)n1CN(C1CC1)C1CCCC1 ZINC000058205635 1037585912 /nfs/dbraw/zinc/58/59/12/1037585912.db2.gz ASTKWAQENASDQD-UHFFFAOYSA-N -1 3 334.533 4.428 20 0 EIADHM CSc1ccc([O-])c(C(=O)N2CCS[C@H](c3ccccc3)C2)c1 ZINC000668878331 1037785224 /nfs/dbraw/zinc/78/52/24/1037785224.db2.gz BZGIUACDDAZEET-KRWDZBQOSA-N -1 3 345.489 4.044 20 0 EIADHM CC(C)Nc1cccc(F)c1NC(=O)CCCc1ccc([O-])c(F)c1 ZINC000911927397 1037845572 /nfs/dbraw/zinc/84/55/72/1037845572.db2.gz FFMBRZUJRXWRKN-UHFFFAOYSA-N -1 3 348.393 4.452 20 0 EIADHM Cc1nnc(C(=O)[N-]c2cc(C)ccc2SCC(F)(F)F)s1 ZINC000668937413 1037899356 /nfs/dbraw/zinc/89/93/56/1037899356.db2.gz QCAZAOBUHAWJLB-UHFFFAOYSA-N -1 3 347.387 4.062 20 0 EIADHM C[C@@H]1CCc2c(sc3ncnc(NCc4ccc([O-])c(F)c4)c23)C1 ZINC000606156750 1037906647 /nfs/dbraw/zinc/90/66/47/1037906647.db2.gz MWUKTMIGEYPPNN-SNVBAGLBSA-N -1 3 343.427 4.273 20 0 EIADHM CCc1nocc1C(=O)[N-]c1cccc(Cl)c1SCC(F)F ZINC000668940406 1037917249 /nfs/dbraw/zinc/91/72/49/1037917249.db2.gz WYLHQAVRCYJEQE-UHFFFAOYSA-N -1 3 346.786 4.500 20 0 EIADHM CC(C)c1ccc([C@H](C)CC(=O)Nc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000606347562 1038010394 /nfs/dbraw/zinc/01/03/94/1038010394.db2.gz BXSFLGURUODFHW-CQSZACIVSA-N -1 3 349.438 4.122 20 0 EIADHM CC(C)c1ccc([C@H](C)CC(=O)Nc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000606347562 1038010415 /nfs/dbraw/zinc/01/04/15/1038010415.db2.gz BXSFLGURUODFHW-CQSZACIVSA-N -1 3 349.438 4.122 20 0 EIADHM C[C@]12CC3CC(C(=O)NCc4ccc([O-])c(F)c4)(C1)C[C@@](C)(C3)C2 ZINC000606537139 1038150305 /nfs/dbraw/zinc/15/03/05/1038150305.db2.gz QMGUVQRABHFSQS-ODNNXGBQSA-N -1 3 331.431 4.144 20 0 EIADHM Cc1ccc(C(C)C)c(O[C@@H](C)C(=O)NCc2ccc([O-])c(F)c2)c1 ZINC000606536674 1038152427 /nfs/dbraw/zinc/15/24/27/1038152427.db2.gz PNCHGZQQTBNLAR-AWEZNQCLSA-N -1 3 345.414 4.047 20 0 EIADHM CCCCCOc1ccc(C(=O)NCc2ccc([O-])c(F)c2)cc1 ZINC000606537042 1038153580 /nfs/dbraw/zinc/15/35/80/1038153580.db2.gz YTCYZTRCLLJODS-UHFFFAOYSA-N -1 3 331.387 4.030 20 0 EIADHM CCOc1ccc(S(=O)(=O)[N-]c2ccc(OC(C)(C)C)cc2)cc1 ZINC000607615918 1038240526 /nfs/dbraw/zinc/24/05/26/1038240526.db2.gz BFTYONIPHUPLSJ-UHFFFAOYSA-N -1 3 349.452 4.063 20 0 EIADHM O=C([O-])c1coc(CN2CCCCC[C@H]2/C=C/c2cccs2)c1 ZINC000574578230 1038297954 /nfs/dbraw/zinc/29/79/54/1038297954.db2.gz NQHSXMMNOQOKDE-KIUWMYQTSA-N -1 3 331.437 4.497 20 0 EIADHM COc1ccccc1O[C@H]1CCCN(Cc2cccc([O-])c2Cl)C1 ZINC000646195094 1038315804 /nfs/dbraw/zinc/31/58/04/1038315804.db2.gz AFHGLHHIYRRMDB-HNNXBMFYSA-N -1 3 347.842 4.098 20 0 EIADHM O=C(N[C@@H]1CC[C@H](Cc2ccccc2)C1)c1cc([O-])ccc1Cl ZINC000504601830 1038424718 /nfs/dbraw/zinc/42/47/18/1038424718.db2.gz PZKWAUZOMUOCIB-HUUCEWRRSA-N -1 3 329.827 4.187 20 0 EIADHM CCCCCC[C@@H](C)C(=O)OCc1noc(-c2ccccc2[O-])n1 ZINC000783864981 1038819355 /nfs/dbraw/zinc/81/93/55/1038819355.db2.gz LGYGVLLIURHSRX-CYBMUJFWSA-N -1 3 332.400 4.092 20 0 EIADHM CCCCCC[C@H](C)C(=O)OCc1noc(-c2ccccc2[O-])n1 ZINC000783864983 1038820567 /nfs/dbraw/zinc/82/05/67/1038820567.db2.gz LGYGVLLIURHSRX-ZDUSSCGKSA-N -1 3 332.400 4.092 20 0 EIADHM CSc1ccc(S(=O)(=O)[N-]c2cc(Cl)ccc2F)cc1 ZINC000064474856 1039386004 /nfs/dbraw/zinc/38/60/04/1039386004.db2.gz LAPZSWLIVXWXOA-UHFFFAOYSA-N -1 3 331.821 4.002 20 0 EIADHM [O-]c1ccc(F)c(CN2CC[C@H](CSc3ccccc3)C2)c1F ZINC000508837398 1039769167 /nfs/dbraw/zinc/76/91/67/1039769167.db2.gz MWTXMXGOLOPWLP-ZDUSSCGKSA-N -1 3 335.419 4.285 20 0 EIADHM Cc1ccc(CN(C)C(=O)CCCc2ccc([O-])c(F)c2)cc1C ZINC000456965868 1039776800 /nfs/dbraw/zinc/77/68/00/1039776800.db2.gz RHVNWNAOIHKWCI-UHFFFAOYSA-N -1 3 329.415 4.129 20 0 EIADHM O=C(c1ccccc1[O-])N1Cc2ccccc2[C@@H](c2ccccc2)C1 ZINC000552767654 1039808109 /nfs/dbraw/zinc/80/81/09/1039808109.db2.gz YCAFYDAUHJILDL-HXUWFJFHSA-N -1 3 329.399 4.180 20 0 EIADHM Cc1ccc([C@@H]2CCN(C(=O)c3cc([O-])ccc3Cl)C2)c(C)c1 ZINC000510002127 1039845963 /nfs/dbraw/zinc/84/59/63/1039845963.db2.gz JTWDRZSYXAQYGK-CQSZACIVSA-N -1 3 329.827 4.292 20 0 EIADHM O=C(Cc1ccc([O-])c(F)c1)N1CC2(CCCC2)[C@H]1c1ccccc1 ZINC000457271778 1039894361 /nfs/dbraw/zinc/89/43/61/1039894361.db2.gz GPXLYXHHSSMMFF-HXUWFJFHSA-N -1 3 339.410 4.218 20 0 EIADHM C[C@@H]1C[C@H](c2ccccc2)N(C(=O)CCCc2ccc([O-])c(F)c2)C1 ZINC000553337795 1040145762 /nfs/dbraw/zinc/14/57/62/1040145762.db2.gz VKEKOYXRKQPAGM-DNVCBOLYSA-N -1 3 341.426 4.464 20 0 EIADHM O=C(Nc1cc(F)ccc1[O-])c1c[nH]cc1-c1ccc(Cl)s1 ZINC000535413696 1040261757 /nfs/dbraw/zinc/26/17/57/1040261757.db2.gz KPMUNPIANMBBLH-UHFFFAOYSA-N -1 3 336.775 4.494 20 0 EIADHM C[C@@H](CC(=O)c1ccccc1F)C(=O)Nc1cc(Cl)ccc1[O-] ZINC000535441008 1040272498 /nfs/dbraw/zinc/27/24/98/1040272498.db2.gz JEZQXMDQITUEEF-JTQLQIEISA-N -1 3 335.762 4.032 20 0 EIADHM CCCc1cc(=O)[n-]c(C(=Cc2cccc(Br)c2)CC)n1 ZINC000435336649 1040287996 /nfs/dbraw/zinc/28/79/96/1040287996.db2.gz PPDFPADSVUYCGF-UKTHLTGXSA-N -1 3 347.256 4.436 20 0 EIADHM CCCc1cc(=O)[n-]c(C(=Cc2nccn2Cc2ccccc2)CC)n1 ZINC000435339967 1040296407 /nfs/dbraw/zinc/29/64/07/1040296407.db2.gz ZUAOQOFTHQDAMU-GHRIWEEISA-N -1 3 348.450 4.330 20 0 EIADHM CC(C)COc1ccccc1CNC(=O)c1cc([O-])ccc1Cl ZINC000514893031 1040316408 /nfs/dbraw/zinc/31/64/08/1040316408.db2.gz AKBUPHXIQZWREH-UHFFFAOYSA-N -1 3 333.815 4.010 20 0 EIADHM O=C([O-])C[C@H](NCc1cc(Cl)cc(Cl)c1)c1cccs1 ZINC000037424424 1040371271 /nfs/dbraw/zinc/37/12/71/1040371271.db2.gz PNCUADLQQZOVFR-LBPRGKRZSA-N -1 3 330.236 4.361 20 0 EIADHM O=C(CSc1ccccc1Cl)Nc1c([O-])cccc1Cl ZINC000514976525 1040400569 /nfs/dbraw/zinc/40/05/69/1040400569.db2.gz TUPYMBIPLJWVLB-UHFFFAOYSA-N -1 3 328.220 4.430 20 0 EIADHM CCc1cc(=O)[n-]c(CSCc2ncc(-c3ccc(C)cc3)o2)n1 ZINC000477348507 1040439200 /nfs/dbraw/zinc/43/92/00/1040439200.db2.gz DOASATKPPHAPKV-UHFFFAOYSA-N -1 3 341.436 4.141 20 0 EIADHM CSc1ccc(C=C(Cc2ccccc2)c2nccc(=O)[n-]2)cc1 ZINC000477413741 1040488725 /nfs/dbraw/zinc/48/87/25/1040488725.db2.gz OKPBAPJWGHQDLH-VKAVYKQESA-N -1 3 334.444 4.275 20 0 EIADHM CCc1nc2c(s1)[C@H](N(C)Cc1c(F)ccc([O-])c1F)CCC2 ZINC000508854840 1040541686 /nfs/dbraw/zinc/54/16/86/1040541686.db2.gz HKKZUYGYVFEMPJ-CYBMUJFWSA-N -1 3 338.423 4.199 20 0 EIADHM Cc1ccc(CCCC(=O)Nc2ccc(Br)cc2[O-])cc1 ZINC000515503355 1040824518 /nfs/dbraw/zinc/82/45/18/1040824518.db2.gz QBEQJSQRGBTZAR-UHFFFAOYSA-N -1 3 348.240 4.425 20 0 EIADHM CCc1ccc([O-])c(C(=O)N(CC)[C@@H](C)c2cccc(OC)c2)c1 ZINC000539855585 1040842954 /nfs/dbraw/zinc/84/29/54/1040842954.db2.gz XRIMDQIXVJTWOP-AWEZNQCLSA-N -1 3 327.424 4.187 20 0 EIADHM CCOc1ccc([N-]S(=O)(=O)c2ccccc2C(C)(C)C)c(C)c1 ZINC000460826717 1040965808 /nfs/dbraw/zinc/96/58/08/1040965808.db2.gz IHFHBBASPBTLLS-UHFFFAOYSA-N -1 3 347.480 4.492 20 0 EIADHM C[C@@H]1[C@H](C(=O)[N-][C@H](c2ccc(F)c(Cl)c2)C(F)(F)F)C1(F)F ZINC000436445918 1041248409 /nfs/dbraw/zinc/24/84/09/1041248409.db2.gz CVJWZQKRELIQNZ-UAINPKIQSA-N -1 3 345.670 4.100 20 0 EIADHM Cc1cc(C)c(/C=C\CNCc2cc(F)c(C(=O)[O-])c(F)c2)c(C)c1 ZINC000904017573 1041260229 /nfs/dbraw/zinc/26/02/29/1041260229.db2.gz LBYYHBROQHBTSE-PLNGDYQASA-N -1 3 345.389 4.391 20 0 EIADHM CC(C)Sc1cccc(Cl)c1CN[C@H]1C=CC[C@H](C(=O)[O-])C1 ZINC000904035887 1041284050 /nfs/dbraw/zinc/28/40/50/1041284050.db2.gz TVDCBSQRRVYXFX-STQMWFEESA-N -1 3 339.888 4.350 20 0 EIADHM CC(C)(C)c1nc(CN[C@@H](CCc2ccccc2)CC(=O)[O-])cs1 ZINC000904038533 1041289075 /nfs/dbraw/zinc/28/90/75/1041289075.db2.gz NYOIWLPAHIINOL-HNNXBMFYSA-N -1 3 346.496 4.006 20 0 EIADHM Cc1ccc(C(=O)N2CCS[C@@H](C)[C@H]2c2ccccc2)c([O-])c1 ZINC000436526886 1041310292 /nfs/dbraw/zinc/31/02/92/1041310292.db2.gz FRFQDPCRFZZPIB-KSSFIOAISA-N -1 3 327.449 4.019 20 0 EIADHM CSCC[C@H](C)N(C)C(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436532746 1041315291 /nfs/dbraw/zinc/31/52/91/1041315291.db2.gz WUAYKXGOBQOXTQ-HNNXBMFYSA-N -1 3 343.492 4.197 20 0 EIADHM O=C(c1ccccc1[O-])N(CCc1ccc(Cl)cc1)CC1CC1 ZINC000436549531 1041325899 /nfs/dbraw/zinc/32/58/99/1041325899.db2.gz GDDSFHHKYDHWNO-UHFFFAOYSA-N -1 3 329.827 4.141 20 0 EIADHM COC(=O)c1cnc(SCc2sc3ccccc3c2Cl)[n-]1 ZINC000484577666 1041330643 /nfs/dbraw/zinc/33/06/43/1041330643.db2.gz RPBAHJNZTIGWSR-UHFFFAOYSA-N -1 3 338.841 4.357 20 0 EIADHM CSCC[C@@H](C)N(C)C(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436539082 1041333127 /nfs/dbraw/zinc/33/31/27/1041333127.db2.gz SFNNKZYUFBFRTF-CQSZACIVSA-N -1 3 345.464 4.398 20 0 EIADHM CN(C(=O)c1cc(Oc2ccccc2)ccc1[O-])C(C1CC1)C1CC1 ZINC000436541639 1041335399 /nfs/dbraw/zinc/33/53/99/1041335399.db2.gz YTDZRIGLRKUXKF-UHFFFAOYSA-N -1 3 337.419 4.445 20 0 EIADHM CCc1ccc(-c2nc(C3(c4ccccc4OC)CC3)no2)c([O-])c1 ZINC000436561412 1041344357 /nfs/dbraw/zinc/34/43/57/1041344357.db2.gz BWBRLLWNMSXSGF-UHFFFAOYSA-N -1 3 336.391 4.093 20 0 EIADHM O=C(Nc1cc(Cl)c([O-])c(Cl)c1)[C@@H]1CCCN1C1CCCC1 ZINC000463103294 1041346381 /nfs/dbraw/zinc/34/63/81/1041346381.db2.gz DWKJPSGZTZSFCN-AWEZNQCLSA-N -1 3 343.254 4.045 20 0 EIADHM O=C(c1ccccc1[O-])N(Cc1cc(F)ccc1F)C1CCCC1 ZINC000436585412 1041361341 /nfs/dbraw/zinc/36/13/41/1041361341.db2.gz QANMYMVKRICROT-UHFFFAOYSA-N -1 3 331.362 4.255 20 0 EIADHM CC[C@H]1CCCC[C@H]1c1noc(-c2cc(OC)c([O-])c(OC)c2)n1 ZINC000436588679 1041362716 /nfs/dbraw/zinc/36/27/16/1041362716.db2.gz ITKGXFRULQNRJW-WCQYABFASA-N -1 3 332.400 4.143 20 0 EIADHM CC[C@H]1CN(C(=O)c2ccc(OC)cc2[O-])CC[C@H]1c1ccccc1 ZINC000436587257 1041363643 /nfs/dbraw/zinc/36/36/43/1041363643.db2.gz OWPSDGPSSMESEO-MAUKXSAKSA-N -1 3 339.435 4.057 20 0 EIADHM CC(C)c1ccc(C(=O)N2CCC[C@H](Nc3ccccc3)C2)c([O-])c1 ZINC000436600173 1041365196 /nfs/dbraw/zinc/36/51/96/1041365196.db2.gz DKZJJXQIYVXWGN-SFHVURJKSA-N -1 3 338.451 4.232 20 0 EIADHM CC(C)c1ccc(C(=O)N(CCc2nccs2)C(C)C)c([O-])c1 ZINC000436599249 1041366066 /nfs/dbraw/zinc/36/60/66/1041366066.db2.gz ACUABGADXAMOAZ-UHFFFAOYSA-N -1 3 332.469 4.065 20 0 EIADHM COc1ccc(C(=O)N2CCCC[C@@H]2c2ccc(F)cc2F)c([O-])c1 ZINC000436604847 1041369247 /nfs/dbraw/zinc/36/92/47/1041369247.db2.gz OEJVWXXUZOUSFS-QGZVFWFLSA-N -1 3 347.361 4.046 20 0 EIADHM Cc1ccc(C(=O)Nc2ccc(NC(=O)CC(C)C)cc2)c([O-])c1C ZINC000436667186 1041408234 /nfs/dbraw/zinc/40/82/34/1041408234.db2.gz TVIQNWVEJYDOKY-UHFFFAOYSA-N -1 3 340.423 4.246 20 0 EIADHM CC(C)Oc1ncccc1-c1noc(-c2ccc(C(C)C)cc2[O-])n1 ZINC000436685480 1041421350 /nfs/dbraw/zinc/42/13/50/1041421350.db2.gz CIBMDUIIHKTPMZ-UHFFFAOYSA-N -1 3 339.395 4.415 20 0 EIADHM COc1ccc(C(=O)N2Cc3ccccc3-c3ccccc3C2)c([O-])c1 ZINC000436696152 1041427005 /nfs/dbraw/zinc/42/70/05/1041427005.db2.gz GRSXYUPPQLZZBX-UHFFFAOYSA-N -1 3 345.398 4.224 20 0 EIADHM O=C(c1cc(CCc2ccccc2)ccc1[O-])N1CCC[C@@H]1C(F)F ZINC000436696846 1041430079 /nfs/dbraw/zinc/43/00/79/1041430079.db2.gz JPMHFRNYBPQSFR-QGZVFWFLSA-N -1 3 345.389 4.047 20 0 EIADHM Cc1cccc(C(=O)Nc2nnc(-c3ccccc3Cl)s2)c1[O-] ZINC000436714565 1041438977 /nfs/dbraw/zinc/43/89/77/1041438977.db2.gz GFSYZSXODBWNLV-UHFFFAOYSA-N -1 3 345.811 4.125 20 0 EIADHM Cc1ccc(C(=O)N2C[C@H]3CCCCN3c3ccccc32)c([O-])c1C ZINC000436738443 1041447789 /nfs/dbraw/zinc/44/77/89/1041447789.db2.gz NWJMBJDTGFJGOB-MRXNPFEDSA-N -1 3 336.435 4.028 20 0 EIADHM CCC[C@H](Cc1ccccc1)N(CCC)C(=O)c1ccc(O)cc1[O-] ZINC000436750409 1041463245 /nfs/dbraw/zinc/46/32/45/1041463245.db2.gz WPSKOZJFXWYZMV-QGZVFWFLSA-N -1 3 341.451 4.361 20 0 EIADHM CC[C@@H](c1ccccc1)N(CC)C(=O)c1cc(OC)c([O-])c(OC)c1 ZINC000436782223 1041473816 /nfs/dbraw/zinc/47/38/16/1041473816.db2.gz MTEPVFBZSZWOHO-INIZCTEOSA-N -1 3 343.423 4.023 20 0 EIADHM CCc1ccc(C(=O)N2CC[C@@H](CSc3ccccc3)C2)c([O-])c1 ZINC000436835092 1041498133 /nfs/dbraw/zinc/49/81/33/1041498133.db2.gz UDHUUDJJBFLEOI-MRXNPFEDSA-N -1 3 341.476 4.209 20 0 EIADHM CCc1ccc(C(=O)N2CC[C@@H](c3ccc(Cl)cc3)C2)c([O-])c1 ZINC000436824194 1041501377 /nfs/dbraw/zinc/50/13/77/1041501377.db2.gz FWEFVQWFFLSWAL-OAHLLOKOSA-N -1 3 329.827 4.238 20 0 EIADHM Cc1ccc(C(=O)N2CCC([C@@H](F)c3ccccc3F)CC2)c([O-])c1 ZINC000436838406 1041506699 /nfs/dbraw/zinc/50/66/99/1041506699.db2.gz KIHZTMMAIUGECO-LJQANCHMSA-N -1 3 345.389 4.403 20 0 EIADHM O=C(c1cc(CCc2ccccc2)ccc1[O-])N1CC[C@@H]2CCC[C@@H]21 ZINC000436838576 1041506714 /nfs/dbraw/zinc/50/67/14/1041506714.db2.gz ROROKRMZUFQPSM-ICSRJNTNSA-N -1 3 335.447 4.192 20 0 EIADHM COc1cccc(C(=O)Nc2sc(-c3ccccc3)nc2C)c1[O-] ZINC000436838943 1041507548 /nfs/dbraw/zinc/50/75/48/1041507548.db2.gz SLILORHYIVMCLJ-UHFFFAOYSA-N -1 3 340.404 4.085 20 0 EIADHM CCc1ccc(-c2nc(Cc3c[nH]c4cccc(OC)c34)no2)c([O-])c1 ZINC000436856744 1041507720 /nfs/dbraw/zinc/50/77/20/1041507720.db2.gz NLEHURKQIHUEPJ-UHFFFAOYSA-N -1 3 349.390 4.085 20 0 EIADHM CC(C)c1ccc(C(=O)N2CC[C@H](C(F)(F)F)C2(C)C)c([O-])c1 ZINC000436863610 1041522089 /nfs/dbraw/zinc/52/20/89/1041522089.db2.gz JPUYNCGKTJCTOU-AWEZNQCLSA-N -1 3 329.362 4.319 20 0 EIADHM CC(C)c1ccc(C(=O)N2CC[C@@H](C(F)(F)F)C2(C)C)c([O-])c1 ZINC000436863611 1041523480 /nfs/dbraw/zinc/52/34/80/1041523480.db2.gz JPUYNCGKTJCTOU-CQSZACIVSA-N -1 3 329.362 4.319 20 0 EIADHM Cc1ccc([O-])c(C(=O)Nc2cccc(OCC(F)(F)F)c2C)c1 ZINC000538789108 1041543903 /nfs/dbraw/zinc/54/39/03/1041543903.db2.gz CZOSHZUANGCDFM-UHFFFAOYSA-N -1 3 339.313 4.202 20 0 EIADHM COC(=O)c1cccc(-c2noc(-c3ccc(C(C)C)cc3[O-])n2)c1 ZINC000436888417 1041543869 /nfs/dbraw/zinc/54/38/69/1041543869.db2.gz RPQHIEHZNKWECL-UHFFFAOYSA-N -1 3 338.363 4.019 20 0 EIADHM Cc1ccc(-c2nc(-c3cc(N(C)C)nc4ccccc43)no2)c([O-])c1 ZINC000436938588 1041567630 /nfs/dbraw/zinc/56/76/30/1041567630.db2.gz JWUYBOQNVMERFC-UHFFFAOYSA-N -1 3 346.390 4.032 20 0 EIADHM CCCCOc1ccc(C(=O)N2CC[C@@H]2Cc2ccccc2)c([O-])c1 ZINC000436987131 1041582546 /nfs/dbraw/zinc/58/25/46/1041582546.db2.gz LUCSMXDAQBTTAO-QGZVFWFLSA-N -1 3 339.435 4.028 20 0 EIADHM CC(C)c1ccc(-c2nc(CCn3cnc4ccccc43)no2)c([O-])c1 ZINC000436995750 1041586788 /nfs/dbraw/zinc/58/67/88/1041586788.db2.gz DRMNUTOTIKHMDC-UHFFFAOYSA-N -1 3 348.406 4.158 20 0 EIADHM COc1ccc(OC)c(-c2noc(-c3cc4ccccc4cc3[O-])n2)c1 ZINC000436995781 1041586934 /nfs/dbraw/zinc/58/69/34/1041586934.db2.gz DVJOHIJROMNBFL-UHFFFAOYSA-N -1 3 348.358 4.280 20 0 EIADHM COc1ccc(Cc2noc(-c3ccc(C(C)C)cc3[O-])n2)cc1F ZINC000437006995 1041589951 /nfs/dbraw/zinc/58/99/51/1041589951.db2.gz YTXUSAIMFSXOBT-UHFFFAOYSA-N -1 3 342.370 4.304 20 0 EIADHM COc1ccc(OC)c(-c2noc(-c3ccc(C(C)C)cc3[O-])n2)c1 ZINC000437002062 1041595395 /nfs/dbraw/zinc/59/53/95/1041595395.db2.gz SFPCCSQFEHUDDP-UHFFFAOYSA-N -1 3 340.379 4.250 20 0 EIADHM C[C@H](NC(=O)c1cc([O-])ccc1Cl)c1cc2cccc(F)c2o1 ZINC000505985880 1041681874 /nfs/dbraw/zinc/68/18/74/1041681874.db2.gz DAUDVZMRZIZLKY-VIFPVBQESA-N -1 3 333.746 4.422 20 0 EIADHM O=C(Cc1cccc(Cl)c1)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000473588143 1042126609 /nfs/dbraw/zinc/12/66/09/1042126609.db2.gz ISFRPACIXMSTFP-UHFFFAOYSA-N -1 3 329.705 4.246 20 0 EIADHM CC(C)[C@@H]1CCN(Cc2nc(=O)c3c(-c4ccco4)csc3[n-]2)C1 ZINC000438489091 1042208752 /nfs/dbraw/zinc/20/87/52/1042208752.db2.gz IQAYQEFESAWUFB-GFCCVEGCSA-N -1 3 343.452 4.135 20 0 EIADHM Cc1cc(F)ccc1[N-]S(=O)(=O)c1ccc(C)c(C(F)(F)F)c1 ZINC000303059478 1042276025 /nfs/dbraw/zinc/27/60/25/1042276025.db2.gz XRDVGINYQJBESZ-UHFFFAOYSA-N -1 3 347.333 4.262 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2cccc(CC(F)(F)F)c2)c(C)c1 ZINC000438754408 1042333529 /nfs/dbraw/zinc/33/35/29/1042333529.db2.gz KLLSVEZERAZSBF-UHFFFAOYSA-N -1 3 343.370 4.209 20 0 EIADHM CC[C@H](O[C@@H]1CCC[C@@H](C)C1)C(=O)Nc1cc(Cl)ccc1[O-] ZINC000439097178 1042491913 /nfs/dbraw/zinc/49/19/13/1042491913.db2.gz LWYFQXWOBNQDAY-KFNAQCHYSA-N -1 3 325.836 4.358 20 0 EIADHM CC(C)(C)[C@H](NCc1nc(=O)c2sccc2[n-]1)c1cccc(F)c1 ZINC000299075802 1042577547 /nfs/dbraw/zinc/57/75/47/1042577547.db2.gz TVUIYKWLYUVJFA-MRXNPFEDSA-N -1 3 345.443 4.413 20 0 EIADHM Cc1cc(=O)[n-]c([C@H](C)N2CCC(F)(c3cccc(Cl)c3)CC2)n1 ZINC000439324993 1042588278 /nfs/dbraw/zinc/58/82/78/1042588278.db2.gz SMCIRDWDFSHXTF-ZDUSSCGKSA-N -1 3 349.837 4.166 20 0 EIADHM O=S(=O)([N-]c1cccc(F)c1F)c1cccc(-c2ccccc2)c1 ZINC000506653715 1042740296 /nfs/dbraw/zinc/74/02/96/1042740296.db2.gz LGTASZILZDMJJD-UHFFFAOYSA-N -1 3 345.370 4.433 20 0 EIADHM COc1cc(C/N=C/c2cc(Cl)ccc2[O-])ccc1OC(C)C ZINC000029022638 1042910905 /nfs/dbraw/zinc/91/09/05/1042910905.db2.gz KXSLFFALHGOQNS-RGVLZGJSSA-N -1 3 333.815 4.461 20 0 EIADHM [O-]c1cc(F)cc(CNc2ccc3oc(C(F)(F)F)nc3c2)c1 ZINC000185590635 1043200413 /nfs/dbraw/zinc/20/04/13/1043200413.db2.gz WDXSSCDTSUSTBX-UHFFFAOYSA-N -1 3 326.249 4.303 20 0 EIADHM COc1ccc(C)cc1[N-]S(=O)(=O)/C=C\c1ccccc1Cl ZINC000727349316 1043204338 /nfs/dbraw/zinc/20/43/38/1043204338.db2.gz AVISCEFLCOWAOG-KTKRTIGZSA-N -1 3 337.828 4.070 20 0 EIADHM COc1ccc2c(c1)CCCN(C(=O)c1cc([O-])c3ccccc3c1)C2 ZINC000527157990 1043250597 /nfs/dbraw/zinc/25/05/97/1043250597.db2.gz VPXRLDKLXYWJCV-UHFFFAOYSA-N -1 3 347.414 4.143 20 0 EIADHM O=C(Nc1nccn1Cc1ccccc1)c1cc([O-])c2ccccc2c1 ZINC000527160804 1043251365 /nfs/dbraw/zinc/25/13/65/1043251365.db2.gz WTUXPBTWDFXCAE-UHFFFAOYSA-N -1 3 343.386 4.043 20 0 EIADHM COCCN(C(=O)c1cc([O-])c2ccccc2c1)[C@H](C)c1ccccc1 ZINC000527163471 1043251736 /nfs/dbraw/zinc/25/17/36/1043251736.db2.gz UBSRXIQWVPIHFZ-MRXNPFEDSA-N -1 3 349.430 4.395 20 0 EIADHM C[C@]1(c2ccccc2)CCN(C(=O)c2cc([O-])c3ccccc3c2)C1 ZINC000527176132 1043253614 /nfs/dbraw/zinc/25/36/14/1043253614.db2.gz CSWXCGQXZHBUSF-QFIPXVFZSA-N -1 3 331.415 4.349 20 0 EIADHM CCN(Cc1ccc(OC)cc1)C(=O)c1cc([O-])c2ccccc2c1 ZINC000527448580 1043261545 /nfs/dbraw/zinc/26/15/45/1043261545.db2.gz OYLSJJGXDNHOAJ-UHFFFAOYSA-N -1 3 335.403 4.216 20 0 EIADHM O=C(NCC1(c2ccncc2)CCCC1)c1cc([O-])c2ccccc2c1 ZINC000527459111 1043262687 /nfs/dbraw/zinc/26/26/87/1043262687.db2.gz UODIVGSKISCSEP-UHFFFAOYSA-N -1 3 346.430 4.182 20 0 EIADHM Cc1ccc([C@H](C)C(=O)Nc2c(C)c(Br)ccc2[O-])o1 ZINC001117776919 1043294223 /nfs/dbraw/zinc/29/42/23/1043294223.db2.gz SFHAUIWDOVITOC-JTQLQIEISA-N -1 3 338.201 4.107 20 0 EIADHM C[C@H](NC(=O)c1c[n-]c2ccccc2c1=O)c1csc2ccccc21 ZINC000729976726 1043422712 /nfs/dbraw/zinc/42/27/12/1043422712.db2.gz FBJBCWRGVLEGDR-LBPRGKRZSA-N -1 3 348.427 4.234 20 0 EIADHM CCOC(=O)Nc1ccc(OC(=O)c2cc(Cl)c(Cl)[n-]2)cc1 ZINC000730784105 1043622808 /nfs/dbraw/zinc/62/28/08/1043622808.db2.gz LYUASTQMQAYFBE-UHFFFAOYSA-N -1 3 343.166 4.109 20 0 EIADHM COc1cc(COC(=O)c2cc(Cl)c(Cl)[n-]2)ccc1SC ZINC000731702181 1043819029 /nfs/dbraw/zinc/81/90/29/1043819029.db2.gz PYGWGSUHFGJFCC-UHFFFAOYSA-N -1 3 346.235 4.409 20 0 EIADHM Cc1sc2[n-]c([C@@H](C)OC(=O)/C=C\C(C)(C)C)nc(=O)c2c1C ZINC000732401423 1043913564 /nfs/dbraw/zinc/91/35/64/1043913564.db2.gz GEICICHGHMWWQT-GQYWMQPJSA-N -1 3 334.441 4.220 20 0 EIADHM Cc1cc(O[C@@H](C)c2ccc(F)c(Br)c2)[n-]c(=S)n1 ZINC001226799591 1044153450 /nfs/dbraw/zinc/15/34/50/1044153450.db2.gz XLQJRMVMAAOCBD-QMMMGPOBSA-N -1 3 343.221 4.115 20 0 EIADHM C[C@H](c1cccc(Br)c1)N1CCC[C@@H](CCC(=O)[O-])C1 ZINC000226454862 1044212605 /nfs/dbraw/zinc/21/26/05/1044212605.db2.gz FQYCKDYKDZLPLI-OLZOCXBDSA-N -1 3 340.261 4.087 20 0 EIADHM COc1cccc([O-])c1C(=O)N[C@@H]1C[C@H](C)C[C@@H](c2ccccc2)C1 ZINC001299308694 1044340445 /nfs/dbraw/zinc/34/04/45/1044340445.db2.gz GQTUQIMSRNFUAA-DJIMGWMZSA-N -1 3 339.435 4.103 20 0 EIADHM Cc1ccccc1-c1cc(=NC(=O)C2CC(c3cccc(F)c3)C2)[nH][n-]1 ZINC000522224045 1044395774 /nfs/dbraw/zinc/39/57/74/1044395774.db2.gz OAKQEMOEJBESTA-UHFFFAOYSA-N -1 3 349.409 4.078 20 0 EIADHM COc1ccc2cccc(Cc3noc(-c4ccccc4[O-])n3)c2c1 ZINC000327024935 1044429433 /nfs/dbraw/zinc/42/94/33/1044429433.db2.gz JLGYBFHFHFHISL-UHFFFAOYSA-N -1 3 332.359 4.195 20 0 EIADHM C[C@@H](c1cccnc1)N(C)C(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000094067925 1044504472 /nfs/dbraw/zinc/50/44/72/1044504472.db2.gz WDUZHSOASNQZIY-INIZCTEOSA-N -1 3 346.430 4.211 20 0 EIADHM CCCCC[C@@H](NC(=O)c1cc(=O)c2ccccc2[n-]1)C(C)(C)C ZINC000734449304 1044576373 /nfs/dbraw/zinc/57/63/73/1044576373.db2.gz WWHXFMGFPCGEDV-GOSISDBHSA-N -1 3 328.456 4.253 20 0 EIADHM Cc1ccccc1C1=CCN(C(=O)CCCc2ccc([O-])c(F)c2)C1 ZINC000469796060 1044662512 /nfs/dbraw/zinc/66/25/12/1044662512.db2.gz INOWSONONLRCDF-UHFFFAOYSA-N -1 3 339.410 4.088 20 0 EIADHM O=C([O-])C[C@@H](NCc1ccccc1C(F)(F)F)c1cccs1 ZINC000315387109 1044876593 /nfs/dbraw/zinc/87/65/93/1044876593.db2.gz DUNQWXKANNCEKE-GFCCVEGCSA-N -1 3 329.343 4.073 20 0 EIADHM Cc1ccccc1CSCc1nc2c3ccccc3oc2c(=O)[n-]1 ZINC000096946758 1044945826 /nfs/dbraw/zinc/94/58/26/1044945826.db2.gz SSVXMAWLFDLVLS-UHFFFAOYSA-N -1 3 336.416 4.411 20 0 EIADHM O=C(N[C@@H](CCc1ccccc1)c1ccccc1)c1ccccc1[O-] ZINC001626085741 1044958211 /nfs/dbraw/zinc/95/82/11/1044958211.db2.gz OTYCMXYGDLJJSP-FQEVSTJZSA-N -1 3 331.415 4.496 20 0 EIADHM O=C([O-])[C@@H](NCc1cccc(Oc2ccccc2)c1)c1ccccc1 ZINC000327498494 1045014371 /nfs/dbraw/zinc/01/43/71/1045014371.db2.gz OUEQUQWAGUEIAG-FQEVSTJZSA-N -1 3 333.387 4.394 20 0 EIADHM O=C(Cc1cccc2ccccc21)[N-]OCc1ccc(Cl)s1 ZINC000738290307 1045053816 /nfs/dbraw/zinc/05/38/16/1045053816.db2.gz XHRKHLWAPGAIKE-UHFFFAOYSA-N -1 3 331.824 4.345 20 0 EIADHM CC[C@H](OC(=O)c1cc(Cl)c(Cl)[n-]1)C(=O)c1ccccc1 ZINC000738602944 1045069219 /nfs/dbraw/zinc/06/92/19/1045069219.db2.gz JQPYKNRPWCDMFH-LBPRGKRZSA-N -1 3 326.179 4.140 20 0 EIADHM COc1ccc([O-])c(C(=O)Nc2nc(-c3ccccc3C)cs2)c1 ZINC000509382438 1045071668 /nfs/dbraw/zinc/07/16/68/1045071668.db2.gz IGCBMMNKWSMZPS-UHFFFAOYSA-N -1 3 340.404 4.085 20 0 EIADHM CCc1ccc(C2CCN(Cc3cc(C(=O)[O-])c(C)o3)CC2)cc1 ZINC000625971737 1045074186 /nfs/dbraw/zinc/07/41/86/1045074186.db2.gz XJAXFCLNWKLHPF-UHFFFAOYSA-N -1 3 327.424 4.228 20 0 EIADHM Cc1oc(C(C)C)cc1C(=O)N=c1cc(-c2cccc(F)c2)o[n-]1 ZINC000509394790 1045097360 /nfs/dbraw/zinc/09/73/60/1045097360.db2.gz OAMOWTGUYMJBOQ-UHFFFAOYSA-N -1 3 328.343 4.180 20 0 EIADHM CC[C@]1(C(=O)[O-])CCCN(Cc2csc(-c3ccc(F)cc3)n2)C1 ZINC000923472995 1045130152 /nfs/dbraw/zinc/13/01/52/1045130152.db2.gz YQARQBXOGACYBJ-SFHVURJKSA-N -1 3 348.443 4.026 20 0 EIADHM COc1cccc(C(=O)N2CCCc3cc(C(C)C)ccc32)c1[O-] ZINC000915165791 1045156539 /nfs/dbraw/zinc/15/65/39/1045156539.db2.gz MXHCKBPEBUYRAY-UHFFFAOYSA-N -1 3 325.408 4.117 20 0 EIADHM CC[C@@](C)([N-]C(=O)C(F)(F)c1cccc(Cl)c1)c1nccs1 ZINC000739602707 1045156867 /nfs/dbraw/zinc/15/68/67/1045156867.db2.gz NMPQPJFXOSSJAE-CQSZACIVSA-N -1 3 344.814 4.330 20 0 EIADHM CC(C)(C(=O)[O-])[C@H]1CCCN(Cc2cc(Cl)ccc2Cl)C1 ZINC000135040032 1045196105 /nfs/dbraw/zinc/19/61/05/1045196105.db2.gz OMLPCYDUNPFURP-LBPRGKRZSA-N -1 3 330.255 4.316 20 0 EIADHM C[C@H](Oc1ccccc1NCc1cc([O-])cc(F)c1)C(F)(F)F ZINC000673735166 1045236462 /nfs/dbraw/zinc/23/64/62/1045236462.db2.gz ZPRDHMRKLGEOQM-JTQLQIEISA-N -1 3 329.293 4.473 20 0 EIADHM CC[C@H](NC(=O)c1c[n-]c2ccccc2c1=O)c1ccc(Cl)cc1 ZINC000053792800 1045355399 /nfs/dbraw/zinc/35/53/99/1045355399.db2.gz LPOMQLGGQHNWOZ-INIZCTEOSA-N -1 3 340.810 4.063 20 0 EIADHM COc1cccc(-c2nc(-c3ccc(Cl)c(Cl)c3)no2)c1[O-] ZINC000316900578 1045459224 /nfs/dbraw/zinc/45/92/24/1045459224.db2.gz UCDSVEARFCLXIL-UHFFFAOYSA-N -1 3 337.162 4.425 20 0 EIADHM C[C@@H](NCc1cc(=O)oc2cc([O-])c(Cl)cc12)c1cccs1 ZINC000915873063 1045532084 /nfs/dbraw/zinc/53/20/84/1045532084.db2.gz XURQKGGXWOCQSY-SECBINFHSA-N -1 3 335.812 4.064 20 0 EIADHM CCOc1cc(C=Cc2nccc(=O)[n-]2)ccc1OCc1ccccc1 ZINC000742221113 1045640521 /nfs/dbraw/zinc/64/05/21/1045640521.db2.gz YVHDYTAYXKVYHX-PKNBQFBNSA-N -1 3 348.402 4.330 20 0 EIADHM [O-]c1ccc(Nc2noc3cc(Br)ccc32)c(F)c1F ZINC001211997592 1045694551 /nfs/dbraw/zinc/69/45/51/1045694551.db2.gz APKVTOFBVPYPKE-UHFFFAOYSA-N -1 3 341.111 4.318 20 0 EIADHM O=C(Nc1ccccc1OC(F)F)c1cc2sccc2c([O-])c1 ZINC000791312854 1045726522 /nfs/dbraw/zinc/72/65/22/1045726522.db2.gz YSRRDVBSLALWQN-UHFFFAOYSA-N -1 3 335.331 4.461 20 0 EIADHM CCS[C@H]1CCC[C@@H](NC(=O)c2cc3sccc3c([O-])c2)C1 ZINC000791378552 1045727704 /nfs/dbraw/zinc/72/77/04/1045727704.db2.gz KHULNZQPJZKUGS-OLZOCXBDSA-N -1 3 335.494 4.401 20 0 EIADHM Cc1cc(=O)[n-]c(CSCc2csc(-c3ccsc3)n2)n1 ZINC000763209616 1045750846 /nfs/dbraw/zinc/75/08/46/1045750846.db2.gz SQEJUVJFORMZBK-UHFFFAOYSA-N -1 3 335.479 4.109 20 0 EIADHM CC(=O)c1ccc(Br)cc1Nc1ccc([O-])c(F)c1F ZINC001212011064 1045831534 /nfs/dbraw/zinc/83/15/34/1045831534.db2.gz PJAMZCYNBIUMIG-UHFFFAOYSA-N -1 3 342.139 4.379 20 0 EIADHM COc1cc(Nc2ccc([O-])c(F)c2F)c(Br)cc1C ZINC001212009578 1045832062 /nfs/dbraw/zinc/83/20/62/1045832062.db2.gz SOWDBTYYARSWGB-UHFFFAOYSA-N -1 3 344.155 4.494 20 0 EIADHM Cc1ccc2c(c1)O[C@@H](C)CN2C(=O)c1cc([O-])c2ccccc2c1 ZINC000792212687 1045881793 /nfs/dbraw/zinc/88/17/93/1045881793.db2.gz BXDPOPSWNHWZEU-AWEZNQCLSA-N -1 3 333.387 4.282 20 0 EIADHM Cc1cc(-n2cccn2)ccc1NC(=O)c1cc([O-])c2ccccc2c1 ZINC000792479627 1045900580 /nfs/dbraw/zinc/90/05/80/1045900580.db2.gz WDIUZPOHXGHXNL-UHFFFAOYSA-N -1 3 343.386 4.292 20 0 EIADHM CCCOc1ccc([N-]S(=O)(=O)c2ccc(C)c(F)c2)c(C)c1 ZINC000614883300 1045904436 /nfs/dbraw/zinc/90/44/36/1045904436.db2.gz MMBAIFNNYMWPBJ-UHFFFAOYSA-N -1 3 337.416 4.032 20 0 EIADHM CCCOc1ccc([N-]S(=O)(=O)c2ccc(C)cc2C)c(C)c1 ZINC000614885349 1045921016 /nfs/dbraw/zinc/92/10/16/1045921016.db2.gz WHHICMSXJSOTQL-UHFFFAOYSA-N -1 3 333.453 4.201 20 0 EIADHM CCc1onc(-c2ccccc2Cl)c1C(=O)[N-]c1cc(C)on1 ZINC000792857998 1046078185 /nfs/dbraw/zinc/07/81/85/1046078185.db2.gz NSDPPCKHIHXBEE-UHFFFAOYSA-N -1 3 331.759 4.106 20 0 EIADHM COc1cc([C@@H](C)NCc2ccc(C(=O)[O-])cc2)ccc1OC(C)C ZINC000263467215 1046291020 /nfs/dbraw/zinc/29/10/20/1046291020.db2.gz KJHBFOYAQUFPJJ-CQSZACIVSA-N -1 3 343.423 4.031 20 0 EIADHM CC(C)O[C@H](CO[N-]C(=O)CCCc1ccccc1)c1ccccc1 ZINC000793836271 1046339010 /nfs/dbraw/zinc/33/90/10/1046339010.db2.gz VKKMIIMJTZLULZ-HXUWFJFHSA-N -1 3 341.451 4.223 20 0 EIADHM C[C@H](NCc1cc(=O)[n-]c(C2CC2)n1)c1cc(Cl)ccc1Cl ZINC000459423170 1046653098 /nfs/dbraw/zinc/65/30/98/1046653098.db2.gz GLXXCCPIGQMSDE-VIFPVBQESA-N -1 3 338.238 4.217 20 0 EIADHM COc1cccc(-c2noc([N-]Cc3cc(-c4ccccc4)on3)n2)c1 ZINC000785800039 1046760247 /nfs/dbraw/zinc/76/02/47/1046760247.db2.gz YZZCQKAICXAFDN-UHFFFAOYSA-N -1 3 348.362 4.012 20 0 EIADHM Cc1cccc(-c2nnc([C@H](C)OC(=O)c3cc4occc4[n-]3)o2)c1 ZINC000786033286 1046803961 /nfs/dbraw/zinc/80/39/61/1046803961.db2.gz YMGYQMYWWWOOTE-NSHDSACASA-N -1 3 337.335 4.037 20 0 EIADHM O=C(OCc1coc(-c2c(F)cccc2F)n1)c1cc2occc2[n-]1 ZINC000786030114 1046804081 /nfs/dbraw/zinc/80/40/81/1046804081.db2.gz CIWAOQUPRNWEKD-UHFFFAOYSA-N -1 3 344.273 4.051 20 0 EIADHM CC[C@@H](OC(=O)c1cc2occc2[n-]1)C(=O)c1ccc(Cl)cc1 ZINC000786030449 1046804362 /nfs/dbraw/zinc/80/43/62/1046804362.db2.gz FXHSGIKUJXXZQI-CQSZACIVSA-N -1 3 331.755 4.233 20 0 EIADHM Cc1nc(-c2ccccc2)sc1C(=O)Nc1cccc([O-])c1F ZINC000128280825 1046806546 /nfs/dbraw/zinc/80/65/46/1046806546.db2.gz ZWOACCKSLUTIRD-UHFFFAOYSA-N -1 3 328.368 4.216 20 0 EIADHM CCC(CC)n1ccc(COC(=O)CCCc2ccc([O-])c(F)c2)n1 ZINC000787849454 1047061881 /nfs/dbraw/zinc/06/18/81/1047061881.db2.gz WNWNQJXXWLIUBR-UHFFFAOYSA-N -1 3 348.418 4.155 20 0 EIADHM C[C@H]1CC[C@@H](c2ccccc2)N(C(=O)NCc2ccc([O-])c(F)c2)C1 ZINC000497801051 1047088468 /nfs/dbraw/zinc/08/84/68/1047088468.db2.gz WJTFDMVIGCSITN-KSSFIOAISA-N -1 3 342.414 4.214 20 0 EIADHM O=C(Nc1cccc([O-])c1F)[C@H]1C[C@@H]1c1cccc(C(F)(F)F)c1 ZINC000128842264 1047112219 /nfs/dbraw/zinc/11/22/19/1047112219.db2.gz VEVYRBDXRLFLHN-NEPJUHHUSA-N -1 3 339.288 4.292 20 0 EIADHM O=C(NCCc1c[nH]c2ccccc12)c1cc2sccc2c([O-])c1 ZINC000788262343 1047145729 /nfs/dbraw/zinc/14/57/29/1047145729.db2.gz LLMZSJXNZHKVLY-UHFFFAOYSA-N -1 3 336.416 4.061 20 0 EIADHM O=C(NCCSc1ccccc1)c1cc2sccc2c([O-])c1 ZINC000788266674 1047150703 /nfs/dbraw/zinc/15/07/03/1047150703.db2.gz PBMOVFIXNFLBBA-UHFFFAOYSA-N -1 3 329.446 4.129 20 0 EIADHM CCOc1cccc([C@H](C)NC(=O)c2cc3sccc3c([O-])c2)c1 ZINC000788294362 1047151386 /nfs/dbraw/zinc/15/13/86/1047151386.db2.gz WICDQFLNEOMUGW-LBPRGKRZSA-N -1 3 341.432 4.497 20 0 EIADHM Cc1csc([C@@H](NC(=O)c2cc3sccc3c([O-])c2)C2CC2)n1 ZINC000788308060 1047153369 /nfs/dbraw/zinc/15/33/69/1047153369.db2.gz SZMPITOAHRCPLE-HNNXBMFYSA-N -1 3 344.461 4.253 20 0 EIADHM CCCCc1nnc(NC(=O)c2cc3sccc3c([O-])c2)s1 ZINC000788276606 1047155197 /nfs/dbraw/zinc/15/51/97/1047155197.db2.gz AGOZVIPIEBRTAI-UHFFFAOYSA-N -1 3 333.438 4.053 20 0 EIADHM O=C(Nc1cnn(Cc2ccccc2)c1)c1cc2sccc2c([O-])c1 ZINC000788287883 1047157484 /nfs/dbraw/zinc/15/74/84/1047157484.db2.gz KPAYZIDQLGWYNN-UHFFFAOYSA-N -1 3 349.415 4.104 20 0 EIADHM O=C(Nc1cccc([O-])c1F)[C@H]1C[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000129262437 1047341962 /nfs/dbraw/zinc/34/19/62/1047341962.db2.gz SMTMGXIKERQVKC-RYUDHWBXSA-N -1 3 339.288 4.292 20 0 EIADHM CC(C)CC[C@@H](N)C(=O)Nc1c([O-])c(Cl)cc(Cl)c1Cl ZINC000638297309 1047370873 /nfs/dbraw/zinc/37/08/73/1047370873.db2.gz AUPYWQDNBLIWRI-SECBINFHSA-N -1 3 339.650 4.054 20 0 EIADHM O=C(O[C@@H](c1ccccn1)C(F)(F)F)c1cc2ccsc2[n-]1 ZINC000747357279 1047372173 /nfs/dbraw/zinc/37/21/73/1047372173.db2.gz GZEVEUZTNRRTQO-NSHDSACASA-N -1 3 326.299 4.085 20 0 EIADHM O=C(Nc1ccc([O-])c(C(F)(F)F)c1)[C@@H]1C[C@]12CCc1ccccc12 ZINC000476174121 1047402084 /nfs/dbraw/zinc/40/20/84/1047402084.db2.gz UCLLGIWKTWAIKK-YJBOKZPZSA-N -1 3 347.336 4.254 20 0 EIADHM CS[C@@H](C)C(=O)Nc1ccc([O-])c(-c2nc3ccccc3s2)c1 ZINC000129478590 1047402425 /nfs/dbraw/zinc/40/24/25/1047402425.db2.gz NINPQRQXMDJUBP-JTQLQIEISA-N -1 3 344.461 4.359 20 0 EIADHM CCO[C@H](CC(=O)Nc1ccc([O-])c(C(F)(F)F)c1)C1=CCCC1 ZINC000476177704 1047402888 /nfs/dbraw/zinc/40/28/88/1047402888.db2.gz WVVVSDYHJXLSJR-OAHLLOKOSA-N -1 3 343.345 4.255 20 0 EIADHM COc1cccc([O-])c1C(=O)NCC(C)(C)c1ccc2ccccc2c1 ZINC001170111544 1047442850 /nfs/dbraw/zinc/44/28/50/1047442850.db2.gz HGJFIRVMXRKSQK-UHFFFAOYSA-N -1 3 349.430 4.262 20 0 EIADHM O=C([N-]Cc1ccc(Cl)c(Cl)c1)C(F)(F)c1ccccc1 ZINC001131102564 1047554816 /nfs/dbraw/zinc/55/48/16/1047554816.db2.gz YAKBIHLICGVWBI-UHFFFAOYSA-N -1 3 330.161 4.402 20 0 EIADHM COc1ccc([O-])c(-c2nc(-c3ccccc3OC3CCC3)no2)c1 ZINC000528257600 1047561370 /nfs/dbraw/zinc/56/13/70/1047561370.db2.gz IHSOQURQRPAGPF-UHFFFAOYSA-N -1 3 338.363 4.049 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(NCC(C)(C)C3CCC3)nc2)n1 ZINC000556242502 1047611606 /nfs/dbraw/zinc/61/16/06/1047611606.db2.gz SPKDUNRCRUQSDF-UHFFFAOYSA-N -1 3 326.444 4.045 20 0 EIADHM Cc1ccc(C(=O)Nc2cccc(COCc3ccco3)c2)c([O-])c1 ZINC000071934939 1047816492 /nfs/dbraw/zinc/81/64/92/1047816492.db2.gz JPTZZCBWJYAEJI-UHFFFAOYSA-N -1 3 337.375 4.263 20 0 EIADHM CCc1ccc(C(=O)N[C@H](C)[C@H](OC)c2ccc(Cl)cc2)c([O-])c1 ZINC001136846345 1047855232 /nfs/dbraw/zinc/85/52/32/1047855232.db2.gz AWKYRFXXWJZMGP-XIKOKIGWSA-N -1 3 347.842 4.114 20 0 EIADHM CCCOc1ccc(CN[C@H](C(=O)[O-])c2cccc(Cl)c2)cc1 ZINC000556671938 1047866795 /nfs/dbraw/zinc/86/67/95/1047866795.db2.gz RAEKZLAALKHWRF-KRWDZBQOSA-N -1 3 333.815 4.044 20 0 EIADHM CC(=O)c1cccc(NC(=O)c2cc3c(ccc4ccccc34)[nH]2)c1[O-] ZINC000556892483 1048137511 /nfs/dbraw/zinc/13/75/11/1048137511.db2.gz JVBOPAWOBUYDOM-UHFFFAOYSA-N -1 3 344.370 4.482 20 0 EIADHM CC(C)(C)c1nsc(NC(=O)c2cc3sccc3c([O-])c2)n1 ZINC001143747652 1048181680 /nfs/dbraw/zinc/18/16/80/1048181680.db2.gz WZMCMHNPTIDWBO-UHFFFAOYSA-N -1 3 333.438 4.008 20 0 EIADHM CCOC(=O)c1cccc2[n-]c(NC(=O)C3(C)CCCCCC3)nc21 ZINC001134940436 1048398880 /nfs/dbraw/zinc/39/88/80/1048398880.db2.gz GDYMCAJVEPQSDB-UHFFFAOYSA-N -1 3 343.427 4.039 20 0 EIADHM CCON(Cc1cc(=O)[n-]c(-c2ccccc2)n1)CC1CCCCC1 ZINC001171199978 1048737996 /nfs/dbraw/zinc/73/79/96/1048737996.db2.gz KJODGQNGPIQFJY-UHFFFAOYSA-N -1 3 341.455 4.183 20 0 EIADHM CCOc1ccc(NC(=O)c2ccc(C)c(C)c2[O-])cc1OCC ZINC001135519020 1048761313 /nfs/dbraw/zinc/76/13/13/1048761313.db2.gz AUUCVNCRCSCPTL-UHFFFAOYSA-N -1 3 329.396 4.059 20 0 EIADHM O=C(Cc1ccc([O-])c(F)c1)N[C@@H](c1ccccc1)C1CCCC1 ZINC001144632067 1048766718 /nfs/dbraw/zinc/76/67/18/1048766718.db2.gz FPIPLOABFVCVRI-FQEVSTJZSA-N -1 3 327.399 4.122 20 0 EIADHM CN(Cc1ccc(Cl)cc1)C(=O)c1cc([O-])c2ccccc2c1 ZINC001135591348 1048818306 /nfs/dbraw/zinc/81/83/06/1048818306.db2.gz KCRQNWMNSJXDAF-UHFFFAOYSA-N -1 3 325.795 4.471 20 0 EIADHM [O-]c1ccc(F)c(CNCc2ccnc(Oc3ccccc3)c2)c1F ZINC000816534413 1048826105 /nfs/dbraw/zinc/82/61/05/1048826105.db2.gz HZNSKLIYUITKSK-UHFFFAOYSA-N -1 3 342.345 4.148 20 0 EIADHM O=C(OCc1ccc(Cl)cn1)c1cc2cc(Cl)sc2[n-]1 ZINC000810705393 1048853172 /nfs/dbraw/zinc/85/31/72/1048853172.db2.gz KDUOGKUNKIGLGH-UHFFFAOYSA-N -1 3 327.192 4.288 20 0 EIADHM CC[C@@H](C)[C@@H](C)N(C(=O)c1cc([O-])cc(Br)c1)C1CC1 ZINC001144848413 1048868826 /nfs/dbraw/zinc/86/88/26/1048868826.db2.gz AJNJDORXZXPXGE-GHMZBOCLSA-N -1 3 340.261 4.194 20 0 EIADHM O=C([N-]c1nc(-c2ccco2)cs1)c1snc(Cl)c1Cl ZINC000816876740 1048875531 /nfs/dbraw/zinc/87/55/31/1048875531.db2.gz CQADVFMKGVUOGU-UHFFFAOYSA-N -1 3 346.220 4.419 20 0 EIADHM C[C@@H]([N-]C(=O)C(F)(F)c1cc(Cl)ccc1Cl)c1cccnc1 ZINC001135772577 1048884283 /nfs/dbraw/zinc/88/42/83/1048884283.db2.gz DAJJGZWXHFSDCY-SECBINFHSA-N -1 3 345.176 4.358 20 0 EIADHM CCn1c(C)cc(C(=O)Nc2ccc([O-])c(C(F)(F)F)c2)c1C ZINC000134182122 1048893922 /nfs/dbraw/zinc/89/39/22/1048893922.db2.gz WVMCIBYVVWONKO-UHFFFAOYSA-N -1 3 326.318 4.102 20 0 EIADHM O=C(N[C@H](c1ccccc1)C(F)F)c1cc2sccc2c([O-])c1 ZINC000817223867 1048910598 /nfs/dbraw/zinc/91/05/98/1048910598.db2.gz CXORJPDUAKLLCP-OAHLLOKOSA-N -1 3 333.359 4.343 20 0 EIADHM CC(C)c1ccc(C(=O)NCCCn2ccc3ccccc32)c([O-])c1 ZINC001135886535 1048949338 /nfs/dbraw/zinc/94/93/38/1048949338.db2.gz DRWPFZKRQOTKSU-UHFFFAOYSA-N -1 3 336.435 4.290 20 0 EIADHM O=C(Nc1cnc2ccccn12)c1cc(Oc2ccccc2)ccc1[O-] ZINC001146339366 1049017793 /nfs/dbraw/zinc/01/77/93/1049017793.db2.gz RYJOETGKOXUPKR-UHFFFAOYSA-N -1 3 345.358 4.085 20 0 EIADHM O=C([N-]c1ccsn1)c1nc(Cl)c(Cl)c(Cl)c1Cl ZINC001132745291 1049028867 /nfs/dbraw/zinc/02/88/67/1049028867.db2.gz QGSKJFJRKLOFOC-UHFFFAOYSA-N -1 3 343.022 4.404 20 0 EIADHM Nc1ccc(C(=O)N(Cc2ccccc2Cl)C2CCCC2)c([O-])c1 ZINC000817935696 1049061922 /nfs/dbraw/zinc/06/19/22/1049061922.db2.gz DAMRNDGZOYVEIA-UHFFFAOYSA-N -1 3 344.842 4.213 20 0 EIADHM CCc1ccc([O-])c(C(=O)N2CC3(CCCC3)[C@@H]2c2ccco2)c1 ZINC001146911235 1049070116 /nfs/dbraw/zinc/07/01/16/1049070116.db2.gz TZTIGYJLFVTZGE-SFHVURJKSA-N -1 3 325.408 4.305 20 0 EIADHM CCc1ccc(C(=O)Nc2ccc(C)c(Br)c2)c([O-])c1 ZINC001136147737 1049169039 /nfs/dbraw/zinc/16/90/39/1049169039.db2.gz PNXARMNMKMNZRJ-UHFFFAOYSA-N -1 3 334.213 4.278 20 0 EIADHM Cc1sc2[n-]c([C@@H](C)OC(=O)[C@@H]3CC34CCCC4)nc(=O)c2c1C ZINC000747733904 1049205701 /nfs/dbraw/zinc/20/57/01/1049205701.db2.gz XRBJLZRIVXNFRI-PWSUYJOCSA-N -1 3 346.452 4.198 20 0 EIADHM CC(C)(C)c1ccc(C(=O)Nc2cc(Br)ccc2[O-])cn1 ZINC001147802843 1049220948 /nfs/dbraw/zinc/22/09/48/1049220948.db2.gz FUPFVKQYAQZAJY-UHFFFAOYSA-N -1 3 349.228 4.100 20 0 EIADHM O=c1ccnc(C=Cc2cc(C(F)(F)F)ccc2Br)[n-]1 ZINC000811691456 1049227566 /nfs/dbraw/zinc/22/75/66/1049227566.db2.gz MYFMVMASTLHTFT-DAFODLJHSA-N -1 3 345.118 4.134 20 0 EIADHM [O-]c1ccc(F)c(CNc2cnc(Cl)c(Br)c2)c1F ZINC000811835064 1049283891 /nfs/dbraw/zinc/28/38/91/1049283891.db2.gz MFVQTCGMQKECQX-UHFFFAOYSA-N -1 3 349.562 4.093 20 0 EIADHM O=C(NCCCC1CCCCC1)c1c[n-]c2c(Cl)cccc2c1=O ZINC001136216565 1049311233 /nfs/dbraw/zinc/31/12/33/1049311233.db2.gz QPEFTUJFHWDCLH-UHFFFAOYSA-N -1 3 346.858 4.272 20 0 EIADHM CCc1ccccc1C(=O)Nc1ccc(C(=O)OC(C)(C)C)cc1[O-] ZINC001148416359 1049314310 /nfs/dbraw/zinc/31/43/10/1049314310.db2.gz LOKBGCWRDNVXTI-UHFFFAOYSA-N -1 3 341.407 4.162 20 0 EIADHM O=S(=O)(/C=C/c1cccc(Cl)c1)[N-]c1cc2c(cn1)CCCC2 ZINC000812333462 1049445205 /nfs/dbraw/zinc/44/52/05/1049445205.db2.gz OMJLZVVREMTSEW-CMDGGOBGSA-N -1 3 348.855 4.026 20 0 EIADHM Cc1sc2[n-]c([C@@H](C)OC(=O)CCCC3CC3)nc(=O)c2c1C ZINC000812601760 1049517982 /nfs/dbraw/zinc/51/79/82/1049517982.db2.gz FTKAPYLBOWQIOK-SNVBAGLBSA-N -1 3 334.441 4.198 20 0 EIADHM CCc1cccc(C(=O)Nc2cc(Cl)c(N)c(Cl)c2)c1[O-] ZINC001136349186 1049522420 /nfs/dbraw/zinc/52/24/20/1049522420.db2.gz LJUZJVWWSNWFRD-UHFFFAOYSA-N -1 3 325.195 4.096 20 0 EIADHM CC(C)c1nsc([N-]C(=O)c2ccc(-c3ccccc3F)o2)n1 ZINC001133406348 1049552223 /nfs/dbraw/zinc/55/22/23/1049552223.db2.gz QJWZSJGNSKAUGO-UHFFFAOYSA-N -1 3 331.372 4.313 20 0 EIADHM COc1cc(SC)ccc1[N-]S(=O)(=O)/C=C/c1ccc(C)cc1 ZINC000773273919 1049683956 /nfs/dbraw/zinc/68/39/56/1049683956.db2.gz IUWBDKSLXDBMIJ-ZHACJKMWSA-N -1 3 349.477 4.138 20 0 EIADHM CCOc1ccc(NC(=O)c2cc3sccc3c([O-])c2)cc1OC ZINC001136515650 1049712502 /nfs/dbraw/zinc/71/25/02/1049712502.db2.gz VDKDLBDWVKWJRU-UHFFFAOYSA-N -1 3 343.404 4.267 20 0 EIADHM O=[N+]([O-])c1ccccc1CN(Cc1cccc(Cl)c1[O-])C1CC1 ZINC000179695492 1049723847 /nfs/dbraw/zinc/72/38/47/1049723847.db2.gz FDIOYNILWHDLHS-UHFFFAOYSA-N -1 3 332.787 4.118 20 0 EIADHM Cc1ccccc1C1(CNC(=O)c2cc([O-])c3ccccc3c2)CC1 ZINC001136547744 1049736636 /nfs/dbraw/zinc/73/66/36/1049736636.db2.gz IVSWTMNPHKDBPW-UHFFFAOYSA-N -1 3 331.415 4.315 20 0 EIADHM C[C@H]1CCCCN1C(=O)c1ccc(NCc2ccc([O-])c(F)c2)cc1 ZINC000813339026 1049755515 /nfs/dbraw/zinc/75/55/15/1049755515.db2.gz YTTCTQKYXKXPFE-AWEZNQCLSA-N -1 3 342.414 4.158 20 0 EIADHM O=C(N[C@@H]1CCc2ccc(F)cc21)c1cc2sccc2c([O-])c1 ZINC000813444333 1049777150 /nfs/dbraw/zinc/77/71/50/1049777150.db2.gz PMSGSSSBEVOPAQ-OAHLLOKOSA-N -1 3 327.380 4.163 20 0 EIADHM O=C(Nc1nccn1Cc1ccccc1)c1cc2sccc2c([O-])c1 ZINC000813425260 1049779153 /nfs/dbraw/zinc/77/91/53/1049779153.db2.gz HTXOLJNABAGECG-UHFFFAOYSA-N -1 3 349.415 4.104 20 0 EIADHM O=C(c1cc2sccc2c([O-])c1)N1Cc2cccc(Cl)c2C1 ZINC000813656513 1049805695 /nfs/dbraw/zinc/80/56/95/1049805695.db2.gz YLLOEGMEVVSUBK-UHFFFAOYSA-N -1 3 329.808 4.416 20 0 EIADHM Cc1cc(=O)[n-]c(-c2ccc(NC(=O)CCCCCC(C)C)cc2)n1 ZINC000747875408 1049818360 /nfs/dbraw/zinc/81/83/60/1049818360.db2.gz LJAFUDLLNAIOQZ-UHFFFAOYSA-N -1 3 341.455 4.290 20 0 EIADHM CC(C)(C)CCCCNC(=O)c1c[n-]c2c(Cl)cccc2c1=O ZINC001136720228 1049846085 /nfs/dbraw/zinc/84/60/85/1049846085.db2.gz GPGQCJVKHSAJMS-UHFFFAOYSA-N -1 3 334.847 4.128 20 0 EIADHM CC(C)Oc1c(F)cc(F)c(Nc2cc(=O)[n-]c(C3CC3)n2)c1F ZINC001212642510 1049860861 /nfs/dbraw/zinc/86/08/61/1049860861.db2.gz BEFVYBBCBYLKEH-UHFFFAOYSA-N -1 3 339.317 4.008 20 0 EIADHM O=C(CCOc1ccc(Cl)cc1)Nc1cc(Cl)ccc1[O-] ZINC000170577838 1049872457 /nfs/dbraw/zinc/87/24/57/1049872457.db2.gz LBBJLEODLIICRU-UHFFFAOYSA-N -1 3 326.179 4.107 20 0 EIADHM C[C@@H]1C[C@@H]1N(Cc1cc(=O)[n-]c(-c2ccccc2)n1)c1ccccc1 ZINC001171047560 1049901075 /nfs/dbraw/zinc/90/10/75/1049901075.db2.gz GBOWTSLRTWZIIW-BEFAXECRSA-N -1 3 331.419 4.264 20 0 EIADHM Cc1ccc(C(=O)Nc2ccc(Oc3ccccn3)cc2)c([O-])c1C ZINC001136834473 1049901716 /nfs/dbraw/zinc/90/17/16/1049901716.db2.gz UFBUGUJDIWMIDL-UHFFFAOYSA-N -1 3 334.375 4.449 20 0 EIADHM Cc1csc(C(=O)[N-]c2nnc(CCC(C)C)s2)c1Cl ZINC000617094831 1049949453 /nfs/dbraw/zinc/94/94/53/1049949453.db2.gz WXCLQUPWRXOZHB-UHFFFAOYSA-N -1 3 329.878 4.402 20 0 EIADHM CCCCOc1ccc(C(=O)N2CCC(c3ccco3)CC2)c([O-])c1 ZINC000617384824 1049987356 /nfs/dbraw/zinc/98/73/56/1049987356.db2.gz RPRIKARZBJQOFA-UHFFFAOYSA-N -1 3 343.423 4.184 20 0 EIADHM Cc1nc(Cl)sc1C(=O)[N-]c1c2nsnc2ccc1Cl ZINC000181261362 1050072579 /nfs/dbraw/zinc/07/25/79/1050072579.db2.gz HQUGJRLTVZHAPQ-UHFFFAOYSA-N -1 3 345.236 4.015 20 0 EIADHM Cc1cc([C@@H]2CCCN2CCCCC(=O)[O-])ccc1Br ZINC000263581912 1050089569 /nfs/dbraw/zinc/08/95/69/1050089569.db2.gz XUKLAJWREMLDAH-HNNXBMFYSA-N -1 3 340.261 4.149 20 0 EIADHM O=C(NCC[C@@H]1CC[C@H]2C[C@H]21)c1cc(CCc2ccccc2)ccc1[O-] ZINC001177997836 1050349479 /nfs/dbraw/zinc/34/94/79/1050349479.db2.gz KMUMVSMCZMYVQF-UFYCRDLUSA-N -1 3 349.474 4.343 20 0 EIADHM CCC[C@@H]1CCCC[C@H]1[N-]S(=O)(=O)c1cc(C)c(Cl)s1 ZINC001186566990 1050361823 /nfs/dbraw/zinc/36/18/23/1050361823.db2.gz QNNWTVNPJKYVON-VXGBXAGGSA-N -1 3 335.922 4.347 20 0 EIADHM CCCCc1ccc(NC(=O)[N-]c2oc(C)nc2C(=O)OCC)cc1 ZINC001187722233 1050610284 /nfs/dbraw/zinc/61/02/84/1050610284.db2.gz NNWPBBYOBGFROA-UHFFFAOYSA-N -1 3 345.399 4.146 20 0 EIADHM Cc1ccc(Cl)c(S(=O)(=O)[N-]C(C(C)C)C(C)C)c1Cl ZINC001188086533 1050697038 /nfs/dbraw/zinc/69/70/38/1050697038.db2.gz BMQGISOTVPDKSU-UHFFFAOYSA-N -1 3 338.300 4.261 20 0 EIADHM COC([O-])=NC(=S)N(c1ccccc1N)c1ccc(C)cc1Cl ZINC001174045924 1050721926 /nfs/dbraw/zinc/72/19/26/1050721926.db2.gz QOZUSPNMKYUNJS-UHFFFAOYSA-N -1 3 349.843 4.010 20 0 EIADHM O=C(Nc1cncc([O-])c1)C1CCC(c2ccc(Cl)cc2)CC1 ZINC001179651487 1050736521 /nfs/dbraw/zinc/73/65/21/1050736521.db2.gz NZJQKOJNYPDOTA-UHFFFAOYSA-N -1 3 330.815 4.353 20 0 EIADHM O=C(Nc1nc2c(cccc2[O-])s1)Nc1cccc(Cl)c1F ZINC001188375111 1050752977 /nfs/dbraw/zinc/75/29/77/1050752977.db2.gz FOLZBJZHROUOHC-UHFFFAOYSA-N -1 3 337.763 4.438 20 0 EIADHM CCCCNC(=O)c1cccc(Nc2nc3c(cccc3[O-])s2)c1 ZINC001174189780 1050826385 /nfs/dbraw/zinc/82/63/85/1050826385.db2.gz YDQMGTQOLURIIY-UHFFFAOYSA-N -1 3 341.436 4.275 20 0 EIADHM Cc1nc(C(F)(F)F)ccc1C(=O)Nc1cc([O-])cc(Cl)c1 ZINC001188734217 1050836708 /nfs/dbraw/zinc/83/67/08/1050836708.db2.gz BRMVUQYBBDAOHO-UHFFFAOYSA-N -1 3 330.693 4.020 20 0 EIADHM COc1ccc(F)c(F)c1Nc1cc(Br)cc(F)c1[O-] ZINC001174424950 1050958188 /nfs/dbraw/zinc/95/81/88/1050958188.db2.gz AQLIVAXXFPDOMW-UHFFFAOYSA-N -1 3 348.118 4.324 20 0 EIADHM CCC1(CC)CCC([N-]S(=O)(=O)c2cc(F)c(F)c(F)c2)CC1 ZINC001189863749 1051072795 /nfs/dbraw/zinc/07/27/95/1051072795.db2.gz QDLGTKITXLBTBJ-UHFFFAOYSA-N -1 3 349.418 4.131 20 0 EIADHM Cc1sccc1C(=O)Nc1n[n-]c(SCc2ccc(C)cc2)n1 ZINC001180842674 1051087253 /nfs/dbraw/zinc/08/72/53/1051087253.db2.gz IUYOJNMSNJLVCC-UHFFFAOYSA-N -1 3 344.465 4.028 20 0 EIADHM O=C(Nc1ccc([O-])c(F)c1)NC1c2ccccc2-c2ccccc21 ZINC001190038170 1051105569 /nfs/dbraw/zinc/10/55/69/1051105569.db2.gz LGKXLRVHLZKDNJ-UHFFFAOYSA-N -1 3 334.350 4.423 20 0 EIADHM [O-]c1cc(Cl)c(Nc2cnn([C@H]3CCCCO3)c2)cc1Cl ZINC001174613733 1051110248 /nfs/dbraw/zinc/11/02/48/1051110248.db2.gz XPLUFADEGDQZIK-CQSZACIVSA-N -1 3 328.199 4.338 20 0 EIADHM COc1ccc(-c2cccc(C(=O)Nc3ccc(F)c([O-])c3)c2)cc1 ZINC001190316660 1051147251 /nfs/dbraw/zinc/14/72/51/1051147251.db2.gz YKCACZYYDJGHGZ-UHFFFAOYSA-N -1 3 337.350 4.459 20 0 EIADHM Cc1ccc(NC(=O)Nc2cccc3nsnc32)c(Cl)c1[O-] ZINC001190312314 1051147293 /nfs/dbraw/zinc/14/72/93/1051147293.db2.gz WKPYIYSROOQBCU-UHFFFAOYSA-N -1 3 334.788 4.003 20 0 EIADHM O=S(=O)([N-]c1cncc(Cl)c1Cl)c1ccc(C2CC2)cc1 ZINC001190472147 1051194733 /nfs/dbraw/zinc/19/47/33/1051194733.db2.gz OTXXNWIGVPRDPP-UHFFFAOYSA-N -1 3 343.235 4.067 20 0 EIADHM Cc1onc(-c2ccccc2)c1C(=O)Nc1ccc(Cl)cc1[O-] ZINC000153661885 1051211781 /nfs/dbraw/zinc/21/17/81/1051211781.db2.gz XAHVUCYMKPANEQ-UHFFFAOYSA-N -1 3 328.755 4.261 20 0 EIADHM O=C(Nc1ccccc1OC(F)(F)F)Nc1cc(F)ccc1[O-] ZINC001190682465 1051255284 /nfs/dbraw/zinc/25/52/84/1051255284.db2.gz YLWWBNBQEWIDBK-UHFFFAOYSA-N -1 3 330.237 4.074 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-][C@H]2CCCCC23CCCC3)c(F)c1F ZINC001190816721 1051284308 /nfs/dbraw/zinc/28/43/08/1051284308.db2.gz BTMWFZYORZVMMS-AWEZNQCLSA-N -1 3 343.439 4.055 20 0 EIADHM O=C(Cc1ccc(Cl)cc1C(F)(F)F)Nc1ccc(F)c([O-])c1 ZINC001181696400 1051290368 /nfs/dbraw/zinc/29/03/68/1051290368.db2.gz FTYZTRUKOWVTCB-UHFFFAOYSA-N -1 3 347.695 4.385 20 0 EIADHM [O-]c1cc(F)c(Nc2ccc(F)c(F)c2Br)c(F)c1 ZINC001175099712 1051344636 /nfs/dbraw/zinc/34/46/36/1051344636.db2.gz GVQDLVMAKHVDRY-UHFFFAOYSA-N -1 3 336.082 4.455 20 0 EIADHM [O-]c1cc(F)c(Nc2ccc3c(cnn3[C@@H]3CCCCO3)c2)c(F)c1 ZINC001175100294 1051347714 /nfs/dbraw/zinc/34/77/14/1051347714.db2.gz PBTFEMLHXCGNRM-KRWDZBQOSA-N -1 3 345.349 4.463 20 0 EIADHM COC(=O)c1ccc(Nc2c(F)cc([O-])cc2F)c(C(F)(F)F)c1 ZINC001175099902 1051348426 /nfs/dbraw/zinc/34/84/26/1051348426.db2.gz FYRYTHZSJIRFHS-UHFFFAOYSA-N -1 3 347.239 4.219 20 0 EIADHM CC(C)(C)OC(=O)c1ccc(Nc2c(F)cc([O-])cc2F)c(O)c1 ZINC001175102545 1051350269 /nfs/dbraw/zinc/35/02/69/1051350269.db2.gz OEFAIQYBQFTUID-UHFFFAOYSA-N -1 3 337.322 4.075 20 0 EIADHM O=C(Nc1cc([O-])cc(Cl)c1)c1cccc(Oc2ccccc2)n1 ZINC001191142793 1051378798 /nfs/dbraw/zinc/37/87/98/1051378798.db2.gz MXVJATUJNBFBGL-UHFFFAOYSA-N -1 3 340.766 4.485 20 0 EIADHM COc1ccc(OC(F)(F)F)cc1Nc1c(F)cc([O-])cc1F ZINC001175096838 1051380466 /nfs/dbraw/zinc/38/04/66/1051380466.db2.gz KAATXGNVRBMLHO-UHFFFAOYSA-N -1 3 335.228 4.321 20 0 EIADHM CC(C)Oc1cc(F)cc(Nc2cc(=O)n(-c3ccccc3)[n-]2)c1 ZINC001175140585 1051409121 /nfs/dbraw/zinc/40/91/21/1051409121.db2.gz NJIUSAFUGWGSEW-UHFFFAOYSA-N -1 3 327.359 4.248 20 0 EIADHM COc1ccc(-c2nnsc2[N-]c2c(F)cc(F)cc2F)cc1 ZINC001175147876 1051413925 /nfs/dbraw/zinc/41/39/25/1051413925.db2.gz XKMUVBCOVWXCSU-UHFFFAOYSA-N -1 3 337.326 4.375 20 0 EIADHM CC(C)c1cccc(C(C)C)c1NC(=O)Nc1cc(=O)[n-]c(=S)[nH]1 ZINC001191615355 1051492699 /nfs/dbraw/zinc/49/26/99/1051492699.db2.gz ARJDBPROORJGFW-UHFFFAOYSA-N -1 3 346.456 4.362 20 0 EIADHM [O-]c1ccc(F)c(Nc2ccc(Br)nc2Cl)c1F ZINC001175262314 1051500353 /nfs/dbraw/zinc/50/03/53/1051500353.db2.gz CJDPHOVWFWAOFV-UHFFFAOYSA-N -1 3 335.535 4.225 20 0 EIADHM Cc1cc(N)c(Nc2c(F)ccc([O-])c2F)cc1Br ZINC001175268367 1051502874 /nfs/dbraw/zinc/50/28/74/1051502874.db2.gz LFNVBLDVLCMZLC-UHFFFAOYSA-N -1 3 329.144 4.067 20 0 EIADHM [O-]c1ccc(F)c(Nc2ccc(OC[C@H]3CCCO3)c(F)c2)c1F ZINC001175268108 1051505224 /nfs/dbraw/zinc/50/52/24/1051505224.db2.gz HTUNDHYCQPXFKM-LLVKDONJSA-N -1 3 339.313 4.111 20 0 EIADHM COC(=O)c1ccc2cc(Nc3c(F)ccc([O-])c3F)ccc2c1 ZINC001175270464 1051506337 /nfs/dbraw/zinc/50/63/37/1051506337.db2.gz ZYBNTOWAWBDPAT-UHFFFAOYSA-N -1 3 329.302 4.354 20 0 EIADHM CC(=O)Nc1ccc(Nc2c(F)ccc([O-])c2F)c(C(F)(F)F)c1 ZINC001175269806 1051507347 /nfs/dbraw/zinc/50/73/47/1051507347.db2.gz MOPKVQFXYIQUDB-UHFFFAOYSA-N -1 3 346.255 4.391 20 0 EIADHM [O-]c1ccc(F)c(Nc2cc(F)c(OCC3CC3)c(F)c2)c1F ZINC001175271093 1051509334 /nfs/dbraw/zinc/50/93/34/1051509334.db2.gz RQOQLFZFDOWILP-UHFFFAOYSA-N -1 3 327.277 4.481 20 0 EIADHM O=S(=O)(Cc1ccc(Cl)cc1F)[N-]c1csc(Cl)c1 ZINC001191865701 1051558056 /nfs/dbraw/zinc/55/80/56/1051558056.db2.gz FFPWQGNNOPKGLG-UHFFFAOYSA-N -1 3 340.228 4.136 20 0 EIADHM c1ccc(COc2cccc(Nc3ccc(-c4nn[n-]n4)cc3)c2)cc1 ZINC001175429309 1051588806 /nfs/dbraw/zinc/58/88/06/1051588806.db2.gz VKUYTMJHUILPCK-UHFFFAOYSA-N -1 3 343.390 4.189 20 0 EIADHM O=C([N-]c1cc(-c2ccccc2F)no1)c1ocnc1-c1ccccc1 ZINC001182600638 1051656407 /nfs/dbraw/zinc/65/64/07/1051656407.db2.gz RFERGBCSFUQRCI-UHFFFAOYSA-N -1 3 349.321 4.388 20 0 EIADHM C[C@@H]1C(=O)CCN(C(=O)c2ccc(C(C)(C)C)cc2[O-])C12CCCC2 ZINC001192322850 1051688758 /nfs/dbraw/zinc/68/87/58/1051688758.db2.gz QCMJVVVBGIBWTN-CQSZACIVSA-N -1 3 343.467 4.054 20 0 EIADHM CN(CCCc1ccccc1)C(=O)c1ccc(C(C)(C)C)cc1[O-] ZINC001192325935 1051692815 /nfs/dbraw/zinc/69/28/15/1051692815.db2.gz KCKCKWUOWXFECP-UHFFFAOYSA-N -1 3 325.452 4.395 20 0 EIADHM CC(C)(C)c1ccc(C(=O)NCc2nccc3ccccc32)c([O-])c1 ZINC001192334997 1051694383 /nfs/dbraw/zinc/69/43/83/1051694383.db2.gz BBGULXBXDYUECR-UHFFFAOYSA-N -1 3 334.419 4.168 20 0 EIADHM CCCCOc1ccc(C(=O)N[C@H](C)CCc2ccc(C)o2)c([O-])c1 ZINC001182823000 1051718578 /nfs/dbraw/zinc/71/85/78/1051718578.db2.gz MLQWHYZEPHHLDU-CQSZACIVSA-N -1 3 345.439 4.224 20 0 EIADHM CC(C)c1ccc(C(=O)N2CC3(CCC3)[C@H]2c2ccncc2)c([O-])c1 ZINC000621170820 1051724524 /nfs/dbraw/zinc/72/45/24/1051724524.db2.gz BPHCACPANJWPRU-LJQANCHMSA-N -1 3 336.435 4.278 20 0 EIADHM COc1cc(F)c(Nc2cc(Br)cc(F)c2[O-])c(F)c1 ZINC001175723838 1051742583 /nfs/dbraw/zinc/74/25/83/1051742583.db2.gz PYVDIXHZPSAFGQ-UHFFFAOYSA-N -1 3 348.118 4.324 20 0 EIADHM C[C@H]1c2sccc2CCN1Cc1cc(=O)[n-]c(-c2ccccc2)n1 ZINC001175830589 1051792176 /nfs/dbraw/zinc/79/21/76/1051792176.db2.gz LFMIRAWEBIVJJC-ZDUSSCGKSA-N -1 3 337.448 4.030 20 0 EIADHM CC(C)Nc1cccc(F)c1[N-]S(=O)(=O)c1cccc(Cl)c1 ZINC000158865592 1051795685 /nfs/dbraw/zinc/79/56/85/1051795685.db2.gz GCTQALZQEFJGBK-UHFFFAOYSA-N -1 3 342.823 4.100 20 0 EIADHM CCOc1cc(CN2CCc3c(cccc3OC)C2)cc(Cl)c1[O-] ZINC000671126554 1051811329 /nfs/dbraw/zinc/81/13/29/1051811329.db2.gz BTJYMWBOTXBDCC-UHFFFAOYSA-N -1 3 347.842 4.011 20 0 EIADHM COc1ccc2c(c1)[n-]cc(C(=O)Nc1cccc(C3CCC3)c1)c2=O ZINC001183611361 1051866175 /nfs/dbraw/zinc/86/61/75/1051866175.db2.gz KJFKHPVXWZCIOV-UHFFFAOYSA-N -1 3 348.402 4.057 20 0 EIADHM CCN(CCc1cccs1)C(=O)c1cc([O-])cc(C(F)(F)F)c1 ZINC000621529373 1051880908 /nfs/dbraw/zinc/88/09/08/1051880908.db2.gz QINRJZAWKWYVEU-UHFFFAOYSA-N -1 3 343.370 4.177 20 0 EIADHM C[C@@H]1CN(C(=O)c2cc(CCc3ccccc3)ccc2[O-])C(C)(C)C1 ZINC001176113946 1051917907 /nfs/dbraw/zinc/91/79/07/1051917907.db2.gz FZTZPHGQDJMHSY-INIZCTEOSA-N -1 3 337.463 4.438 20 0 EIADHM CC(C)(Cc1ccccc1C(F)(F)F)C(=O)Nc1ncccc1[O-] ZINC001183946192 1051930379 /nfs/dbraw/zinc/93/03/79/1051930379.db2.gz JNOGOWBOHQQZSP-UHFFFAOYSA-N -1 3 338.329 4.013 20 0 EIADHM CCN(Cc1cc(=O)[n-]c(-c2ccccc2)n1)c1ccc2[nH]ccc2c1 ZINC001193505690 1051938861 /nfs/dbraw/zinc/93/88/61/1051938861.db2.gz CCPYEIKZNRDWRI-UHFFFAOYSA-N -1 3 344.418 4.357 20 0 EIADHM O=S(=O)(CC1CCC1)[N-]c1ccccc1Sc1ccccc1 ZINC001193514685 1051940634 /nfs/dbraw/zinc/94/06/34/1051940634.db2.gz DXNIBYPTJKLREJ-UHFFFAOYSA-N -1 3 333.478 4.380 20 0 EIADHM CN(C)C(=O)c1cc(Nc2ccc([O-])c(Cl)c2)ccc1Cl ZINC001176155587 1051945680 /nfs/dbraw/zinc/94/56/80/1051945680.db2.gz MEAYTDNLHBPYNX-UHFFFAOYSA-N -1 3 325.195 4.144 20 0 EIADHM Cc1ccc(CCCNC(=O)c2ccc([O-])cc2C(F)(F)F)s1 ZINC001193747239 1051991103 /nfs/dbraw/zinc/99/11/03/1051991103.db2.gz IKMXHMNYEKYDKG-UHFFFAOYSA-N -1 3 343.370 4.144 20 0 EIADHM O=C(NCc1cccc(C(F)F)c1)c1ccc([O-])cc1C(F)(F)F ZINC001193747622 1051991272 /nfs/dbraw/zinc/99/12/72/1051991272.db2.gz KYMSTJJAOUFSFS-UHFFFAOYSA-N -1 3 345.267 4.279 20 0 EIADHM C[C@H](CCc1ccccc1)NC(=O)c1ccc([O-])cc1C(F)(F)F ZINC001193757939 1051991443 /nfs/dbraw/zinc/99/14/43/1051991443.db2.gz IAUNFIODTYFFPE-GFCCVEGCSA-N -1 3 337.341 4.162 20 0 EIADHM O=C(c1cc([O-])cc(C(F)(F)F)c1)N1CC2(CC2)c2ccccc21 ZINC000621878532 1051991465 /nfs/dbraw/zinc/99/14/65/1051991465.db2.gz REEAQSHXZVPLHM-UHFFFAOYSA-N -1 3 333.309 4.103 20 0 EIADHM C[C@H]1[C@H]2C[C@@H](C[C@H]1NC(=O)c1ccc([O-])cc1C(F)(F)F)C2(C)C ZINC001193759206 1051993350 /nfs/dbraw/zinc/99/33/50/1051993350.db2.gz QUZIIVYRXRAKFH-UOJCWERNSA-N -1 3 341.373 4.212 20 0 EIADHM [O-]c1ccc(F)c(CNc2nc3ccccc3n2CC2CC2)c1F ZINC001184461791 1052017587 /nfs/dbraw/zinc/01/75/87/1052017587.db2.gz CQVDRGQTOZXJIS-UHFFFAOYSA-N -1 3 329.350 4.042 20 0 EIADHM [O-]c1cc(Nc2cccc3c2cnn3[C@@H]2CCCCO2)c(F)cc1F ZINC001176314954 1052018931 /nfs/dbraw/zinc/01/89/31/1052018931.db2.gz CNJNNTKKXHKSHH-SFHVURJKSA-N -1 3 345.349 4.463 20 0 EIADHM Cc1ccc(Cl)c(S(=O)(=O)[N-][C@H](C)CCC(C)C)c1Cl ZINC001184523948 1052025707 /nfs/dbraw/zinc/02/57/07/1052025707.db2.gz MODSLAOAACWODS-LLVKDONJSA-N -1 3 338.300 4.405 20 0 EIADHM CCc1ccc(S(=O)(=O)[N-]c2ccc(C)c(-c3ncco3)c2)cc1 ZINC000164744726 1052039790 /nfs/dbraw/zinc/03/97/90/1052039790.db2.gz WGWYDYMUVKQENQ-UHFFFAOYSA-N -1 3 342.420 4.013 20 0 EIADHM Cc1c(Cl)cccc1NC(=O)[N-]c1cc(-c2ccccn2)no1 ZINC001184654191 1052071567 /nfs/dbraw/zinc/07/15/67/1052071567.db2.gz ABEHCYNJQJZENU-UHFFFAOYSA-N -1 3 328.759 4.342 20 0 EIADHM CC(C)[C@@H](NC(=O)Cc1ccc([O-])c(F)c1)c1ccc(Cl)cc1 ZINC000622289691 1052185548 /nfs/dbraw/zinc/18/55/48/1052185548.db2.gz AXUNEYKVUGEVJA-GOSISDBHSA-N -1 3 335.806 4.241 20 0 EIADHM CCc1ccc([O-])c(C(=O)N(CC(C)C)c2cccc(OC)c2)c1 ZINC000622335076 1052213598 /nfs/dbraw/zinc/21/35/98/1052213598.db2.gz OQPDUYJPDSCZOT-UHFFFAOYSA-N -1 3 327.424 4.266 20 0 EIADHM CCc1cccc(C(=O)N(C)CC(C)(C)c2ccc(C)cc2)c1[O-] ZINC000622394301 1052250514 /nfs/dbraw/zinc/25/05/14/1052250514.db2.gz FBFRQTGRFZXULB-UHFFFAOYSA-N -1 3 325.452 4.313 20 0 EIADHM COc1nccc(F)c1C(=O)[N-]c1ccccc1SC(C)(C)C ZINC001185570254 1052262558 /nfs/dbraw/zinc/26/25/58/1052262558.db2.gz HGSWCXJVBGKXJN-UHFFFAOYSA-N -1 3 334.416 4.372 20 0 EIADHM CC(C)(C)[C@H]1CCCN(C(=O)c2cc([O-])cc(C(F)(F)F)c2)C1 ZINC000622574342 1052341739 /nfs/dbraw/zinc/34/17/39/1052341739.db2.gz LQRJUNDUOJJVPT-LBPRGKRZSA-N -1 3 329.362 4.309 20 0 EIADHM Cc1cc(F)ccc1[C@H]1CCCN1C(=O)c1cc([O-])ccc1Cl ZINC000622667626 1052372246 /nfs/dbraw/zinc/37/22/46/1052372246.db2.gz MZAXLONCCWGXFM-QGZVFWFLSA-N -1 3 333.790 4.470 20 0 EIADHM O=C(NCCC1CC(F)(F)C1)c1cc(Cc2ccccc2)ccc1[O-] ZINC000622678794 1052386052 /nfs/dbraw/zinc/38/60/52/1052386052.db2.gz DROZNNUKUYVVFQ-UHFFFAOYSA-N -1 3 345.389 4.148 20 0 EIADHM Cc1cccc(C(=O)Nc2cc(Cl)ccc2OC(F)F)c1[O-] ZINC000622733953 1052400238 /nfs/dbraw/zinc/40/02/38/1052400238.db2.gz XCTCQIJWDUTBQE-UHFFFAOYSA-N -1 3 327.714 4.208 20 0 EIADHM C[C@H](c1ccco1)N(C(=O)c1cc([O-])cc(C(F)(F)F)c1)C1CC1 ZINC000623017388 1052570106 /nfs/dbraw/zinc/57/01/06/1052570106.db2.gz OOOXUTTZRNWCNK-SNVBAGLBSA-N -1 3 339.313 4.370 20 0 EIADHM CCOc1cccc2cc([C@H](C)N[C@@H](C)c3nc(C)cc(=O)[n-]3)oc21 ZINC000192779898 1052638639 /nfs/dbraw/zinc/63/86/39/1052638639.db2.gz WIXUJKZEMIEQES-STQMWFEESA-N -1 3 341.411 4.047 20 0 EIADHM CCc1ccc([O-])c(C(=O)N2CCC(=Cc3cccc(F)c3)CC2)c1 ZINC000623478124 1052665099 /nfs/dbraw/zinc/66/50/99/1052665099.db2.gz XHLLLNWDXGQKFA-UHFFFAOYSA-N -1 3 339.410 4.413 20 0 EIADHM O=C(Nc1cc(F)ccc1[O-])c1[nH]c2ccccc2c1Br ZINC000179649084 1052745421 /nfs/dbraw/zinc/74/54/21/1052745421.db2.gz DTBOKCDBNGQIAD-UHFFFAOYSA-N -1 3 349.159 4.027 20 0 EIADHM O=C(Nc1ccc(Br)cc1[O-])c1ccc(Cl)cc1F ZINC000125986961 1053322157 /nfs/dbraw/zinc/32/21/57/1053322157.db2.gz BIDWICCVVPCYKG-UHFFFAOYSA-N -1 3 344.567 4.200 20 0 EIADHM Cc1ccc(Oc2ccccc2)c(NC([O-])=NO[C@H]2CCCCO2)c1 ZINC000775666542 1053443374 /nfs/dbraw/zinc/44/33/74/1053443374.db2.gz FBNRIQMMCZKGMI-SFHVURJKSA-N -1 3 342.395 4.367 20 0 EIADHM Cc1ccc(Oc2ccccc2)c(NC(=O)[N-]O[C@H]2CCCCO2)c1 ZINC000775666542 1053443382 /nfs/dbraw/zinc/44/33/82/1053443382.db2.gz FBNRIQMMCZKGMI-SFHVURJKSA-N -1 3 342.395 4.367 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])[C@@H](O)c1cc(Cl)cc(Cl)c1 ZINC000765198216 1053464684 /nfs/dbraw/zinc/46/46/84/1053464684.db2.gz KOBBEFUTYUZQSI-ZDUSSCGKSA-N -1 3 346.597 4.025 20 0 EIADHM Cc1ccc(C2=CCN(C(=O)c3cc([O-])c4ccccc4c3)CC2)cn1 ZINC000350766144 1053581456 /nfs/dbraw/zinc/58/14/56/1053581456.db2.gz XDEMBIDVJOUGDE-UHFFFAOYSA-N -1 3 344.414 4.178 20 0 EIADHM O=C([N-]c1ccc2c[nH]nc2c1Cl)c1snc(Cl)c1Cl ZINC001196345164 1053647056 /nfs/dbraw/zinc/64/70/56/1053647056.db2.gz WTWGJDWAWWWKTD-UHFFFAOYSA-N -1 3 347.614 4.232 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N1CCc2[nH]c3ccccc3c2C1 ZINC000471637334 1053677624 /nfs/dbraw/zinc/67/76/24/1053677624.db2.gz WCUUSBFXHBWDTP-UHFFFAOYSA-N -1 3 342.398 4.225 20 0 EIADHM CC(C)C(=O)Nc1cccc(NC(=O)c2cc([O-])c3ccccc3c2)c1 ZINC000471698348 1053686314 /nfs/dbraw/zinc/68/63/14/1053686314.db2.gz UWBGLLIYXYNKGX-UHFFFAOYSA-N -1 3 348.402 4.392 20 0 EIADHM CCOCc1ccc(CNC(=O)c2cc([O-])c3ccccc3c2)cc1 ZINC000471704130 1053686900 /nfs/dbraw/zinc/68/69/00/1053686900.db2.gz BMCOMSMFGOXANT-UHFFFAOYSA-N -1 3 335.403 4.012 20 0 EIADHM CCCc1nnc([N-]C(=O)c2cc(F)c(Cl)cc2Cl)s1 ZINC000017367857 1053695636 /nfs/dbraw/zinc/69/56/36/1053695636.db2.gz KVCXYXOKLGMJFS-UHFFFAOYSA-N -1 3 334.203 4.189 20 0 EIADHM CC(C)c1ccc([C@H](C)N2CC[C@@](C)([N-]C(=O)C(F)(F)F)C2)cc1 ZINC001197168150 1053847950 /nfs/dbraw/zinc/84/79/50/1053847950.db2.gz QFAKUHHXLRQCMP-SUMWQHHRSA-N -1 3 342.405 4.014 20 0 EIADHM [O-]c1ccc(NC(=S)Nc2cccc(F)c2)cc1Br ZINC001197640691 1053956723 /nfs/dbraw/zinc/95/67/23/1053956723.db2.gz DRCZKUHNUJFDAF-UHFFFAOYSA-N -1 3 341.205 4.103 20 0 EIADHM O=C(NCC1CCC(F)(F)CC1)c1cc2sccc2c([O-])c1 ZINC001626041693 1053958110 /nfs/dbraw/zinc/95/81/10/1053958110.db2.gz DYPXXJPTHQAMDN-UHFFFAOYSA-N -1 3 325.380 4.162 20 0 EIADHM CSc1ccccc1[N-]S(=O)(=O)Cc1ccc(Cl)c(F)c1 ZINC001197673285 1053967643 /nfs/dbraw/zinc/96/76/43/1053967643.db2.gz QGOABCPZBUJBJC-UHFFFAOYSA-N -1 3 345.848 4.143 20 0 EIADHM Cc1cc(Cl)c2ccccc2c1NC([O-])=NO[C@H]1CCCCO1 ZINC000775786031 1053989238 /nfs/dbraw/zinc/98/92/38/1053989238.db2.gz RFTQUXIFNUOOPS-HNNXBMFYSA-N -1 3 334.803 4.381 20 0 EIADHM Cc1cc(Cl)c2ccccc2c1NC(=O)[N-]O[C@H]1CCCCO1 ZINC000775786031 1053989244 /nfs/dbraw/zinc/98/92/44/1053989244.db2.gz RFTQUXIFNUOOPS-HNNXBMFYSA-N -1 3 334.803 4.381 20 0 EIADHM O=C(NC1CCC2(CC2(F)F)CC1)c1cc([O-])c2ccccc2c1 ZINC000855959927 1054002275 /nfs/dbraw/zinc/00/22/75/1054002275.db2.gz AAPXJBMRNXTHEU-UHFFFAOYSA-N -1 3 331.362 4.243 20 0 EIADHM Cc1ccc(NC(=S)Nc2c([O-])cccc2Br)cc1 ZINC001197928011 1054026285 /nfs/dbraw/zinc/02/62/85/1054026285.db2.gz LKBJMOIIZYIYNT-UHFFFAOYSA-N -1 3 337.242 4.272 20 0 EIADHM [O-]c1ccc(NC(=S)Nc2ccccc2OC(F)(F)F)cc1F ZINC001198162835 1054088378 /nfs/dbraw/zinc/08/83/78/1054088378.db2.gz HRIBCBRASPGBRE-UHFFFAOYSA-N -1 3 346.305 4.239 20 0 EIADHM O=C([O-])CC[C@@H](NCc1ccncc1)c1ccc(Cl)c(Cl)c1 ZINC000871066334 1054152162 /nfs/dbraw/zinc/15/21/62/1054152162.db2.gz QUEXEQBIPPSRET-OAHLLOKOSA-N -1 3 339.222 4.084 20 0 EIADHM CC(C)(C)c1ccc(NC(=S)Nc2cc(=O)[n-]c(C3CC3)n2)cc1 ZINC001198468287 1054154712 /nfs/dbraw/zinc/15/47/12/1054154712.db2.gz WLVMNXLPVPORGN-UHFFFAOYSA-N -1 3 342.468 4.166 20 0 EIADHM O=C(Cc1coc2cc(Cl)ccc12)[N-]OCCCC(F)(F)F ZINC000871217796 1054172943 /nfs/dbraw/zinc/17/29/43/1054172943.db2.gz TWNKZZORFHGVRI-UHFFFAOYSA-N -1 3 335.709 4.019 20 0 EIADHM COc1ccc([C@@H]2CCN(C(=O)c3cc([O-])c4ccccc4c3)C2)cc1 ZINC000471945732 1054204110 /nfs/dbraw/zinc/20/41/10/1054204110.db2.gz YLZACCQIIPLHTE-QGZVFWFLSA-N -1 3 347.414 4.184 20 0 EIADHM CCOc1ccc(OC)cc1NC(=O)c1cc([O-])c2ccccc2c1 ZINC000472020983 1054207947 /nfs/dbraw/zinc/20/79/47/1054207947.db2.gz HVNQKQBNILHUDI-UHFFFAOYSA-N -1 3 337.375 4.205 20 0 EIADHM Cc1nc(C(C)(C)NC(=O)c2cc([O-])c3ccccc3c2)sc1C ZINC000472155962 1054216606 /nfs/dbraw/zinc/21/66/06/1054216606.db2.gz MTIAMARKCXMOFW-UHFFFAOYSA-N -1 3 340.448 4.284 20 0 EIADHM Cc1cc(F)c([N-]S(=O)(=O)c2ccc3occc3c2)cc1Cl ZINC001198868674 1054292456 /nfs/dbraw/zinc/29/24/56/1054292456.db2.gz LFGUQAOUSTXDCL-UHFFFAOYSA-N -1 3 339.775 4.335 20 0 EIADHM CCOc1cccc(F)c1CNCCC1(CC(=O)[O-])CCCCC1 ZINC000871874487 1054314999 /nfs/dbraw/zinc/31/49/99/1054314999.db2.gz PRENGAMKBPWTBS-UHFFFAOYSA-N -1 3 337.435 4.129 20 0 EIADHM Cc1ccnn1-c1ccccc1NC(=O)c1cc([O-])c2ccccc2c1 ZINC000472501562 1054334172 /nfs/dbraw/zinc/33/41/72/1054334172.db2.gz OAZOOKCYMPTHIK-UHFFFAOYSA-N -1 3 343.386 4.292 20 0 EIADHM C[C@H](NCc1cccc(OCC(F)(F)F)c1)c1cccc([O-])c1F ZINC000872024008 1054336789 /nfs/dbraw/zinc/33/67/89/1054336789.db2.gz XFEUPBXUVRNIIK-NSHDSACASA-N -1 3 343.320 4.323 20 0 EIADHM C[C@@H](N[C@H](C)c1cccc([O-])c1F)c1cccc(N2CCCC2=O)c1 ZINC000872027784 1054343410 /nfs/dbraw/zinc/34/34/10/1054343410.db2.gz LSYRQBSWFPQEQE-ZIAGYGMSSA-N -1 3 342.414 4.070 20 0 EIADHM C[C@H](N[C@@H](C)c1cccc([O-])c1F)c1nc(C(F)(F)F)cs1 ZINC000872067115 1054374342 /nfs/dbraw/zinc/37/43/42/1054374342.db2.gz OIRLPHZSJBWKGY-YUMQZZPRSA-N -1 3 334.338 4.418 20 0 EIADHM C[C@@H](NCc1cc(F)ccc1OC(F)F)c1cccc([O-])c1F ZINC000872089197 1054385353 /nfs/dbraw/zinc/38/53/53/1054385353.db2.gz UZTZJASUPHWVGM-SECBINFHSA-N -1 3 329.293 4.123 20 0 EIADHM C[C@@H](NCc1ccc(OC(F)F)cc1F)c1cccc([O-])c1F ZINC000872090480 1054385385 /nfs/dbraw/zinc/38/53/85/1054385385.db2.gz CAGPLDKKPZIFJE-SECBINFHSA-N -1 3 329.293 4.123 20 0 EIADHM C[C@H](N[C@H](CCO)c1ccc(Cl)c(F)c1)c1cccc([O-])c1F ZINC000872093676 1054386563 /nfs/dbraw/zinc/38/65/63/1054386563.db2.gz WCUCVJJZWBXGOR-ZUZCIYMTSA-N -1 3 341.785 4.098 20 0 EIADHM Cc1cc(C)cc(C2=CCN(Cc3cc(C(=O)[O-])cs3)CC2)c1 ZINC000872159768 1054414038 /nfs/dbraw/zinc/41/40/38/1054414038.db2.gz ZSXXNKHFQZIYBL-UHFFFAOYSA-N -1 3 327.449 4.352 20 0 EIADHM Cc1nc(C2CCN([C@H](C)c3ccc(F)cc3)CC2)sc1C(=O)[O-] ZINC000872165043 1054415698 /nfs/dbraw/zinc/41/56/98/1054415698.db2.gz NROPTXRSWRUVRD-GFCCVEGCSA-N -1 3 348.443 4.229 20 0 EIADHM CC[C@H](C)c1ccccc1NC(=O)[C@@H](C)OC(=O)c1ccc([O-])cc1 ZINC000005061034 1054482518 /nfs/dbraw/zinc/48/25/18/1054482518.db2.gz AJQYFFYTMUZIRV-UONOGXRCSA-N -1 3 341.407 4.090 20 0 EIADHM Cc1cc(NC(=S)Nc2nc3c(cccc3[O-])s2)ccc1F ZINC001201028861 1054638591 /nfs/dbraw/zinc/63/85/91/1054638591.db2.gz PGZIKOSKNRQQOZ-UHFFFAOYSA-N -1 3 333.413 4.258 20 0 EIADHM CCCC1(CCC)CCCN1C(=O)c1cc(=O)c2ccccc2[n-]1 ZINC000874626245 1054704045 /nfs/dbraw/zinc/70/40/45/1054704045.db2.gz LYLGFOPOPHOIKW-UHFFFAOYSA-N -1 3 326.440 4.103 20 0 EIADHM CC1CCC(N(Cn2[n-]c(-c3ccccn3)nc2=S)C2CC2)CC1 ZINC000117319271 1054789506 /nfs/dbraw/zinc/78/95/06/1054789506.db2.gz VZVIBIIQKFIPNO-UHFFFAOYSA-N -1 3 343.500 4.003 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1cnn(-c2ccccc2Cl)c1 ZINC000064657144 1054870548 /nfs/dbraw/zinc/87/05/48/1054870548.db2.gz XHMFDGHXXCKTNZ-UHFFFAOYSA-N -1 3 348.189 4.137 20 0 EIADHM COc1ccc(C)c([N-]S(=O)(=O)c2c(C)c(C)c(C)c(C)c2C)c1 ZINC001201789931 1054919771 /nfs/dbraw/zinc/91/97/71/1054919771.db2.gz POTDRJCXGNMGNG-UHFFFAOYSA-N -1 3 347.480 4.347 20 0 EIADHM CSc1ccc(C(=O)COC(=O)c2cc(Cl)c(Cl)[n-]2)cc1 ZINC000021730490 1054934244 /nfs/dbraw/zinc/93/42/44/1054934244.db2.gz XPCSAAKIHOKTDG-UHFFFAOYSA-N -1 3 344.219 4.083 20 0 EIADHM O=C(Nc1ccc(C(F)(F)F)cc1[O-])N[C@@H]1C[C@H]1c1ccccc1 ZINC001201937908 1054947255 /nfs/dbraw/zinc/94/72/55/1054947255.db2.gz NHZICEAXUKTIHA-GXTWGEPZSA-N -1 3 336.313 4.089 20 0 EIADHM O=C(Nc1ccc(F)cc1F)Nc1c([O-])cccc1Br ZINC001202020257 1054981550 /nfs/dbraw/zinc/98/15/50/1054981550.db2.gz ORAJTCVGBXDLPY-UHFFFAOYSA-N -1 3 343.127 4.077 20 0 EIADHM O=C(Nc1ccc(C(F)(F)F)cc1[O-])Nc1ccc(F)cc1F ZINC001202023302 1054983337 /nfs/dbraw/zinc/98/33/37/1054983337.db2.gz UOYCVKWTLXLXAH-UHFFFAOYSA-N -1 3 332.228 4.333 20 0 EIADHM Cc1ccc(C)c(NC(=O)Nc2ccc(-c3cc(=O)[n-]c(C)n3)cc2)c1 ZINC000339033153 1055013996 /nfs/dbraw/zinc/01/39/96/1055013996.db2.gz PGIGPKSARFROAO-UHFFFAOYSA-N -1 3 348.406 4.418 20 0 EIADHM Cc1cc(C)cc(NC(=O)Nc2ccc(-c3cc(=O)[n-]c(C)n3)cc2)c1 ZINC000339034778 1055038335 /nfs/dbraw/zinc/03/83/35/1055038335.db2.gz YFBWJHPHLPJFSI-UHFFFAOYSA-N -1 3 348.406 4.418 20 0 EIADHM CC1(C)[C@@H](c2cccc(Cl)c2)CCN1C(=O)c1ccc(N)cc1[O-] ZINC000877427868 1055050509 /nfs/dbraw/zinc/05/05/09/1055050509.db2.gz QEFWZZLUUKENKS-MRXNPFEDSA-N -1 3 344.842 4.036 20 0 EIADHM CCc1ccc(CN(Cc2nnc(-c3ccccc3[O-])o2)C2CC2)cc1 ZINC000877956874 1055162689 /nfs/dbraw/zinc/16/26/89/1055162689.db2.gz BPIZRJYUZSBLQQ-UHFFFAOYSA-N -1 3 349.434 4.169 20 0 EIADHM Cc1ccc(C(=O)N2CCC(c3c[nH]c4ccccc43)CC2)c([O-])c1 ZINC000073310688 1055177986 /nfs/dbraw/zinc/17/79/86/1055177986.db2.gz KIDJRGCZFVDNSF-UHFFFAOYSA-N -1 3 334.419 4.202 20 0 EIADHM O=C(NCC1(C(F)(F)F)CCCC1)c1cc([O-])c2ccccc2c1 ZINC000863508323 1055217078 /nfs/dbraw/zinc/21/70/78/1055217078.db2.gz RMNLRHFBWVEWPA-UHFFFAOYSA-N -1 3 337.341 4.398 20 0 EIADHM [O-]c1ccccc1-c1nnc(CN[C@H](c2ccccc2)C2CCCC2)o1 ZINC000878243390 1055221218 /nfs/dbraw/zinc/22/12/18/1055221218.db2.gz BYASBJPGBWKGBL-HXUWFJFHSA-N -1 3 349.434 4.463 20 0 EIADHM O=C(N[C@@H]1CCC[C@H]1Cc1ccccc1)c1cc(=O)c2ccccc2[n-]1 ZINC000265709294 1055642588 /nfs/dbraw/zinc/64/25/88/1055642588.db2.gz UQFMMJQDEINGJE-FUHWJXTLSA-N -1 3 346.430 4.082 20 0 EIADHM CCCN(CCc1ccccn1)C(=O)c1cc([O-])c2ccccc2c1 ZINC000353413669 1055876657 /nfs/dbraw/zinc/87/66/57/1055876657.db2.gz KGVDKJMUTCSFPK-UHFFFAOYSA-N -1 3 334.419 4.035 20 0 EIADHM O=C(CCCOc1ccc(Cl)cc1)Nc1cc(Cl)ccc1[O-] ZINC000111211148 1056774678 /nfs/dbraw/zinc/77/46/78/1056774678.db2.gz DGCMJLXQXKBCTP-UHFFFAOYSA-N -1 3 340.206 4.497 20 0 EIADHM Cc1ccc([N-]S(=O)(=O)c2ccc(Cl)c(Cl)c2)c(F)c1 ZINC000007428118 1056794233 /nfs/dbraw/zinc/79/42/33/1056794233.db2.gz VUULJXIOHGOWNE-UHFFFAOYSA-N -1 3 334.199 4.242 20 0 EIADHM CCCCCC[C@@H](C)C(=O)Nc1ccc(-c2nc(C)cc(=O)[n-]2)cc1 ZINC000741913558 1058451526 /nfs/dbraw/zinc/45/15/26/1058451526.db2.gz OAOLSEFDXSZOMP-CQSZACIVSA-N -1 3 341.455 4.290 20 0 EIADHM CCc1cccc(CC)c1NC(=S)NCc1ccc([O-])c(F)c1 ZINC000737460681 1058530361 /nfs/dbraw/zinc/53/03/61/1058530361.db2.gz CBOQSTRCFCTRRN-UHFFFAOYSA-N -1 3 332.444 4.143 20 0 EIADHM CCOc1cc(C=Cc2nccc(=O)[n-]2)ccc1OCc1ccccc1 ZINC000742221112 1058548275 /nfs/dbraw/zinc/54/82/75/1058548275.db2.gz YVHDYTAYXKVYHX-LUAWRHEFSA-N -1 3 348.402 4.330 20 0 EIADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)C=C(C)C(C)(C)C)c2)n1 ZINC000742548290 1058668769 /nfs/dbraw/zinc/66/87/69/1058668769.db2.gz CCMKBWLQWCNBKE-JLHYYAGUSA-N -1 3 339.439 4.343 20 0 EIADHM Cc1cc(=O)[n-]c(-c2cccc(OC(=O)C[C@@H](C)c3ccccc3)c2)n1 ZINC000744219406 1059334999 /nfs/dbraw/zinc/33/49/99/1059334999.db2.gz RFERPRPQSAHIJV-CQSZACIVSA-N -1 3 348.402 4.257 20 0 EIADHM C[C@@H](OC(=O)c1ccc([O-])cc1)c1nc(-c2ccc(Cl)cc2)no1 ZINC000746058816 1059999647 /nfs/dbraw/zinc/99/96/47/1059999647.db2.gz QXGFOXQMTDFJAF-SNVBAGLBSA-N -1 3 344.754 4.014 20 0 EIADHM O=C(c1cccc(Nc2ccc(Cl)c([O-])c2)c1)N1CCCCC1 ZINC001212592436 1060891048 /nfs/dbraw/zinc/89/10/48/1060891048.db2.gz PUHDJQLEEGNEKU-UHFFFAOYSA-N -1 3 330.815 4.415 20 0 EIADHM [O-]c1cccnc1CNc1nccc2cc(-c3ccc(F)cc3)[nH]c21 ZINC001169734002 1060935835 /nfs/dbraw/zinc/93/58/35/1060935835.db2.gz STQAUBYYBUTMLQ-UHFFFAOYSA-N -1 3 334.354 4.082 20 0 EIADHM [O-]c1cc(Nc2cccc(-c3nc(CO)cs3)c2)ccc1Cl ZINC001212595122 1060977920 /nfs/dbraw/zinc/97/79/20/1060977920.db2.gz IKECLPSYCONBMH-UHFFFAOYSA-N -1 3 332.812 4.405 20 0 EIADHM Cc1cc(OC(C)C)ccc1[N-]S(=O)(=O)c1ccc(F)cc1C ZINC000614863610 1032102200 /nfs/dbraw/zinc/10/22/00/1032102200.db2.gz JHTUZXJNNCMLLU-UHFFFAOYSA-N -1 3 337.416 4.031 20 0 EIADHM CN(C)[C@@H]1CCOc2c(Nc3cc(Cl)cc(C(=O)[O-])c3)cccc21 ZINC001211969667 1032138474 /nfs/dbraw/zinc/13/84/74/1032138474.db2.gz UPNJDZNWWIHQFI-MRXNPFEDSA-N -1 3 346.814 4.167 20 0 EIADHM CC(C)c1nc(C(=O)[N-]c2nnc(-c3ccsc3)s2)cs1 ZINC000171439285 1032257384 /nfs/dbraw/zinc/25/73/84/1032257384.db2.gz FZKBKCHNTBCBAF-UHFFFAOYSA-N -1 3 336.467 4.099 20 0 EIADHM Cc1ccc(Cl)cc1C(=O)Nc1ccc(Br)cc1[O-] ZINC000532799308 1032319611 /nfs/dbraw/zinc/31/96/11/1032319611.db2.gz HHRXNCDFLVMJCW-UHFFFAOYSA-N -1 3 340.604 4.369 20 0 EIADHM O=C([O-])[C@@H](CNCc1c(Cl)cccc1Cl)Cc1ccccc1 ZINC000683170857 1019087106 /nfs/dbraw/zinc/08/71/06/1019087106.db2.gz DIFAAQZDWDBKQJ-CYBMUJFWSA-N -1 3 338.234 4.027 20 0 EIADHM CC(C)(CCNCc1csc(-c2cccs2)n1)CCC(=O)[O-] ZINC000426636844 1032818109 /nfs/dbraw/zinc/81/81/09/1032818109.db2.gz BDCZIZWAOZCCNM-UHFFFAOYSA-N -1 3 338.498 4.242 20 0 EIADHM CCOc1ccc(C[C@@H](C)C(=O)Nc2c([O-])cccc2Cl)cc1 ZINC000655110414 1019383926 /nfs/dbraw/zinc/38/39/26/1019383926.db2.gz RNRCNAXZAXAEDY-GFCCVEGCSA-N -1 3 333.815 4.262 20 0 EIADHM CC[C@@H](NC(=O)CCCc1ccc([O-])c(F)c1)c1ccccc1F ZINC000655204613 1019608435 /nfs/dbraw/zinc/60/84/35/1019608435.db2.gz NATHYXMMPXOURU-QGZVFWFLSA-N -1 3 333.378 4.261 20 0 EIADHM O=C([N-]c1cc(Cl)ccc1SCC(F)(F)F)c1ncccn1 ZINC000073933831 1019838091 /nfs/dbraw/zinc/83/80/91/1019838091.db2.gz WVWJVTHCWLRQEP-UHFFFAOYSA-N -1 3 347.749 4.037 20 0 EIADHM O=c1[n-]c(CN2CCCCc3ccccc32)nc2c3ccccc3oc21 ZINC000471224172 1020015599 /nfs/dbraw/zinc/01/55/99/1020015599.db2.gz XVNXHSMTTGLXLO-UHFFFAOYSA-N -1 3 345.402 4.425 20 0 EIADHM CCCc1nnc([N-]C(=O)c2sc(C)nc2-c2ccccc2)s1 ZINC000015612180 1020046987 /nfs/dbraw/zinc/04/69/87/1020046987.db2.gz CIBCKRLJODBIKL-UHFFFAOYSA-N -1 3 344.465 4.175 20 0 EIADHM CC[C@H]1CCCCN1Cc1csc(-c2ccc(C(=O)[O-])cc2)n1 ZINC000652366630 1020535191 /nfs/dbraw/zinc/53/51/91/1020535191.db2.gz FBINOWYXQJKIMC-INIZCTEOSA-N -1 3 330.453 4.273 20 0 EIADHM CC[C@@H](c1ccc(Br)cc1)N1CCC(CC(=O)[O-])CC1 ZINC000093682507 1020816708 /nfs/dbraw/zinc/81/67/08/1020816708.db2.gz PJXDFJYEENNNQM-HNNXBMFYSA-N -1 3 340.261 4.087 20 0 EIADHM [O-]c1c(Cl)cccc1Nc1cnc2ccc(Br)cn12 ZINC001210216628 1020953261 /nfs/dbraw/zinc/95/32/61/1020953261.db2.gz ZQSZAUJDGPDLNK-UHFFFAOYSA-N -1 3 338.592 4.199 20 0 EIADHM [O-]c1c(Cl)cccc1Nc1cc(F)ccc1OC[C@H]1CCCO1 ZINC001210222076 1020959040 /nfs/dbraw/zinc/95/90/40/1020959040.db2.gz MTQYYAAFLMLRJM-GFCCVEGCSA-N -1 3 337.778 4.486 20 0 EIADHM Cc1ccc([N-]S(=O)(=O)c2ccc(OC3CCCC3)cc2)cc1 ZINC000096659158 1032973377 /nfs/dbraw/zinc/97/33/77/1032973377.db2.gz MELFALAKQBGWMO-UHFFFAOYSA-N -1 3 331.437 4.117 20 0 EIADHM CC(C)Cc1csc2[n-]c(COc3ccc(Cl)cc3)nc(=O)c12 ZINC000063579636 1021391661 /nfs/dbraw/zinc/39/16/61/1021391661.db2.gz ILPKGRZJWFUSRV-UHFFFAOYSA-N -1 3 348.855 4.416 20 0 EIADHM O=C(NCCc1c(Cl)cccc1Cl)c1cc([O-])ccc1Cl ZINC000558492569 1021486275 /nfs/dbraw/zinc/48/62/75/1021486275.db2.gz KLTGJYSVFHRQLR-UHFFFAOYSA-N -1 3 344.625 4.325 20 0 EIADHM CC(C)c1ccc(-c2nc(CN[C@H](C)[C@@H](C)C(=O)[O-])cs2)cc1 ZINC000580085644 1021629084 /nfs/dbraw/zinc/62/90/84/1021629084.db2.gz WUMSVIBBJGYFLG-CHWSQXEVSA-N -1 3 332.469 4.132 20 0 EIADHM CCOc1cnc(Br)c(Nc2cccc([O-])c2Cl)c1 ZINC001210851793 1021799417 /nfs/dbraw/zinc/79/94/17/1021799417.db2.gz KVUSGJQNJNVXMY-UHFFFAOYSA-N -1 3 343.608 4.345 20 0 EIADHM COc1ccccc1-n1ncc(C)c1Nc1cccc([O-])c1Cl ZINC001210854906 1021805720 /nfs/dbraw/zinc/80/57/20/1021805720.db2.gz FEDUYITUOPRPDA-UHFFFAOYSA-N -1 3 329.787 4.292 20 0 EIADHM Cn1c2ccc(NC(=O)c3cc([O-])ccc3Cl)cc2nc1C1CC1 ZINC000431801687 1021880893 /nfs/dbraw/zinc/88/08/93/1021880893.db2.gz SPVKGAUEIJEXRI-UHFFFAOYSA-N -1 3 341.798 4.062 20 0 EIADHM CSc1ccc(Cl)cc1[N-]C(=O)c1cn2cc(C)nc2s1 ZINC000349325477 1022042313 /nfs/dbraw/zinc/04/23/13/1022042313.db2.gz IVXXVZFVLNKLFX-UHFFFAOYSA-N -1 3 337.857 4.332 20 0 EIADHM FC(F)(F)[C@H](C[C@H]1CCCO1)[N-]c1nc(-c2ccccc2)ns1 ZINC000656224492 1022057789 /nfs/dbraw/zinc/05/77/89/1022057789.db2.gz JVEHHLBGFPLDPF-NEPJUHHUSA-N -1 3 343.374 4.117 20 0 EIADHM CSc1ccc([O-])c(C(=O)N2CC[C@H](c3ccc(C)cc3)C2)c1 ZINC000613458603 1022059924 /nfs/dbraw/zinc/05/99/24/1022059924.db2.gz MZRWLOJFTSQAJO-HNNXBMFYSA-N -1 3 327.449 4.052 20 0 EIADHM O=C(NCc1ccc(-c2ccncc2)cc1)c1cc([O-])ccc1Cl ZINC000377934876 1022125991 /nfs/dbraw/zinc/12/59/91/1022125991.db2.gz CDLKKEBDMHUWDM-UHFFFAOYSA-N -1 3 338.794 4.038 20 0 EIADHM Cc1ccc(NC(=O)c2cc([O-])ccc2Cl)cc1-c1ncco1 ZINC000377950041 1022147686 /nfs/dbraw/zinc/14/76/86/1022147686.db2.gz AQVJYLIAQLQKTQ-UHFFFAOYSA-N -1 3 328.755 4.261 20 0 EIADHM O=C(CCc1ccc(OC(F)F)cc1)Nc1c([O-])cccc1Cl ZINC000557184434 1022181365 /nfs/dbraw/zinc/18/13/65/1022181365.db2.gz ZCDBFEYEGDQTRS-UHFFFAOYSA-N -1 3 341.741 4.218 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])[C@H]1SCCc2sccc21 ZINC000175615680 1022408554 /nfs/dbraw/zinc/40/85/54/1022408554.db2.gz WVEDAOLWSAGAHY-ZDUSSCGKSA-N -1 3 325.842 4.076 20 0 EIADHM Cc1sc2[n-]c([C@H](C)OC(=O)[C@H]3CCC(C)(C)C3)nc(=O)c2c1C ZINC000781698551 1022422208 /nfs/dbraw/zinc/42/22/08/1022422208.db2.gz PUDADLIJUGLBHQ-JQWIXIFHSA-N -1 3 348.468 4.444 20 0 EIADHM [O-]c1cccc(CNCc2csc(Br)c2)c1Cl ZINC000397405979 1022510707 /nfs/dbraw/zinc/51/07/07/1022510707.db2.gz TWNYZDUTTKKYJO-UHFFFAOYSA-N -1 3 332.650 4.159 20 0 EIADHM COc1cccc2c1CCCN2C(=O)c1cc([O-])c2ccccc2c1 ZINC000497478900 1022530846 /nfs/dbraw/zinc/53/08/46/1022530846.db2.gz KRRPDVWUFALDHU-UHFFFAOYSA-N -1 3 333.387 4.147 20 0 EIADHM CCSc1cccc(F)c1[N-]S(=O)(=O)c1ccc(F)cc1C ZINC000685916318 1022659111 /nfs/dbraw/zinc/65/91/11/1022659111.db2.gz LYYGJHRKXWALRL-UHFFFAOYSA-N -1 3 343.420 4.186 20 0 EIADHM CC[C@H]1CN(Cc2c(C(=O)[O-])sc3cccc(F)c32)CCS1 ZINC000387830806 1022823365 /nfs/dbraw/zinc/82/33/65/1022823365.db2.gz YZJNILRYJVQKRS-JTQLQIEISA-N -1 3 339.457 4.066 20 0 EIADHM COc1ccc(C)cc1S(=O)(=O)[N-]c1c(C)cc(C)cc1Cl ZINC000096659528 1022882774 /nfs/dbraw/zinc/88/27/74/1022882774.db2.gz ZHLCDMMSJSWSQM-UHFFFAOYSA-N -1 3 339.844 4.075 20 0 EIADHM O=c1cc(CNc2ccccc2CCC(F)(F)F)nc(C2CC2)[n-]1 ZINC000417013685 1023108738 /nfs/dbraw/zinc/10/87/38/1023108738.db2.gz DDGSRZPPESVNFK-UHFFFAOYSA-N -1 3 337.345 4.167 20 0 EIADHM Cc1ccc(-c2noc(C=C([O-])c3ccccc3Cl)n2)cc1F ZINC001211647256 1023218515 /nfs/dbraw/zinc/21/85/15/1023218515.db2.gz KOBFTNFJJZLKTO-UHFFFAOYSA-N -1 3 330.746 4.263 20 0 EIADHM Cc1cc(F)ccc1-c1noc(C=C([O-])c2ccccc2Cl)n1 ZINC001211647454 1023225036 /nfs/dbraw/zinc/22/50/36/1023225036.db2.gz QFQMHBJKRWZHKM-UHFFFAOYSA-N -1 3 330.746 4.263 20 0 EIADHM CCCOc1ccc(CN[C@H](CC(=O)[O-])c2ccsc2)c(C)c1 ZINC000656564336 1023229638 /nfs/dbraw/zinc/22/96/38/1023229638.db2.gz JYRFIKHKXKIVHN-QGZVFWFLSA-N -1 3 333.453 4.151 20 0 EIADHM Cc1ncc(Cl)cc1-c1noc(C=C([O-])c2ccccc2Cl)n1 ZINC001211647582 1023232516 /nfs/dbraw/zinc/23/25/16/1023232516.db2.gz WTRTVTXMMZFXOK-UHFFFAOYSA-N -1 3 348.189 4.172 20 0 EIADHM COC(=O)c1ccc(C(=O)Nc2ccc(C(C)C)cc2C(C)C)[n-]1 ZINC000431935596 1023254317 /nfs/dbraw/zinc/25/43/17/1023254317.db2.gz GCKLXQBYYCZUBS-UHFFFAOYSA-N -1 3 328.412 4.300 20 0 EIADHM CC(=O)c1cc(NC(=O)c2cc([O-])ccc2C(F)(F)F)ccc1F ZINC000341076909 1023260052 /nfs/dbraw/zinc/26/00/52/1023260052.db2.gz UVMBROWFUIAPOZ-UHFFFAOYSA-N -1 3 341.260 4.005 20 0 EIADHM C[C@@H]1CCN(CCSc2cc(Cl)ccc2Cl)C[C@@H]1C(=O)[O-] ZINC000584779978 1023311970 /nfs/dbraw/zinc/31/19/70/1023311970.db2.gz ZISHGQYQBOTYBS-PWSUYJOCSA-N -1 3 348.295 4.128 20 0 EIADHM COc1ccc([C@@H](NCc2ccc(C3CCC3)cc2)C(=O)[O-])cc1F ZINC000417572245 1023356717 /nfs/dbraw/zinc/35/67/17/1023356717.db2.gz OXUHVZYWIBPKNF-LJQANCHMSA-N -1 3 343.398 4.017 20 0 EIADHM COc1cccc2c(CN[C@@H](CC(=O)[O-])c3ccc(C)o3)cccc12 ZINC000417576239 1023361625 /nfs/dbraw/zinc/36/16/25/1023361625.db2.gz UOKSPAAJWZTIRF-KRWDZBQOSA-N -1 3 339.391 4.055 20 0 EIADHM Cc1nc2c(s1)[C@@H](NC(=O)c1cc([O-])c3ccccc3c1)CCC2 ZINC000377067464 1023362507 /nfs/dbraw/zinc/36/25/07/1023362507.db2.gz NAXAGTIYPLYMTH-INIZCTEOSA-N -1 3 338.432 4.118 20 0 EIADHM CC(C)(C)c1ncc(CN[C@@H](CCC(=O)[O-])c2ccccc2)s1 ZINC000417590101 1023367375 /nfs/dbraw/zinc/36/73/75/1023367375.db2.gz BKLSSVSJEATKOH-HNNXBMFYSA-N -1 3 332.469 4.136 20 0 EIADHM COc1ccc2oc(CN[C@H](CCC(=O)[O-])c3ccccc3)cc2c1 ZINC000417605084 1023369527 /nfs/dbraw/zinc/36/95/27/1023369527.db2.gz XCYLXCNQKKHMQD-GOSISDBHSA-N -1 3 339.391 4.137 20 0 EIADHM CC(C)(C)c1ccc(-c2ccc(CN[C@@H]3C=C[C@H](C(=O)[O-])C3)o2)cc1 ZINC000417613056 1023378509 /nfs/dbraw/zinc/37/85/09/1023378509.db2.gz CHXUNOOHDKMIBG-DOTOQJQBSA-N -1 3 339.435 4.363 20 0 EIADHM Cc1cc2cc(CN[C@@H]3C[C@@H](C(=O)[O-])c4ccccc43)oc2cc1C ZINC000417631276 1023383083 /nfs/dbraw/zinc/38/30/83/1023383083.db2.gz RYURYVBQMXINDT-RTBURBONSA-N -1 3 335.403 4.452 20 0 EIADHM Cc1cc(C(F)(F)F)ccc1CNCc1ccc(C(=O)[O-])c(C)c1 ZINC000417671016 1023402407 /nfs/dbraw/zinc/40/24/07/1023402407.db2.gz PPXKCSDLZISFHD-UHFFFAOYSA-N -1 3 337.341 4.310 20 0 EIADHM COc1ccc2cc([C@H](C)C(=O)Nc3cccc([O-])c3F)ccc2c1 ZINC000129667617 1023456720 /nfs/dbraw/zinc/45/67/20/1023456720.db2.gz PWPKMQOZOXDTQU-LBPRGKRZSA-N -1 3 339.366 4.435 20 0 EIADHM [O-]c1cc(F)cc(CN[C@H](c2ccncc2)c2cc(F)ccc2F)c1 ZINC000364212842 1023488656 /nfs/dbraw/zinc/48/86/56/1023488656.db2.gz CVMFANXFDYOVAQ-LJQANCHMSA-N -1 3 344.336 4.084 20 0 EIADHM O=C([O-])[C@@H]1CCN(Cc2cc(Cl)ccc2Cl)[C@H]2CCCC[C@@H]12 ZINC000656762472 1023503423 /nfs/dbraw/zinc/50/34/23/1023503423.db2.gz BBLREQZJQNPLKR-LZWOXQAQSA-N -1 3 342.266 4.459 20 0 EIADHM O=C([O-])[C@@H]1CCN(Cc2csc(C3CCCC3)n2)[C@@H]2CCCC[C@@H]12 ZINC000656767369 1023507608 /nfs/dbraw/zinc/50/76/08/1023507608.db2.gz UXDIXJOHNNXXCB-GVDBMIGSSA-N -1 3 348.512 4.266 20 0 EIADHM Cc1cc(=O)[n-]c([C@H](C)N2CCC(F)(c3ccc(Cl)cc3)CC2)n1 ZINC000500140544 1023537872 /nfs/dbraw/zinc/53/78/72/1023537872.db2.gz QBJGKVFFWQNYHT-ZDUSSCGKSA-N -1 3 349.837 4.166 20 0 EIADHM CC(C)c1cccc(S(=O)(=O)[N-]c2cccc(Cl)c2F)c1 ZINC000460457356 1023569552 /nfs/dbraw/zinc/56/95/52/1023569552.db2.gz WEAVVJGZWNTCPB-UHFFFAOYSA-N -1 3 327.808 4.403 20 0 EIADHM O=C([O-])c1ccc(CN2CCCCC[C@@H]2/C=C\c2cccs2)nc1 ZINC000581731558 1023655794 /nfs/dbraw/zinc/65/57/94/1023655794.db2.gz GGIHUXSNQJHNLH-DOOKAGJSSA-N -1 3 342.464 4.299 20 0 EIADHM [O-]c1cccc(Cl)c1CNc1cccc(Oc2cnccn2)c1 ZINC000156420058 1023759634 /nfs/dbraw/zinc/75/96/34/1023759634.db2.gz SMJLPMQSRAZDDF-UHFFFAOYSA-N -1 3 327.771 4.240 20 0 EIADHM Cc1ccc(CNCc2c(F)ccc([O-])c2F)c(OCC2CC2)c1 ZINC000511682651 1023829869 /nfs/dbraw/zinc/82/98/69/1023829869.db2.gz PYOGWDNCWJIPSD-UHFFFAOYSA-N -1 3 333.378 4.057 20 0 EIADHM Cc1cc(C(=O)Nc2cc(Cl)ccc2[O-])c(C)n1[C@H]1CCCOC1 ZINC000626227997 1023894637 /nfs/dbraw/zinc/89/46/37/1023894637.db2.gz UGRMOIWJCSSBPM-AWEZNQCLSA-N -1 3 348.830 4.068 20 0 EIADHM O=C(N[C@H]1CC[C@@H](c2cccc(F)c2)C1)c1cc([O-])ccc1Cl ZINC000510904887 1024770214 /nfs/dbraw/zinc/77/02/14/1024770214.db2.gz COQSNGXRZQYSQZ-OCCSQVGLSA-N -1 3 333.790 4.251 20 0 EIADHM C[C@H](c1ccc(C(=O)[O-])o1)N(C)CCCOc1ccc(Cl)cc1 ZINC000652398637 1024806998 /nfs/dbraw/zinc/80/69/98/1024806998.db2.gz ROCSQNHYTSUQJP-GFCCVEGCSA-N -1 3 337.803 4.093 20 0 EIADHM Cc1cc([C@@H](C)N2CCC(OC3CCC(C)CC3)CC2)oc1C(=O)[O-] ZINC000652410845 1024820307 /nfs/dbraw/zinc/82/03/07/1024820307.db2.gz CXGOAUWXDVCBLI-OGVSOVDVSA-N -1 3 349.471 4.407 20 0 EIADHM CCOc1ccc(OCC)c(NC(=O)c2cc([O-])ccc2Cl)c1 ZINC000323490674 1024843518 /nfs/dbraw/zinc/84/35/18/1024843518.db2.gz BFEZCQKXYOGBIU-UHFFFAOYSA-N -1 3 335.787 4.095 20 0 EIADHM CCC(=O)Nc1ccc(N=Cc2cc(Br)ccc2[O-])cc1 ZINC000254798385 1024987194 /nfs/dbraw/zinc/98/71/94/1024987194.db2.gz LSEFCHJFENYBFK-UHFFFAOYSA-N -1 3 347.212 4.254 20 0 EIADHM Cc1cccc([N-]S(=O)(=O)c2ccc(OCC(C)C)cc2)c1C ZINC000506792308 1025755643 /nfs/dbraw/zinc/75/56/43/1025755643.db2.gz ALWLUAODIRFMPD-UHFFFAOYSA-N -1 3 333.453 4.139 20 0 EIADHM Cc1cc(C)c([N-]S(=O)(=O)c2ccc(C(F)(F)F)cc2)c(C)c1 ZINC000007053379 1025814994 /nfs/dbraw/zinc/81/49/94/1025814994.db2.gz IDPIFOQNVIJQSD-UHFFFAOYSA-N -1 3 343.370 4.431 20 0 EIADHM CSc1ccc([O-])c(C(=O)N2CC[C@@H](c3ccc(Cl)cc3)C2)c1 ZINC000668591146 1025884824 /nfs/dbraw/zinc/88/48/24/1025884824.db2.gz ZCTIRIXJCKSVJQ-CYBMUJFWSA-N -1 3 347.867 4.397 20 0 EIADHM O=C(Nc1ncc(-c2ccccc2)s1)c1cc([O-])ccc1Cl ZINC000431340477 1026035091 /nfs/dbraw/zinc/03/50/91/1026035091.db2.gz WOEIIJWBTZGTNK-UHFFFAOYSA-N -1 3 330.796 4.421 20 0 EIADHM COc1ccc(S[C@@H](C)C(=O)Nc2cc(Cl)ccc2[O-])cc1 ZINC000111211319 1026097573 /nfs/dbraw/zinc/09/75/73/1026097573.db2.gz OVNRSDPPRKDEFH-JTQLQIEISA-N -1 3 337.828 4.174 20 0 EIADHM C[C@H](c1nc2ccccc2s1)N(C)CCc1ccccc1C(=O)[O-] ZINC000325759157 1026100205 /nfs/dbraw/zinc/10/02/05/1026100205.db2.gz INXPBIFVXDPZFX-CYBMUJFWSA-N -1 3 340.448 4.230 20 0 EIADHM CC[C@H](C)c1ccc(S(=O)(=O)[N-]c2cc(C)cnc2Cl)cc1 ZINC000318785553 1026284553 /nfs/dbraw/zinc/28/45/53/1026284553.db2.gz YKHKYHQBWDUDHP-LBPRGKRZSA-N -1 3 338.860 4.358 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)N1CCCCc2sccc21 ZINC000684784174 1026288227 /nfs/dbraw/zinc/28/82/27/1026288227.db2.gz UNQJKJURDNRSJZ-UHFFFAOYSA-N -1 3 333.428 4.285 20 0 EIADHM O=C(NC1(c2ccc(F)cc2)CCCC1)c1cc([O-])ccc1Cl ZINC000550216740 1026363742 /nfs/dbraw/zinc/36/37/42/1026363742.db2.gz DIORAGJEIPMGQS-UHFFFAOYSA-N -1 3 333.790 4.384 20 0 EIADHM CCc1nc([N-]C(=O)c2ocnc2C(F)F)sc1C(C)(C)C ZINC000627725363 1026491989 /nfs/dbraw/zinc/49/19/89/1026491989.db2.gz GGUUABOYPSMZOU-UHFFFAOYSA-N -1 3 329.372 4.181 20 0 EIADHM O=C([O-])[C@H](NCc1ccc(Cl)c(F)c1)c1cccc(Cl)c1 ZINC000426727391 1026509227 /nfs/dbraw/zinc/50/92/27/1026509227.db2.gz OLQRNISVEJQKGP-CQSZACIVSA-N -1 3 328.170 4.048 20 0 EIADHM Cc1cc(=O)[n-]c([C@@H](C)N2CCC([C@H](F)c3ccccc3F)CC2)n1 ZINC000511105542 1026511985 /nfs/dbraw/zinc/51/19/85/1026511985.db2.gz JDKHQUQGEAGAOC-ACJLOTCBSA-N -1 3 347.409 4.114 20 0 EIADHM Cc1cc(CN[C@H](C(=O)[O-])c2ccc(Cl)c(F)c2)ccc1Cl ZINC000426732715 1026515255 /nfs/dbraw/zinc/51/52/55/1026515255.db2.gz VCKZXWHLNOQQIM-HNNXBMFYSA-N -1 3 342.197 4.356 20 0 EIADHM O=C([O-])[C@H](NCc1ccc(Cl)cc1)c1ccc(Cl)c(F)c1 ZINC000426762599 1026529971 /nfs/dbraw/zinc/52/99/71/1026529971.db2.gz LQYJUALZRYZGHT-CQSZACIVSA-N -1 3 328.170 4.048 20 0 EIADHM O=C([O-])C[C@@H](NCc1cccs1)c1cc(Cl)cc(Cl)c1 ZINC000426755648 1026543367 /nfs/dbraw/zinc/54/33/67/1026543367.db2.gz DUEPDIDKRNYXHU-CYBMUJFWSA-N -1 3 330.236 4.361 20 0 EIADHM Cc1cc(Cl)ccc1CN[C@@H](C(=O)[O-])c1ccc(Cl)c(F)c1 ZINC000426760435 1026544439 /nfs/dbraw/zinc/54/44/39/1026544439.db2.gz RGDYUBJYECQUBK-OAHLLOKOSA-N -1 3 342.197 4.356 20 0 EIADHM Cc1cc([C@@H](NCc2cc3ccc(F)cc3[nH]2)C(=O)[O-])ccc1Cl ZINC000426776643 1026554079 /nfs/dbraw/zinc/55/40/79/1026554079.db2.gz HAEZTJIQPYSANB-QGZVFWFLSA-N -1 3 346.789 4.184 20 0 EIADHM O=C([O-])[C@H](NCc1cc(Cl)cc(C(F)(F)F)c1)c1ccccc1 ZINC000426781841 1026556589 /nfs/dbraw/zinc/55/65/89/1026556589.db2.gz CHNKDTNHHDNAGI-CQSZACIVSA-N -1 3 343.732 4.274 20 0 EIADHM CC[C@H](NC(=O)c1c(C)cccc1[O-])c1nc(C(F)(F)F)cs1 ZINC000625951988 1026636953 /nfs/dbraw/zinc/63/69/53/1026636953.db2.gz LRAILFQXIOCBAT-VIFPVBQESA-N -1 3 344.358 4.057 20 0 EIADHM CC(C)c1ccc(-c2nc(Cc3c(F)cccc3F)no2)c([O-])c1 ZINC000436889157 1026653429 /nfs/dbraw/zinc/65/34/29/1026653429.db2.gz PUUKMZYEOPMZRT-UHFFFAOYSA-N -1 3 330.334 4.435 20 0 EIADHM Cc1ccccc1[C@H](NC(=O)c1cc(=O)c2ccccc2[n-]1)C(C)(C)C ZINC000431417117 1026672124 /nfs/dbraw/zinc/67/21/24/1026672124.db2.gz HBXZUHZYIHZHQJ-FQEVSTJZSA-N -1 3 348.446 4.354 20 0 EIADHM Cc1cccc2cc(C(=O)N=c3cc(-c4ccccc4C)[n-][nH]3)oc21 ZINC000512322712 1026687565 /nfs/dbraw/zinc/68/75/65/1026687565.db2.gz ALKYLUNUEKWMKZ-UHFFFAOYSA-N -1 3 331.375 4.114 20 0 EIADHM CCOCCN(CC[C@H]1CCC[C@H](C)C1)Cc1ccc(C(=O)[O-])o1 ZINC000519605049 1026790531 /nfs/dbraw/zinc/79/05/31/1026790531.db2.gz KZTSSUMIIJXHLJ-JKSUJKDBSA-N -1 3 337.460 4.033 20 0 EIADHM O=C([O-])c1ccoc1CN1CCCCC[C@@H]1/C=C\c1cccs1 ZINC000582671555 1026924893 /nfs/dbraw/zinc/92/48/93/1026924893.db2.gz QRIRXFKGQVUKOM-WBTMPAOCSA-N -1 3 331.437 4.497 20 0 EIADHM Cc1cc(OC(F)F)c(C(=O)[N-]c2nc(C(C)(C)C)ns2)s1 ZINC000074564574 1027002114 /nfs/dbraw/zinc/00/21/14/1027002114.db2.gz RWUCQHONCXFVBE-UHFFFAOYSA-N -1 3 347.412 4.059 20 0 EIADHM Cc1ccc(C)c(OCC(=O)Nc2ccc([O-])c(C(F)(F)F)c2)c1 ZINC000440995094 1027179155 /nfs/dbraw/zinc/17/91/55/1027179155.db2.gz ZUSUHGLEOZYSAD-UHFFFAOYSA-N -1 3 339.313 4.045 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])C1(CCOCc2ccccc2)CC1 ZINC000474536555 1027193823 /nfs/dbraw/zinc/19/38/23/1027193823.db2.gz UAEGUZAJUWPNTE-UHFFFAOYSA-N -1 3 345.826 4.371 20 0 EIADHM CC(C)CCc1ccc(NC(=O)c2c[n-]c3ccccc3c2=O)cc1 ZINC000520145586 1027230650 /nfs/dbraw/zinc/23/06/50/1027230650.db2.gz JROIVCUVLGCFIC-UHFFFAOYSA-N -1 3 334.419 4.369 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(NCCC3=CCCCCC3)nc2)n1 ZINC000302212133 1027261895 /nfs/dbraw/zinc/26/18/95/1027261895.db2.gz ZURUDQIGBNJIMJ-UHFFFAOYSA-N -1 3 338.455 4.499 20 0 EIADHM Cc1cc(C(=O)Nc2ccc(Br)cc2[O-])sc1C ZINC000261370439 1027496538 /nfs/dbraw/zinc/49/65/38/1027496538.db2.gz IDTJOAUWIJHLEN-UHFFFAOYSA-N -1 3 326.215 4.085 20 0 EIADHM CC(C)Cc1nnc([N-]C(=O)c2cc(F)c(Cl)cc2Cl)s1 ZINC000017341755 1027567811 /nfs/dbraw/zinc/56/78/11/1027567811.db2.gz GYGGLXOZGRCGMH-UHFFFAOYSA-N -1 3 348.230 4.435 20 0 EIADHM Cc1ccc(C(=O)N2CC[C@H]2c2ccc(Br)cc2)c([O-])c1 ZINC001167651329 1027887523 /nfs/dbraw/zinc/88/75/23/1027887523.db2.gz MJKUINURVYOLMX-HNNXBMFYSA-N -1 3 346.224 4.050 20 0 EIADHM Cc1ccc(C(=O)N2CC[C@@H]2c2ccc(Br)cc2)c([O-])c1 ZINC001167651330 1027887688 /nfs/dbraw/zinc/88/76/88/1027887688.db2.gz MJKUINURVYOLMX-OAHLLOKOSA-N -1 3 346.224 4.050 20 0 EIADHM CCc1ccc(C(=O)N(C)[C@H](C)c2nc3ccccc3s2)c([O-])c1 ZINC000188626154 1028009883 /nfs/dbraw/zinc/00/98/83/1028009883.db2.gz OTQAZPGOORGPEN-GFCCVEGCSA-N -1 3 340.448 4.398 20 0 EIADHM C[C@H]1CCN(C(=O)c2ccc3c(c2)CCCCC3=O)c2c([O-])cccc21 ZINC000330125223 1028207908 /nfs/dbraw/zinc/20/79/08/1028207908.db2.gz BKOQVXSNVYFZNT-AWEZNQCLSA-N -1 3 349.430 4.455 20 0 EIADHM Cc1c(Cl)c(CN2CCCC[C@H]2CCC(=O)[O-])nc2ccccc12 ZINC000324306683 1028240745 /nfs/dbraw/zinc/24/07/45/1028240745.db2.gz XRWYCHRZSAWCRJ-AWEZNQCLSA-N -1 3 346.858 4.416 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)N[C@H]1CCCc2sccc21 ZINC000346261250 1028353132 /nfs/dbraw/zinc/35/31/32/1028353132.db2.gz YXKNLUOWPCYRDS-HNNXBMFYSA-N -1 3 333.428 4.109 20 0 EIADHM COc1cc(F)c(F)cc1NC(=O)c1cc([O-])c2ccccc2c1 ZINC000583413021 1028681330 /nfs/dbraw/zinc/68/13/30/1028681330.db2.gz IVPMPILQFUOAML-UHFFFAOYSA-N -1 3 329.302 4.085 20 0 EIADHM Cc1cc(N2CCCC[C@@H]2C)ccc1[N-]S(=O)(=O)c1ccccc1 ZINC000150995565 1028754375 /nfs/dbraw/zinc/75/43/75/1028754375.db2.gz QWDAYTFJIHTDGL-INIZCTEOSA-N -1 3 344.480 4.175 20 0 EIADHM COc1ccc([O-])c(-c2nc(Cc3ccc(Cl)cc3C)no2)c1 ZINC000445602700 1028764846 /nfs/dbraw/zinc/76/48/46/1028764846.db2.gz XYFJIJIXSBETPL-UHFFFAOYSA-N -1 3 330.771 4.003 20 0 EIADHM Cc1cccc(CN(CC(C)C)C(=O)c2c[n-]c3ccccc3c2=O)c1 ZINC000347133338 1028880026 /nfs/dbraw/zinc/88/00/26/1028880026.db2.gz GSRMACCLPLIWLL-UHFFFAOYSA-N -1 3 348.446 4.135 20 0 EIADHM Cc1cc(NCc2ccc([O-])c(F)c2)ccc1N1CCSCC1 ZINC000892354869 1029129456 /nfs/dbraw/zinc/12/94/56/1029129456.db2.gz JXTAADURMGWLJM-UHFFFAOYSA-N -1 3 332.444 4.005 20 0 EIADHM C[C@@H](Sc1ncco1)c1nc(=O)c2c(-c3ccco3)csc2[n-]1 ZINC000446069774 1029131459 /nfs/dbraw/zinc/13/14/59/1029131459.db2.gz GEWOMNLKUYIZPO-MRVPVSSYSA-N -1 3 345.405 4.498 20 0 EIADHM O=C(Nc1cc(F)ccc1[O-])c1csc(-c2ccc(F)cc2)n1 ZINC000531133831 1029546379 /nfs/dbraw/zinc/54/63/79/1029546379.db2.gz XWPQNRHFVBNDFM-UHFFFAOYSA-N -1 3 332.331 4.046 20 0 EIADHM CC1(C2CC2)CCN([C@H](C(=O)[O-])c2c(F)cccc2Cl)CC1 ZINC000584064855 1029585635 /nfs/dbraw/zinc/58/56/35/1029585635.db2.gz PJDHFDQPZAPAOR-HNNXBMFYSA-N -1 3 325.811 4.117 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(NCCC3CCCCC3)nc2)n1 ZINC000301158204 1029678488 /nfs/dbraw/zinc/67/84/88/1029678488.db2.gz CTAWLMCEBUMFND-UHFFFAOYSA-N -1 3 326.444 4.189 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N3CCC[C@H]3c3ccccc3)nc2)n1 ZINC000301503921 1029745344 /nfs/dbraw/zinc/74/53/44/1029745344.db2.gz GDEXEJXNKCWJPY-SFHVURJKSA-N -1 3 346.434 4.148 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-][C@@H](CC(F)(F)F)c2ccccc2)s1 ZINC000056127953 1029749127 /nfs/dbraw/zinc/74/91/27/1029749127.db2.gz DRMINLFPDKLEJA-LBPRGKRZSA-N -1 3 349.399 4.029 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N(C)[C@H](C)c3ccc(C)cc3)nc2)n1 ZINC000301545801 1029754968 /nfs/dbraw/zinc/75/49/68/1029754968.db2.gz TZOTWFIQXAONHC-OAHLLOKOSA-N -1 3 348.450 4.312 20 0 EIADHM CCc1nc(C)c([C@H](C)N(C)C(=O)c2cccc(CC)c2[O-])s1 ZINC000091735849 1029890110 /nfs/dbraw/zinc/89/01/10/1029890110.db2.gz DKSKLPSITIKLNZ-LBPRGKRZSA-N -1 3 332.469 4.115 20 0 EIADHM Cc1ccccc1S(=O)(=O)[N-]c1ccc(-c2ccco2)cc1F ZINC000447265324 1029949774 /nfs/dbraw/zinc/94/97/74/1029949774.db2.gz QXAGELKGIFIVLZ-UHFFFAOYSA-N -1 3 331.368 4.195 20 0 EIADHM CC(C)c1ccc(C(=O)N2C[C@H](C)O[C@@H](c3ccccc3)C2)c([O-])c1 ZINC000143502654 1030071565 /nfs/dbraw/zinc/07/15/65/1030071565.db2.gz UIBFNTRWEIAMTO-MGPUTAFESA-N -1 3 339.435 4.118 20 0 EIADHM CCCc1nnc([N-]C(=O)c2csc(-c3ccccc3F)n2)s1 ZINC000144924863 1030080622 /nfs/dbraw/zinc/08/06/22/1030080622.db2.gz YOLBXFQFGFGMOQ-UHFFFAOYSA-N -1 3 348.428 4.006 20 0 EIADHM C[C@H](CCC[C@H](C)NCc1csc(-c2ccccc2)n1)C(=O)[O-] ZINC000321391218 1030333208 /nfs/dbraw/zinc/33/32/08/1030333208.db2.gz WSGVRSMBBFXEKW-KGLIPLIRSA-N -1 3 332.469 4.179 20 0 EIADHM O=C(NCCSc1ccc(Cl)cc1)c1cc([O-])ccc1Cl ZINC000431611063 1030504162 /nfs/dbraw/zinc/50/41/62/1030504162.db2.gz UBDDTYCCXGHSRT-UHFFFAOYSA-N -1 3 342.247 4.221 20 0 EIADHM CCc1cccc(C(=O)N2C[C@@H](c3ccc(F)cc3)C[C@@H]2C)c1[O-] ZINC000530719666 1030673083 /nfs/dbraw/zinc/67/30/83/1030673083.db2.gz SVCOQQXEKATLMQ-BBRMVZONSA-N -1 3 327.399 4.112 20 0 EIADHM Cc1ccc(C)c(OC2CCN(Cc3cccc(C(=O)[O-])c3)CC2)c1 ZINC000263447505 1030872263 /nfs/dbraw/zinc/87/22/63/1030872263.db2.gz GHNBUMVFMLVMCZ-UHFFFAOYSA-N -1 3 339.435 4.045 20 0 EIADHM CCCC[C@H](CC)CN1CCC12CN(C(=O)c1ccccc1[S-])C2 ZINC001272012766 1030895579 /nfs/dbraw/zinc/89/55/79/1030895579.db2.gz FTQFKMFHDCDAGP-INIZCTEOSA-N -1 3 346.540 4.092 20 0 EIADHM CCCCc1nnc([N-]C(=O)c2nc(-c3ccccc3)oc2C)s1 ZINC000023360891 1030928281 /nfs/dbraw/zinc/92/82/81/1030928281.db2.gz XAARFCRCFKKKNL-UHFFFAOYSA-N -1 3 342.424 4.096 20 0 EIADHM Cc1cc(=O)[n-]c([C@H](C)N[C@H](c2ccc(Cl)cc2)[C@@H]2C[C@@H]2C)n1 ZINC000192769032 1031131959 /nfs/dbraw/zinc/13/19/59/1031131959.db2.gz JMANHWZRNPDDGO-WZFLISSASA-N -1 3 331.847 4.192 20 0 EIADHM C[C@@H]1C[C@@H](C(F)(F)F)CCN1C(=O)CCCc1ccc([O-])c(F)c1 ZINC000452650633 1031219370 /nfs/dbraw/zinc/21/93/70/1031219370.db2.gz VKZHQDJZHJAGGE-YPMHNXCESA-N -1 3 347.352 4.043 20 0 EIADHM C[C@H](/N=C/c1cc(Cl)ccc1[O-])c1cccc(N2CCOC2=O)c1 ZINC000065829892 1031297469 /nfs/dbraw/zinc/29/74/69/1031297469.db2.gz UMXFKZONYBDNMT-DQAKUKQTSA-N -1 3 344.798 4.182 20 0 EIADHM O=C(c1ccccc1[O-])N1CCC([C@@H](F)c2ccccc2F)CC1 ZINC000375994410 1031684465 /nfs/dbraw/zinc/68/44/65/1031684465.db2.gz VIWRPKWDKNEKIH-GOSISDBHSA-N -1 3 331.362 4.094 20 0 EIADHM CC(=O)c1ccc(C(=O)Nc2ccccc2OC2CCCC2)cc1[O-] ZINC000666700383 1031915697 /nfs/dbraw/zinc/91/56/97/1031915697.db2.gz ODNZOZPXPKLQRW-UHFFFAOYSA-N -1 3 339.391 4.169 20 0 EIADHM COc1nccc(Nc2cc(Br)cc(F)c2[O-])c1Cl ZINC001211955524 1032008828 /nfs/dbraw/zinc/00/88/28/1032008828.db2.gz GHFSWIYPFASUBT-UHFFFAOYSA-N -1 3 347.571 4.094 20 0 EIADHM CCC[C@H](CC(C)C)C(=O)Nc1ccc(-c2nc(C)cc(=O)[n-]2)cc1 ZINC000449801774 1032010670 /nfs/dbraw/zinc/01/06/70/1032010670.db2.gz FRAKKDVINWDLRE-MRXNPFEDSA-N -1 3 341.455 4.146 20 0 EIADHM O=C(Cc1nc(=O)c2c3ccccc3sc2[n-]1)c1ccc(F)cc1 ZINC000614114915 1033397284 /nfs/dbraw/zinc/39/72/84/1033397284.db2.gz GLFBTBPXEKGFCI-UHFFFAOYSA-N -1 3 338.363 4.115 20 0 EIADHM [O-]c1cccc(CN[C@H](c2ccc(F)cc2)[C@H]2CCCO2)c1Cl ZINC000645150772 1033844217 /nfs/dbraw/zinc/84/42/17/1033844217.db2.gz PYIXDWFSRHSOST-SJLPKXTDSA-N -1 3 335.806 4.195 20 0 EIADHM C[C@@H]1C[C@]1(NC(=O)c1cc([O-])ccc1Cl)c1ccc(Cl)cc1 ZINC000512787831 1033946146 /nfs/dbraw/zinc/94/61/46/1033946146.db2.gz LEHLEGABNLWLCO-BMLIUANNSA-N -1 3 336.218 4.364 20 0 EIADHM O=C(NC1(Cc2ccccc2)CCCC1)c1cc([O-])ccc1Cl ZINC000433364138 1034280452 /nfs/dbraw/zinc/28/04/52/1034280452.db2.gz MUMWSOMGGOVBJD-UHFFFAOYSA-N -1 3 329.827 4.331 20 0 EIADHM Cc1cnn(-c2ccc(C)cc2NC(=O)c2cc([O-])ccc2Cl)c1 ZINC000433369965 1034281941 /nfs/dbraw/zinc/28/19/41/1034281941.db2.gz BFWIACHSDQVGMK-UHFFFAOYSA-N -1 3 341.798 4.100 20 0 EIADHM CC(C)(C)c1csc(CSCc2cc(=O)[n-]c(C3CC3)n2)n1 ZINC000419431422 1035344091 /nfs/dbraw/zinc/34/40/91/1035344091.db2.gz WMGOCADFEWNJKT-UHFFFAOYSA-N -1 3 335.498 4.247 20 0 EIADHM COc1cccc(C(=O)CCCC(=O)Nc2ccc(Cl)cc2[O-])c1 ZINC000490653715 1035575347 /nfs/dbraw/zinc/57/53/47/1035575347.db2.gz YCPMKPGPUVHWHQ-UHFFFAOYSA-N -1 3 347.798 4.046 20 0 EIADHM O=C(Nc1nnc(-c2cc3ccccc3o2)[n-]1)c1cccc(Cl)c1 ZINC000485110037 1035710061 /nfs/dbraw/zinc/71/00/61/1035710061.db2.gz ULKUAQYSCHJHEI-UHFFFAOYSA-N -1 3 338.754 4.124 20 0 EIADHM O=C(Nc1n[n-]c(-c2cc3ccccc3o2)n1)c1cccc(Cl)c1 ZINC000485110037 1035710081 /nfs/dbraw/zinc/71/00/81/1035710081.db2.gz ULKUAQYSCHJHEI-UHFFFAOYSA-N -1 3 338.754 4.124 20 0 EIADHM COc1ccc(NC(=O)c2cc(C)ccc2[O-])cc1OC1CCCC1 ZINC000913506128 1035770836 /nfs/dbraw/zinc/77/08/36/1035770836.db2.gz BOJIOEGNMHQDCL-UHFFFAOYSA-N -1 3 341.407 4.283 20 0 EIADHM O=C(Nc1cc(Cl)c([O-])c(Cl)c1)c1cc(-c2ccccc2)n[nH]1 ZINC000501992839 1035803759 /nfs/dbraw/zinc/80/37/59/1035803759.db2.gz ZVRDMVMTDIQSKV-UHFFFAOYSA-N -1 3 348.189 4.341 20 0 EIADHM CC(=O)c1cccc(-c2nc3cc(Cl)c(Cl)cc3c(=O)[n-]2)c1 ZINC000485368816 1035849689 /nfs/dbraw/zinc/84/96/89/1035849689.db2.gz VPVHHNHVNZGJNC-UHFFFAOYSA-N -1 3 333.174 4.100 20 0 EIADHM O=C1Nc2c(cc(Cl)cc2Cl)C1=N[N-]c1ncccc1Cl ZINC000054884361 1035858878 /nfs/dbraw/zinc/85/88/78/1035858878.db2.gz ZEOHJCYXVOERGB-UHFFFAOYSA-N -1 3 341.585 4.460 20 0 EIADHM COc1ccc([C@H](C)NCc2ccc(C(=O)[O-])c(Cl)c2)cc1C ZINC000905726405 1035875399 /nfs/dbraw/zinc/87/53/99/1035875399.db2.gz CJIRPRQQAAJIBV-LBPRGKRZSA-N -1 3 333.815 4.206 20 0 EIADHM CC[C@@H]1CCc2c(sc3nc(-c4ccnc(Cl)c4)[n-]c(=O)c23)C1 ZINC000055494639 1036072613 /nfs/dbraw/zinc/07/26/13/1036072613.db2.gz PQUMYISTSNRKAK-SECBINFHSA-N -1 3 345.855 4.215 20 0 EIADHM O=c1cc(C=Cc2ccc(-c3ccccc3)o2)nc(-c2ccncc2)[n-]1 ZINC000485980976 1036407555 /nfs/dbraw/zinc/40/75/55/1036407555.db2.gz HDHUOCJSLMWYNY-SREVYHEPSA-N -1 3 341.370 4.262 20 0 EIADHM O=c1cc(C=Cc2cccc(C(F)(F)F)c2)nc(-c2ccncc2)[n-]1 ZINC000486032336 1036432547 /nfs/dbraw/zinc/43/25/47/1036432547.db2.gz VJXCJOJXKGLADK-SNAWJCMRSA-N -1 3 343.308 4.021 20 0 EIADHM O=c1cc(C=Cc2cc(Cl)cc(Cl)c2)nc(-c2ccncc2)[n-]1 ZINC000486106149 1036488852 /nfs/dbraw/zinc/48/88/52/1036488852.db2.gz YOMJKXNSQDKOMS-OWOJBTEDSA-N -1 3 344.201 4.309 20 0 EIADHM CCC1CCC(N(C(=O)NCc2ccc([O-])c(F)c2)C2CC2)CC1 ZINC000486111232 1036490809 /nfs/dbraw/zinc/49/08/09/1036490809.db2.gz PYFQSQOOFSLZLW-UHFFFAOYSA-N -1 3 334.435 4.174 20 0 EIADHM C[C@@H](Oc1ccccc1Cl)C(=O)Nc1cc(Cl)ccc1[O-] ZINC000588925602 1036604621 /nfs/dbraw/zinc/60/46/21/1036604621.db2.gz HYNNHDGTZRIYBY-SECBINFHSA-N -1 3 326.179 4.105 20 0 EIADHM O=C(Nc1ccc(Cl)cc1[O-])c1cc2cc(Cl)sc2[nH]1 ZINC000486791453 1036856933 /nfs/dbraw/zinc/85/69/33/1036856933.db2.gz NSTFTKGUWJJFFO-UHFFFAOYSA-N -1 3 327.192 4.494 20 0 EIADHM [O-]c1ccc(F)c(CN2CC3(CCOCC3)[C@H]2c2ccccc2)c1F ZINC000414561102 1036865179 /nfs/dbraw/zinc/86/51/79/1036865179.db2.gz RNBRGMBQSXFKMD-LJQANCHMSA-N -1 3 345.389 4.024 20 0 EIADHM [O-]c1ccc(F)c(CN2CC3(CCOCC3)[C@@H]2c2ccccc2)c1F ZINC000414561101 1036865532 /nfs/dbraw/zinc/86/55/32/1036865532.db2.gz RNBRGMBQSXFKMD-IBGZPJMESA-N -1 3 345.389 4.024 20 0 EIADHM CCCCC[C@H]1CCCN1c1ccc(-c2nc(CC)cc(=O)[n-]2)cn1 ZINC000486928026 1036893290 /nfs/dbraw/zinc/89/32/90/1036893290.db2.gz RVJPUOWJHNJVAN-KRWDZBQOSA-N -1 3 340.471 4.356 20 0 EIADHM Cc1ccc([O-])c(NC(=O)c2ccc(C(F)(F)F)cc2Cl)n1 ZINC000345970520 1036971546 /nfs/dbraw/zinc/97/15/46/1036971546.db2.gz CGQMCNAUJHIWFE-UHFFFAOYSA-N -1 3 330.693 4.020 20 0 EIADHM COc1cc([C@@H](C)/N=C/c2cc(Cl)ccc2[O-])cc(OC)c1OC ZINC000044010199 1037423951 /nfs/dbraw/zinc/42/39/51/1037423951.db2.gz RRMWHGQUFROKEL-JZOCJUILSA-N -1 3 349.814 4.252 20 0 EIADHM Cc1cc(=O)[n-]c([C@@H](C)Sc2nnc(-c3cccc(Cl)c3)o2)n1 ZINC000488483336 1037629982 /nfs/dbraw/zinc/62/99/82/1037629982.db2.gz SRKGUVQFRAXYBY-SECBINFHSA-N -1 3 348.815 4.047 20 0 EIADHM O=C([N-]c1nc2ccsc2s1)c1cc(-c2ccccc2)no1 ZINC000605117034 1037684098 /nfs/dbraw/zinc/68/40/98/1037684098.db2.gz YSOZARPTBFLUFP-UHFFFAOYSA-N -1 3 327.390 4.265 20 0 EIADHM Cc1cccc2nc(-c3cnn(-c4cccc(Cl)c4)c3)[n-]c(=O)c12 ZINC000489235685 1037906289 /nfs/dbraw/zinc/90/62/89/1037906289.db2.gz VXGAEEYELHSPOM-UHFFFAOYSA-N -1 3 336.782 4.150 20 0 EIADHM Cc1ccc(C(C)C)cc1O[C@H](C)C(=O)NCc1ccc([O-])c(F)c1 ZINC000606537266 1038150825 /nfs/dbraw/zinc/15/08/25/1038150825.db2.gz NLNABXDTBMNFLX-CQSZACIVSA-N -1 3 345.414 4.047 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)c1cc2c(s1)CCCCCC2 ZINC000606537264 1038154698 /nfs/dbraw/zinc/15/46/98/1038154698.db2.gz MRJBRLVJKYFXIO-UHFFFAOYSA-N -1 3 333.428 4.182 20 0 EIADHM CC(C)c1ccc(C(C)(C)NC(=O)NCc2ccc([O-])c(F)c2)cc1 ZINC000606677999 1038219731 /nfs/dbraw/zinc/21/97/31/1038219731.db2.gz VSRQLJFPPJTXFF-UHFFFAOYSA-N -1 3 344.430 4.389 20 0 EIADHM Cc1cc(S(=O)(=O)[N-]c2ccc(OC(C)C)cc2)cc(C)c1F ZINC000460443691 1038805550 /nfs/dbraw/zinc/80/55/50/1038805550.db2.gz BRIQDTKBAJGNRY-UHFFFAOYSA-N -1 3 337.416 4.031 20 0 EIADHM Cc1ccccc1[C@@H]1CN(C(=O)c2ccc(C(C)C)cc2[O-])CCO1 ZINC000608443504 1038824897 /nfs/dbraw/zinc/82/48/97/1038824897.db2.gz MYQOTVJVZNAJKA-FQEVSTJZSA-N -1 3 339.435 4.038 20 0 EIADHM CCCc1ccc(S(=O)(=O)[N-]c2ccc(C)c(OC)c2C)cc1 ZINC000505054740 1038922391 /nfs/dbraw/zinc/92/23/91/1038922391.db2.gz JGDNYPVMFVMFSK-UHFFFAOYSA-N -1 3 333.453 4.065 20 0 EIADHM Cc1ccc(C(=O)Nc2ccc([O-])c(C(F)(F)F)c2)c(C2CC2)n1 ZINC000456006622 1039025278 /nfs/dbraw/zinc/02/52/78/1039025278.db2.gz ZJZBKQTZGTWFHY-UHFFFAOYSA-N -1 3 336.313 4.244 20 0 EIADHM CC(C)c1ccc(C(=O)N2CC[C@@H](C(F)(F)F)C[C@@H]2C)c([O-])c1 ZINC000456109537 1039099840 /nfs/dbraw/zinc/09/98/40/1039099840.db2.gz DKLBUSZQYBEMHG-WCQYABFASA-N -1 3 329.362 4.319 20 0 EIADHM C[C@@]1(CNC(=O)c2cc([O-])c3ccccc3c2)CCOC2(CCC2)C1 ZINC000899490051 1039208875 /nfs/dbraw/zinc/20/88/75/1039208875.db2.gz ZCKWOSMVGGKPNA-HXUWFJFHSA-N -1 3 339.435 4.015 20 0 EIADHM CC(=O)c1cccc(NC(=O)c2cc(C)c(OC(F)F)c(C)c2)c1[O-] ZINC000552285948 1039338691 /nfs/dbraw/zinc/33/86/91/1039338691.db2.gz HABUVNKPQMJOSC-UHFFFAOYSA-N -1 3 349.333 4.065 20 0 EIADHM Cc1cc(=O)[n-]c([C@H](C)SCc2cccc(OC(F)F)c2)n1 ZINC000121798394 1039489650 /nfs/dbraw/zinc/48/96/50/1039489650.db2.gz QRABHUVVHFLRKK-JTQLQIEISA-N -1 3 326.368 4.086 20 0 EIADHM CCOc1ccc(C(=O)CCC(=O)Nc2c([O-])cccc2Cl)cc1 ZINC000552435440 1039514148 /nfs/dbraw/zinc/51/41/48/1039514148.db2.gz HLYMKUSWWSQMAE-UHFFFAOYSA-N -1 3 347.798 4.046 20 0 EIADHM O=C(Nc1c([O-])cccc1Cl)c1cc(F)cc(Br)c1 ZINC000552781631 1039817820 /nfs/dbraw/zinc/81/78/20/1039817820.db2.gz OZSFORLPVQMGJD-UHFFFAOYSA-N -1 3 344.567 4.200 20 0 EIADHM CCOc1ccc2cc(C(=O)Nc3c([O-])cccc3Cl)[nH]c2c1 ZINC000552783196 1039819406 /nfs/dbraw/zinc/81/94/06/1039819406.db2.gz HWAVDVSSJLTGOP-UHFFFAOYSA-N -1 3 330.771 4.178 20 0 EIADHM O=C(Cc1ccc([O-])c(F)c1)N[C@H]1CC[C@H](c2cccc(Cl)c2)C1 ZINC000457076753 1039829637 /nfs/dbraw/zinc/82/96/37/1039829637.db2.gz KZPBDYXSQROYAD-HOCLYGCPSA-N -1 3 347.817 4.180 20 0 EIADHM Cc1cccc(S(=O)(=O)[N-]c2ccc(OC3CCCC3)cc2)c1 ZINC000514527785 1039980598 /nfs/dbraw/zinc/98/05/98/1039980598.db2.gz BAGMRDYMBVEECC-UHFFFAOYSA-N -1 3 331.437 4.117 20 0 EIADHM C[C@H]1C[C@@H](c2ccccc2)N(C(=O)CCCc2ccc([O-])c(F)c2)C1 ZINC000553337797 1040147545 /nfs/dbraw/zinc/14/75/45/1040147545.db2.gz VKEKOYXRKQPAGM-KXBFYZLASA-N -1 3 341.426 4.464 20 0 EIADHM Cc1nc(-c2ccc(CNC(=O)c3ccc(C)cc3[O-])s2)cs1 ZINC000514721257 1040175348 /nfs/dbraw/zinc/17/53/48/1040175348.db2.gz DURMFUBZSWOHOE-UHFFFAOYSA-N -1 3 344.461 4.124 20 0 EIADHM CSc1ccccc1C(=O)Nc1ccc(Br)cc1[O-] ZINC000514820695 1040257274 /nfs/dbraw/zinc/25/72/74/1040257274.db2.gz YTAFRRBHIINEGE-UHFFFAOYSA-N -1 3 338.226 4.129 20 0 EIADHM COc1ccccc1[C@H]1CCCN1C(=O)c1cc(SC)ccc1[O-] ZINC000668101841 1040421780 /nfs/dbraw/zinc/42/17/80/1040421780.db2.gz ADRQKCXRSJJMSF-MRXNPFEDSA-N -1 3 343.448 4.100 20 0 EIADHM CCc1cc(=O)[n-]c(CSCc2cc(-c3ccc(C)cc3)no2)n1 ZINC000477347192 1040440518 /nfs/dbraw/zinc/44/05/18/1040440518.db2.gz GFWTWWWDUQHSLE-UHFFFAOYSA-N -1 3 341.436 4.141 20 0 EIADHM COc1ccc(C2CCN(C(=O)c3cc([O-])ccc3Cl)CC2)cc1 ZINC000551620518 1040462403 /nfs/dbraw/zinc/46/24/03/1040462403.db2.gz JIWKHVXGYGBUOH-UHFFFAOYSA-N -1 3 345.826 4.074 20 0 EIADHM CCc1cc(=O)[n-]c(CSCc2nc(-c3ccccc3)cs2)n1 ZINC000435881805 1040686384 /nfs/dbraw/zinc/68/63/84/1040686384.db2.gz QIMJCPJDVJRSPM-UHFFFAOYSA-N -1 3 343.477 4.302 20 0 EIADHM Cc1ccc(C(=O)N2CCCC[C@@H]2Cc2ccc(F)cc2)c([O-])c1 ZINC000539890225 1040860936 /nfs/dbraw/zinc/86/09/36/1040860936.db2.gz XJSNPBLHUYXFES-QGZVFWFLSA-N -1 3 327.399 4.077 20 0 EIADHM COc1cc(NC(=O)c2cc([O-])c3ccccc3c2)c(C)c(OC)c1 ZINC000504277083 1040903857 /nfs/dbraw/zinc/90/38/57/1040903857.db2.gz OBRSSKJWVPUTHA-UHFFFAOYSA-N -1 3 337.375 4.123 20 0 EIADHM Cc1ccc([N-]S(=O)(=O)c2ccc(CCC(C)C)cc2)c(C)c1O ZINC000515629926 1040913450 /nfs/dbraw/zinc/91/34/50/1040913450.db2.gz PLXUBZGUYIYVBR-UHFFFAOYSA-N -1 3 347.480 4.398 20 0 EIADHM O=C(CCc1cncc2ccccc21)Nc1cc(Cl)ccc1[O-] ZINC000462772468 1040928424 /nfs/dbraw/zinc/92/84/24/1040928424.db2.gz ICSSOZXVDPXYKL-UHFFFAOYSA-N -1 3 326.783 4.165 20 0 EIADHM Cc1cc(C)c(S(=O)(=O)[N-]c2cc3[nH]ccc3cc2C)c(C)c1 ZINC000436179536 1040946809 /nfs/dbraw/zinc/94/68/09/1040946809.db2.gz OGJDOGOHIUMTDZ-UHFFFAOYSA-N -1 3 328.437 4.202 20 0 EIADHM CC[C@@H]1CC[C@@H](C)N(Cc2ccc(C(=O)[O-])cc2Br)C1 ZINC000380280988 1040965774 /nfs/dbraw/zinc/96/57/74/1040965774.db2.gz BIOSQZHVBUMDPF-VXGBXAGGSA-N -1 3 340.261 4.158 20 0 EIADHM CCCCCc1nnc([N-]C(=O)c2cc(F)c(F)cc2Cl)s1 ZINC000014714574 1041073126 /nfs/dbraw/zinc/07/31/26/1041073126.db2.gz CFJDENGFBFBFOU-UHFFFAOYSA-N -1 3 345.802 4.455 20 0 EIADHM Cc1ccc(C(=O)N(C)[C@@H](C)c2nc3ccccc3s2)c([O-])c1 ZINC000194811079 1041213170 /nfs/dbraw/zinc/21/31/70/1041213170.db2.gz RVYUWQHPFOHXAM-LBPRGKRZSA-N -1 3 326.421 4.144 20 0 EIADHM O=C([O-])C[C@@H](CCc1ccccc1)NCc1c(F)cccc1Cl ZINC000904037818 1041287564 /nfs/dbraw/zinc/28/75/64/1041287564.db2.gz CINUHPUSTQBWHJ-CQSZACIVSA-N -1 3 335.806 4.045 20 0 EIADHM CC(C)(C)c1cnc(CN[C@@H](CCc2ccccc2)CC(=O)[O-])s1 ZINC000904039764 1041291797 /nfs/dbraw/zinc/29/17/97/1041291797.db2.gz CBLHXZVQVPKNQA-HNNXBMFYSA-N -1 3 346.496 4.006 20 0 EIADHM O=C(c1ccccc1[O-])N(CCc1ccccc1F)C1CCCC1 ZINC000436536234 1041307311 /nfs/dbraw/zinc/30/73/11/1041307311.db2.gz AJYYIRYVCOWICX-UHFFFAOYSA-N -1 3 327.399 4.159 20 0 EIADHM [O-]c1ccc(OCc2ccccc2)cc1-c1nc(-c2ccco2)no1 ZINC000436518083 1041323474 /nfs/dbraw/zinc/32/34/74/1041323474.db2.gz WGGPYOKFXHYPLY-UHFFFAOYSA-N -1 3 334.331 4.281 20 0 EIADHM CCCN(C(=O)c1ccc(C)cc1[O-])[C@@H](C)c1ccccc1OC ZINC000436540500 1041334325 /nfs/dbraw/zinc/33/43/25/1041334325.db2.gz PCXUUQXJYRICEC-HNNXBMFYSA-N -1 3 327.424 4.323 20 0 EIADHM CCCN(CC(F)F)C(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436541733 1041335075 /nfs/dbraw/zinc/33/50/75/1041335075.db2.gz ZLQIRJHRZIHBIN-UHFFFAOYSA-N -1 3 335.350 4.302 20 0 EIADHM CC[C@@H](CN(CC)C(=O)c1ccc(OC)cc1[O-])c1ccccc1 ZINC000436565486 1041345547 /nfs/dbraw/zinc/34/55/47/1041345547.db2.gz MWMCRAWCSWLCLA-HNNXBMFYSA-N -1 3 327.424 4.057 20 0 EIADHM CC(C)c1ccc(C(=O)N2CC[C@@H](c3cccc(F)c3)C2)c([O-])c1 ZINC000436571814 1041349950 /nfs/dbraw/zinc/34/99/50/1041349950.db2.gz WYTNDVLXBMZHPX-MRXNPFEDSA-N -1 3 327.399 4.284 20 0 EIADHM CC(=O)c1ccc(C(=O)N2CCC[C@@H]2c2ccccc2Cl)cc1[O-] ZINC000436599590 1041358235 /nfs/dbraw/zinc/35/82/35/1041358235.db2.gz DTWQWGDFBSDGSS-QGZVFWFLSA-N -1 3 343.810 4.226 20 0 EIADHM CC(C)(C)OC(=O)N=c1[n-]cc(-c2nc(-c3ccccc3)no2)s1 ZINC000904236323 1041400109 /nfs/dbraw/zinc/40/01/09/1041400109.db2.gz MOLMEBCDJZHHSM-UHFFFAOYSA-N -1 3 344.396 4.207 20 0 EIADHM CC(=O)c1cc(F)c([N-]C(=O)c2sc(C(C)C)nc2C)c(F)c1 ZINC000538543535 1041402459 /nfs/dbraw/zinc/40/24/59/1041402459.db2.gz RSFIXPDNAGQCTA-UHFFFAOYSA-N -1 3 338.379 4.308 20 0 EIADHM O=C(c1c([O-])cccc1O)N1CC=C(c2cccc3ccccc32)CC1 ZINC000436648555 1041404278 /nfs/dbraw/zinc/40/42/78/1041404278.db2.gz NZLPUSXSLMRHOI-UHFFFAOYSA-N -1 3 345.398 4.181 20 0 EIADHM CCc1ccc(C(=O)N2CC[C@@H](C(F)(F)F)C3(CCC3)C2)c([O-])c1 ZINC000436661628 1041415243 /nfs/dbraw/zinc/41/52/43/1041415243.db2.gz DNINVDZKLGVADD-OAHLLOKOSA-N -1 3 341.373 4.149 20 0 EIADHM CCCCN(C(=O)c1cc(NC(C)=O)ccc1[O-])[C@@H]1CCC[C@H](C)C1 ZINC000436701622 1041432002 /nfs/dbraw/zinc/43/20/02/1041432002.db2.gz AFEIKJHFDZBYIG-WMLDXEAASA-N -1 3 346.471 4.172 20 0 EIADHM COc1cccc(C(=O)Nc2cccc(-c3nc(C)cs3)c2)c1[O-] ZINC000436710364 1041436943 /nfs/dbraw/zinc/43/69/43/1041436943.db2.gz SORNFVMHIOGEIR-UHFFFAOYSA-N -1 3 340.404 4.085 20 0 EIADHM C[C@H]1CSCCN(C(=O)c2cc(Oc3ccccc3)ccc2[O-])C1 ZINC000436727891 1041452269 /nfs/dbraw/zinc/45/22/69/1041452269.db2.gz DVRAHBUDYOCHCZ-CQSZACIVSA-N -1 3 343.448 4.010 20 0 EIADHM C[C@H](Cc1ccccc1C(F)(F)F)N(C)C(=O)c1ccccc1[O-] ZINC000436787892 1041482102 /nfs/dbraw/zinc/48/21/02/1041482102.db2.gz ZPGSCPFLTGPZAV-GFCCVEGCSA-N -1 3 337.341 4.114 20 0 EIADHM COc1ccc(C(=O)N2CCCCC[C@H]2c2ccccc2)c([O-])c1 ZINC000436803667 1041488708 /nfs/dbraw/zinc/48/87/08/1041488708.db2.gz MAWQCRAFTAIDGQ-SFHVURJKSA-N -1 3 325.408 4.158 20 0 EIADHM CCc1ccc(C(=O)N2CCCCC[C@@H]2[C@@H]2CCCCC2=O)c([O-])c1 ZINC000436832587 1041498097 /nfs/dbraw/zinc/49/80/97/1041498097.db2.gz SQFRJGOQACVWDA-FUHWJXTLSA-N -1 3 343.467 4.099 20 0 EIADHM CC[C@@H](C)CN(C)C(=O)c1cc(CCc2ccccc2)ccc1[O-] ZINC000436861740 1041523039 /nfs/dbraw/zinc/52/30/39/1041523039.db2.gz FNIJKVODNUCBDC-MRXNPFEDSA-N -1 3 325.452 4.296 20 0 EIADHM COC(=O)c1ccc(-c2noc(-c3ccc(C(C)C)cc3[O-])n2)cc1 ZINC000436894912 1041535957 /nfs/dbraw/zinc/53/59/57/1041535957.db2.gz GYFWFHVSLTUZMP-UHFFFAOYSA-N -1 3 338.363 4.019 20 0 EIADHM CN(C)c1ccc(-c2noc(-c3cc4ccccc4cc3[O-])n2)cc1 ZINC000436897878 1041551077 /nfs/dbraw/zinc/55/10/77/1041551077.db2.gz UZXGUZOTFBEPTG-UHFFFAOYSA-N -1 3 331.375 4.328 20 0 EIADHM CCc1nc(Cc2noc(-c3ccc(C(C)C)cc3[O-])n2)cs1 ZINC000436922046 1041558841 /nfs/dbraw/zinc/55/88/41/1041558841.db2.gz WAUGSXYQWAPYAP-UHFFFAOYSA-N -1 3 329.425 4.175 20 0 EIADHM Cc1ccc(-c2nc(-c3ccc(OC4CCCC4)nc3)no2)c([O-])c1 ZINC000436926520 1041561769 /nfs/dbraw/zinc/56/17/69/1041561769.db2.gz JSZCOJCQXLJWAE-UHFFFAOYSA-N -1 3 337.379 4.134 20 0 EIADHM COc1ccc2c(c1)CCC[C@H]2c1noc(-c2ccc(C)cc2[O-])n1 ZINC000436962542 1041571415 /nfs/dbraw/zinc/57/14/15/1041571415.db2.gz MADUVZSVLYCSJU-MRXNPFEDSA-N -1 3 336.391 4.227 20 0 EIADHM Cc1cc(-c2noc(-c3ccccc3[O-])n2)ccc1Br ZINC000436999305 1041582533 /nfs/dbraw/zinc/58/25/33/1041582533.db2.gz KNJOQTKPWDNEKQ-UHFFFAOYSA-N -1 3 331.169 4.180 20 0 EIADHM COc1cc(-c2noc(-c3ccc(C)cc3[O-])n2)ccc1OC(C)C ZINC000437002675 1041589019 /nfs/dbraw/zinc/58/90/19/1041589019.db2.gz RQRGPHUMBDKZGM-UHFFFAOYSA-N -1 3 340.379 4.213 20 0 EIADHM Cc1cc(N(C)C)ccc1[N-]S(=O)(=O)c1ccccc1C(C)(C)C ZINC000437305407 1041747203 /nfs/dbraw/zinc/74/72/03/1041747203.db2.gz OEYCXRRNUCBUES-UHFFFAOYSA-N -1 3 346.496 4.159 20 0 EIADHM C[C@H]1CO[C@H](c2cccc(Cl)c2)CN1Cc1cc([O-])cc(F)c1 ZINC000438545709 1042232376 /nfs/dbraw/zinc/23/23/76/1042232376.db2.gz KKVKUFRPQVZTJD-SGTLLEGYSA-N -1 3 335.806 4.147 20 0 EIADHM CC(C)Cc1ccc(S(=O)(=O)[N-]c2cc(F)c(F)cc2F)cc1 ZINC000517923274 1042277555 /nfs/dbraw/zinc/27/75/55/1042277555.db2.gz LANFQWJVIWCEIX-UHFFFAOYSA-N -1 3 343.370 4.103 20 0 EIADHM O=C(Cc1cccc(C(F)(F)F)c1)Nc1cc(Cl)ccc1[O-] ZINC000000019093 1042467397 /nfs/dbraw/zinc/46/73/97/1042467397.db2.gz TYFDILYRQOGAAN-UHFFFAOYSA-N -1 3 329.705 4.246 20 0 EIADHM Cc1ccc(-c2ocnc2C(=O)Nc2cc(Cl)ccc2[O-])cc1 ZINC000439099471 1042501484 /nfs/dbraw/zinc/50/14/84/1042501484.db2.gz TYIUQXOAKSYSSP-UHFFFAOYSA-N -1 3 328.755 4.261 20 0 EIADHM O=C(c1cc(OCc2ccccc2)ccc1[O-])N1CCc2ccccc21 ZINC000303848650 1042519162 /nfs/dbraw/zinc/51/91/62/1042519162.db2.gz UPJBHGWSJHFJIY-UHFFFAOYSA-N -1 3 345.398 4.174 20 0 EIADHM O=c1nc(CN2CC[C@@H]3CCC[C@@H]32)[n-]c2scc(-c3ccco3)c21 ZINC000426461854 1042729357 /nfs/dbraw/zinc/72/93/57/1042729357.db2.gz PSZHHFTXWZSTAI-AAEUAGOBSA-N -1 3 341.436 4.031 20 0 EIADHM Cc1cc(C)c(S(=O)(=O)[N-]c2cccc(C(F)F)c2)c(C)c1 ZINC000509612037 1042744742 /nfs/dbraw/zinc/74/47/42/1042744742.db2.gz WMLBCZZFSJHKHR-UHFFFAOYSA-N -1 3 325.380 4.350 20 0 EIADHM CCSc1ccc(Cl)cc1[N-]C(=O)c1ncncc1Cl ZINC000175206512 1042747258 /nfs/dbraw/zinc/74/72/58/1042747258.db2.gz FJWPGGFLOSATEC-UHFFFAOYSA-N -1 3 328.224 4.148 20 0 EIADHM COc1ccc(CN[C@@H](CCC(=O)[O-])c2ccccc2)c(Cl)c1 ZINC000417604127 1042899794 /nfs/dbraw/zinc/89/97/94/1042899794.db2.gz UAAPYLORYQQHMJ-KRWDZBQOSA-N -1 3 333.815 4.044 20 0 EIADHM Cc1cc(C(=O)[N-]c2cccc(Cl)c2SCC(F)F)no1 ZINC000076473917 1043097415 /nfs/dbraw/zinc/09/74/15/1043097415.db2.gz OLQRTNMXXPRDBF-UHFFFAOYSA-N -1 3 332.759 4.246 20 0 EIADHM COc1cccc(F)c1[N-]C(=O)c1cc(-c2ccc(C)cc2)no1 ZINC000184434659 1043099514 /nfs/dbraw/zinc/09/95/14/1043099514.db2.gz HPEVYQWJFPJAML-UHFFFAOYSA-N -1 3 326.327 4.050 20 0 EIADHM Cn1ncc(NC(=O)c2cc([O-])c3ccccc3c2)c1-c1ccccc1 ZINC000516987598 1043144345 /nfs/dbraw/zinc/14/43/45/1043144345.db2.gz BSRARSXIMUHBSM-UHFFFAOYSA-N -1 3 343.386 4.198 20 0 EIADHM C[C@H]1[C@H](C(F)(F)F)CCCN1C(=O)c1cc([O-])c2ccccc2c1 ZINC000526919321 1043246038 /nfs/dbraw/zinc/24/60/38/1043246038.db2.gz MITLKYZLRHXBNO-XHDPSFHLSA-N -1 3 337.341 4.348 20 0 EIADHM CC1(C)CN(C(=O)c2cc([O-])c3ccccc3c2)CC2(CCCC2)O1 ZINC000526929361 1043246251 /nfs/dbraw/zinc/24/62/51/1043246251.db2.gz LTAZBKCAISMQCT-UHFFFAOYSA-N -1 3 339.435 4.109 20 0 EIADHM C[C@H]([C@H]1Cc2ccccc2O1)N(C)C(=O)c1cc([O-])c2ccccc2c1 ZINC000527166888 1043253140 /nfs/dbraw/zinc/25/31/40/1043253140.db2.gz PBBMWNLZFJPOOL-SPLOXXLWSA-N -1 3 347.414 4.010 20 0 EIADHM C[C@H](NC(=O)c1cc([O-])c2ccccc2c1)c1cccc(F)c1F ZINC000527170351 1043253482 /nfs/dbraw/zinc/25/34/82/1043253482.db2.gz NZLXAWFHRVCUPL-NSHDSACASA-N -1 3 327.330 4.315 20 0 EIADHM CN(Cc1csc2ccccc12)C(=O)NCc1ccc([O-])c(F)c1 ZINC000163635569 1043254499 /nfs/dbraw/zinc/25/44/99/1043254499.db2.gz FPDZICXNWRQHET-UHFFFAOYSA-N -1 3 344.411 4.088 20 0 EIADHM Cc1cccc(OCCN(C)C(=O)c2cc([O-])c3ccccc3c2)c1 ZINC000527451816 1043260327 /nfs/dbraw/zinc/26/03/27/1043260327.db2.gz YEUYXXJCYXSMAN-UHFFFAOYSA-N -1 3 335.403 4.005 20 0 EIADHM Cc1cccc2[nH]cc(CCNC(=O)c3cc([O-])c4ccccc4c3)c21 ZINC000527450310 1043260830 /nfs/dbraw/zinc/26/08/30/1043260830.db2.gz WNPYPXAIYSUIJA-UHFFFAOYSA-N -1 3 344.414 4.308 20 0 EIADHM Cc1cccc([C@@H]2CCCN2C(=O)NCc2ccc([O-])c(F)c2)c1C ZINC000465981532 1043274804 /nfs/dbraw/zinc/27/48/04/1043274804.db2.gz NXNAPSVGYPGYAM-SFHVURJKSA-N -1 3 342.414 4.195 20 0 EIADHM O=c1[n-]c(CN2CC[C@@H]2c2cccc(F)c2)nc2c3ccccc3oc21 ZINC000674012857 1043292118 /nfs/dbraw/zinc/29/21/18/1043292118.db2.gz FWJIMQWHVHTIFZ-OAHLLOKOSA-N -1 3 349.365 4.168 20 0 EIADHM COc1ccc(C(=O)N(C2CC2)[C@H]2CCCc3ccccc32)c([O-])c1 ZINC000220114681 1043292663 /nfs/dbraw/zinc/29/26/63/1043292663.db2.gz IDWIGJCTVAAFRP-IBGZPJMESA-N -1 3 337.419 4.083 20 0 EIADHM C[C@@H](C(=O)[N-][C@H](c1ccc(F)c(Cl)c1)C(F)(F)F)C(C)(F)F ZINC000508175423 1043303374 /nfs/dbraw/zinc/30/33/74/1043303374.db2.gz WGWWYWUMZRONPR-QUBYGPBYSA-N -1 3 347.686 4.490 20 0 EIADHM C[C@@H](OC(=O)c1cc(Cl)c(Cl)[n-]1)C(=O)c1cc(F)ccc1F ZINC000730298005 1043495871 /nfs/dbraw/zinc/49/58/71/1043495871.db2.gz VCDISCRJUZHYTO-ZCFIWIBFSA-N -1 3 348.132 4.028 20 0 EIADHM O=C([N-]c1c(F)cc(F)cc1F)c1ccc(C(F)(F)F)s1 ZINC000674320645 1043603119 /nfs/dbraw/zinc/60/31/19/1043603119.db2.gz DENLNQRLSJSCED-UHFFFAOYSA-N -1 3 325.233 4.437 20 0 EIADHM O=C(OCc1ncc(-c2cccs2)o1)c1cc2ccsc2[n-]1 ZINC000731508384 1043780748 /nfs/dbraw/zinc/78/07/48/1043780748.db2.gz TXYSSMGWBATYMA-UHFFFAOYSA-N -1 3 330.390 4.303 20 0 EIADHM CCCN(C(=O)c1nnc2ccccc2c1[O-])[C@H](CC)c1ccccc1 ZINC000732278437 1043892096 /nfs/dbraw/zinc/89/20/96/1043892096.db2.gz NAOLIUFHPDJVNS-GOSISDBHSA-N -1 3 349.434 4.339 20 0 EIADHM COc1ccc2c(c1)CCCCN2C(=O)c1cc([O-])ccc1Cl ZINC000494740227 1043988063 /nfs/dbraw/zinc/98/80/63/1043988063.db2.gz XIFGVKPUXUUBRA-UHFFFAOYSA-N -1 3 331.799 4.037 20 0 EIADHM O=C(/C=C(\c1ccc(Cl)cc1)C(F)(F)F)Nc1ncccc1[O-] ZINC000761713617 1044302275 /nfs/dbraw/zinc/30/22/75/1044302275.db2.gz UFJPURSPVHVSES-DHZHZOJOSA-N -1 3 342.704 4.025 20 0 EIADHM [O-]c1ccc(-c2nc(-c3ccccc3OCc3ccccc3)no2)nc1 ZINC001212557966 1044305327 /nfs/dbraw/zinc/30/53/27/1044305327.db2.gz KVGDDDZJYAUYQH-UHFFFAOYSA-N -1 3 345.358 4.083 20 0 EIADHM COc1cccc([O-])c1C(=O)N[C@H]1C[C@H](c2ccccc2)C[C@H](C)C1 ZINC001299308696 1044338628 /nfs/dbraw/zinc/33/86/28/1044338628.db2.gz GQTUQIMSRNFUAA-USXIJHARSA-N -1 3 339.435 4.103 20 0 EIADHM CCCOc1ccc(S(=O)(=O)[N-]c2ccc(Cl)cc2C)cc1 ZINC000029046272 1044676671 /nfs/dbraw/zinc/67/66/71/1044676671.db2.gz VIIBAQDFGKVDQI-UHFFFAOYSA-N -1 3 339.844 4.238 20 0 EIADHM Cc1ccc(-c2ccsc2C(=O)[N-]c2nc(C3CC3)no2)cc1 ZINC001129195452 1044680720 /nfs/dbraw/zinc/68/07/20/1044680720.db2.gz NDUPYURTYKOIQV-UHFFFAOYSA-N -1 3 325.393 4.236 20 0 EIADHM [O-]c1cccc(CN2CC[C@@H](OCCCc3ccccc3)C2)c1Cl ZINC000508968164 1044852207 /nfs/dbraw/zinc/85/22/07/1044852207.db2.gz VHOHAHFGYSIMQV-GOSISDBHSA-N -1 3 345.870 4.269 20 0 EIADHM C[C@@H](OC(=O)c1cc2ccsc2[n-]1)c1nnc(-c2cccs2)o1 ZINC000914890863 1044852500 /nfs/dbraw/zinc/85/25/00/1044852500.db2.gz IQPITQRJQOIAKK-MRVPVSSYSA-N -1 3 345.405 4.259 20 0 EIADHM CCc1ccc([O-])c(C(=O)N2CC=C(c3c(F)cccc3F)CC2)c1 ZINC000474322729 1044857602 /nfs/dbraw/zinc/85/76/02/1044857602.db2.gz GMSHNEKASWCASL-UHFFFAOYSA-N -1 3 343.373 4.162 20 0 EIADHM CCC(CC)[C@@H](C)C(=O)Oc1cccc(-c2nc(C)cc(=O)[n-]2)c1 ZINC000762063738 1044886384 /nfs/dbraw/zinc/88/63/84/1044886384.db2.gz DNIRAWYUVWNCJZ-CYBMUJFWSA-N -1 3 328.412 4.135 20 0 EIADHM CN(Cc1nc(=O)c2sc(-c3ccc(F)cc3)cc2[n-]1)CC1CC1 ZINC000053184032 1044948933 /nfs/dbraw/zinc/94/89/33/1044948933.db2.gz BJXYWCQEWNRDAF-UHFFFAOYSA-N -1 3 343.427 4.045 20 0 EIADHM [O-]c1ccc(Cl)c(Nc2cnc(F)c(Br)c2)c1F ZINC001214554443 1045021522 /nfs/dbraw/zinc/02/15/22/1045021522.db2.gz RHKZVLIIXJUWQH-UHFFFAOYSA-N -1 3 335.535 4.225 20 0 EIADHM COc1c(C)cc(C)cc1S(=O)(=O)[N-]c1ccc(C)cc1Cl ZINC000509104598 1045131917 /nfs/dbraw/zinc/13/19/17/1045131917.db2.gz WQWQIMYMBIYLMS-UHFFFAOYSA-N -1 3 339.844 4.075 20 0 EIADHM C[C@@H](Oc1ccccc1NCc1cc([O-])cc(F)c1)C(F)(F)F ZINC000673735168 1045236598 /nfs/dbraw/zinc/23/65/98/1045236598.db2.gz ZPRDHMRKLGEOQM-SNVBAGLBSA-N -1 3 329.293 4.473 20 0 EIADHM COc1cc(Cl)c(C)cc1NC(=O)c1cc([O-])ccc1Cl ZINC000234905882 1045301911 /nfs/dbraw/zinc/30/19/11/1045301911.db2.gz UFBYLOBFKJISBN-UHFFFAOYSA-N -1 3 326.179 4.268 20 0 EIADHM Cc1cccc(NC(=O)c2cc([O-])ccc2Cl)c1Br ZINC000235921427 1045346462 /nfs/dbraw/zinc/34/64/62/1045346462.db2.gz QJUBGVHIZJXTLX-UHFFFAOYSA-N -1 3 340.604 4.369 20 0 EIADHM COc1ccccc1C/C(C)=C/C(=O)Nc1cc(Cl)ccc1[O-] ZINC000762797770 1045353456 /nfs/dbraw/zinc/35/34/56/1045353456.db2.gz CUGHTZZUALHJDP-ZRDIBKRKSA-N -1 3 331.799 4.182 20 0 EIADHM O=C1[N-]C(=O)C(=CNc2cc(C(F)F)ccc2Cl)c2ccccc21 ZINC000767693548 1045597950 /nfs/dbraw/zinc/59/79/50/1045597950.db2.gz UHHZOSJIUBBEHU-XYOKQWHBSA-N -1 3 348.736 4.001 20 0 EIADHM [O-]c1ccc(Nc2ncc(Cl)cc2Br)c(F)c1F ZINC001211997880 1045712782 /nfs/dbraw/zinc/71/27/82/1045712782.db2.gz QOMFIABTXMVCNW-UHFFFAOYSA-N -1 3 335.535 4.225 20 0 EIADHM C[C@@H](CCc1ccc(O)cc1)NC(=O)c1cc2sccc2c([O-])c1 ZINC000791386975 1045729980 /nfs/dbraw/zinc/72/99/80/1045729980.db2.gz RLRQUVFSUYIRSS-LBPRGKRZSA-N -1 3 341.432 4.064 20 0 EIADHM Cn1nc(C2CCCC2)cc1NC(=O)c1cc2sccc2c([O-])c1 ZINC000791400514 1045735909 /nfs/dbraw/zinc/73/59/09/1045735909.db2.gz ZHEUGLZYINZGSY-UHFFFAOYSA-N -1 3 341.436 4.250 20 0 EIADHM Cc1cc(=O)[n-]c(CSCc2cc(Cl)cc3cccnc32)n1 ZINC000763211437 1045750166 /nfs/dbraw/zinc/75/01/66/1045750166.db2.gz SVVHZXUYWVXGEQ-UHFFFAOYSA-N -1 3 331.828 4.126 20 0 EIADHM CC(=O)Nc1cccc([C@@H](C)OC(=O)c2cc3ccsc3[n-]2)c1 ZINC000747029069 1045792520 /nfs/dbraw/zinc/79/25/20/1045792520.db2.gz GTSFMFQVNOWKKT-SNVBAGLBSA-N -1 3 328.393 4.106 20 0 EIADHM O=C([N-]c1ccccc1SC(F)(F)F)c1coc(C2CC2)n1 ZINC000763250384 1045798101 /nfs/dbraw/zinc/79/81/01/1045798101.db2.gz NRXSPZQGWWJEHP-UHFFFAOYSA-N -1 3 328.315 4.416 20 0 EIADHM [O-]c1ccc(Nc2c(F)cc(F)cc2Br)c(F)c1F ZINC001212007456 1045827856 /nfs/dbraw/zinc/82/78/56/1045827856.db2.gz GFWMEMHJRBHHAN-UHFFFAOYSA-N -1 3 336.082 4.455 20 0 EIADHM COC(=O)c1cc(Nc2ccc([O-])c(F)c2F)cc(C(F)(F)F)c1 ZINC001212011164 1045833876 /nfs/dbraw/zinc/83/38/76/1045833876.db2.gz VYBSAIPPAFACOI-UHFFFAOYSA-N -1 3 347.239 4.219 20 0 EIADHM COc1cccc(C(=O)C(F)(F)F)c1Nc1ccc([O-])c(F)c1F ZINC001212016279 1045838959 /nfs/dbraw/zinc/83/89/59/1045838959.db2.gz HWSMSPDAMZHPPG-UHFFFAOYSA-N -1 3 347.239 4.168 20 0 EIADHM O=C(c1cccc(F)c1Nc1ccc([O-])c(F)c1F)C(F)(F)F ZINC001212016410 1045839661 /nfs/dbraw/zinc/83/96/61/1045839661.db2.gz OQNGREONRUTYDC-UHFFFAOYSA-N -1 3 335.203 4.298 20 0 EIADHM O=C(Nc1cccc(Cn2cccn2)c1)c1cc([O-])c2ccccc2c1 ZINC000792053413 1045852705 /nfs/dbraw/zinc/85/27/05/1045852705.db2.gz WBFKJMMQGHMRFD-UHFFFAOYSA-N -1 3 343.386 4.043 20 0 EIADHM C[C@H](CNC(=O)c1cc([O-])c2ccccc2c1)c1nc2ccccc2o1 ZINC000792208197 1045869779 /nfs/dbraw/zinc/86/97/79/1045869779.db2.gz RQUHCXOUZMATCZ-CYBMUJFWSA-N -1 3 346.386 4.220 20 0 EIADHM O=C(N[C@H]1COc2c1cccc2Cl)c1cc([O-])c2ccccc2c1 ZINC000792223167 1045877784 /nfs/dbraw/zinc/87/77/84/1045877784.db2.gz OFVAMTYPUWUDAZ-INIZCTEOSA-N -1 3 339.778 4.062 20 0 EIADHM CCN(Cc1ccc(Cl)s1)Cc1cc(=O)oc2cc([O-])ccc12 ZINC000916569802 1046089247 /nfs/dbraw/zinc/08/92/47/1046089247.db2.gz VPBVRIJRFMICBP-UHFFFAOYSA-N -1 3 349.839 4.236 20 0 EIADHM Cc1ccc([O-])c(C(=O)Nc2ccc(N(C)C)cc2C(F)(F)F)c1 ZINC000123851334 1046200899 /nfs/dbraw/zinc/20/08/99/1046200899.db2.gz UPZYPGXWNZBMGJ-UHFFFAOYSA-N -1 3 338.329 4.038 20 0 EIADHM COc1ccc(N(C(=O)c2cc(C)ccc2[O-])[C@H](C)C2CC2)cc1 ZINC000124609094 1046251150 /nfs/dbraw/zinc/25/11/50/1046251150.db2.gz ZARGJSSBTDDSQD-CQSZACIVSA-N -1 3 325.408 4.155 20 0 EIADHM O=C(Cc1c[nH]c2ccccc12)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000125290848 1046298197 /nfs/dbraw/zinc/29/81/97/1046298197.db2.gz FFRSKMWBFXHBTA-UHFFFAOYSA-N -1 3 334.297 4.074 20 0 EIADHM CCCCC[C@H](C(=O)Nc1nc2c(cccc2C(=O)OC)[n-]1)C(C)C ZINC001127417798 1046328967 /nfs/dbraw/zinc/32/89/67/1046328967.db2.gz BRGUZDQQJAJQKO-ZDUSSCGKSA-N -1 3 345.443 4.141 20 0 EIADHM O=C(c1ccc(F)cc1)[C@@H]1CCCN(Cc2cccc([O-])c2Cl)C1 ZINC000508709728 1046365217 /nfs/dbraw/zinc/36/52/17/1046365217.db2.gz OPGZETHZOMTUCB-OAHLLOKOSA-N -1 3 347.817 4.280 20 0 EIADHM COCCOc1ccc(Nc2c(Cl)ccc([O-])c2F)cc1F ZINC001214563400 1046394896 /nfs/dbraw/zinc/39/48/96/1046394896.db2.gz DTZJDQMWYNPRDK-UHFFFAOYSA-N -1 3 329.730 4.093 20 0 EIADHM COc1cc(-c2nc(-c3cccc(C(F)F)c3)no2)cc(OC)c1[O-] ZINC000771525585 1046438132 /nfs/dbraw/zinc/43/81/32/1046438132.db2.gz KJGNYXMYRMOKTR-UHFFFAOYSA-N -1 3 348.305 4.064 20 0 EIADHM C[C@@H]1Cc2ccccc2[C@H]1NCc1cccc([O-])c1Br ZINC000459413373 1046636956 /nfs/dbraw/zinc/63/69/56/1046636956.db2.gz WZWHXXAVTSHWNO-DIFFPNOSSA-N -1 3 332.241 4.178 20 0 EIADHM Cc1ccc([O-])c(C(=O)Nc2ccccc2NC(=O)c2ccccc2)c1 ZINC000536692789 1046684816 /nfs/dbraw/zinc/68/48/16/1046684816.db2.gz NDDZRPOQXDQUBH-UHFFFAOYSA-N -1 3 346.386 4.205 20 0 EIADHM C[C@H](Sc1ccccc1Cl)C(=O)Nc1cccc([O-])c1F ZINC000128200856 1046780688 /nfs/dbraw/zinc/78/06/88/1046780688.db2.gz DOWBURWOGOJAIK-VIFPVBQESA-N -1 3 325.792 4.304 20 0 EIADHM C[C@H](OC(=O)c1cc2occc2[n-]1)C(=O)C12CC3CC(CC(C3)C1)C2 ZINC000786029500 1046796456 /nfs/dbraw/zinc/79/64/56/1046796456.db2.gz DVDHXUKOXOCCLK-ABROSTTOSA-N -1 3 341.407 4.092 20 0 EIADHM CCc1ccc(C(=O)N2CCC(c3cc4ccccc4[nH]3)CC2)c([O-])c1 ZINC000786844739 1046875767 /nfs/dbraw/zinc/87/57/67/1046875767.db2.gz RVGCADFXCOEFLH-UHFFFAOYSA-N -1 3 348.446 4.456 20 0 EIADHM CCc1ccc(OC(=O)CCCc2ccc([O-])c(F)c2)c(OC)c1 ZINC000787171197 1046930194 /nfs/dbraw/zinc/93/01/94/1046930194.db2.gz IWIIVCJFGKYBBG-UHFFFAOYSA-N -1 3 332.371 4.031 20 0 EIADHM O=C(Cc1ccc(Br)c(Cl)c1)[N-]OC1CCCCC1 ZINC000787310068 1046990272 /nfs/dbraw/zinc/99/02/72/1046990272.db2.gz WBODWUBVRUBEJU-UHFFFAOYSA-N -1 3 346.652 4.026 20 0 EIADHM Cc1nc(C2CCCCC2)sc1C(=O)NCc1ccc([O-])c(F)c1 ZINC000537170604 1047005886 /nfs/dbraw/zinc/00/58/86/1047005886.db2.gz HRCCLDZBXGGXID-UHFFFAOYSA-N -1 3 348.443 4.274 20 0 EIADHM C[C@@H](OC(=O)CCCc1ccc([O-])c(F)c1)c1ncc(C(C)(C)C)o1 ZINC000787829443 1047058700 /nfs/dbraw/zinc/05/87/00/1047058700.db2.gz NEJGRVXOADXXQF-GFCCVEGCSA-N -1 3 349.402 4.444 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)OCCCC(=O)c1ccccc1 ZINC000787845618 1047059594 /nfs/dbraw/zinc/05/95/94/1047059594.db2.gz QADBUCLJOFHVAS-UHFFFAOYSA-N -1 3 344.382 4.060 20 0 EIADHM O=C(Nc1ccc(OC(F)F)cc1)c1cc2sccc2c([O-])c1 ZINC000788262902 1047145954 /nfs/dbraw/zinc/14/59/54/1047145954.db2.gz IGCZTSRODONUDS-UHFFFAOYSA-N -1 3 335.331 4.461 20 0 EIADHM O=C(N[C@@H]1[C@@H]2CCc3ccccc3[C@@H]21)c1cc2sccc2c([O-])c1 ZINC000788310132 1047165483 /nfs/dbraw/zinc/16/54/83/1047165483.db2.gz ZIWRVZKJFZWULI-AYOQOUSVSA-N -1 3 335.428 4.065 20 0 EIADHM CCCS(=O)(=O)[N-]c1ccc(Cl)cc1-c1nc2ccccc2[nH]1 ZINC000537397342 1047184764 /nfs/dbraw/zinc/18/47/64/1047184764.db2.gz WZJJOYNPUPRGCU-UHFFFAOYSA-N -1 3 349.843 4.035 20 0 EIADHM C/C(=C/C(=O)Nc1ccc(Br)cc1[O-])c1ccccc1 ZINC000918125815 1047343624 /nfs/dbraw/zinc/34/36/24/1047343624.db2.gz UODJHRJWAJPHRS-LUAWRHEFSA-N -1 3 332.197 4.197 20 0 EIADHM O=C(Nc1ccc([O-])c(C(F)(F)F)c1)[C@@H]1Cc2ccccc2S1 ZINC000476136973 1047369167 /nfs/dbraw/zinc/36/91/67/1047369167.db2.gz DURSJQZSIOYDAB-AWEZNQCLSA-N -1 3 339.338 4.067 20 0 EIADHM Cc1ccc(C(=O)Nc2ccc(N3CCCC3)c(F)c2)c([O-])c1C ZINC000918348825 1047412147 /nfs/dbraw/zinc/41/21/47/1047412147.db2.gz DFVZYGBQVBMJPX-UHFFFAOYSA-N -1 3 328.387 4.001 20 0 EIADHM CC(=O)c1cccc(NC(=O)C=Cc2cnc(C(C)(C)C)s2)c1[O-] ZINC000808187789 1047621779 /nfs/dbraw/zinc/62/17/79/1047621779.db2.gz KVYDBRAWLGUVNZ-HJWRWDBZSA-N -1 3 344.436 4.001 20 0 EIADHM O=C(N[C@H]1C[C@H]1c1c(F)cccc1Cl)c1cc([O-])ccc1Cl ZINC000556306125 1047668134 /nfs/dbraw/zinc/66/81/34/1047668134.db2.gz PMVPAKUGQKVRMF-YGRLFVJLSA-N -1 3 340.181 4.124 20 0 EIADHM CC(C)(Cc1ccccc1Cl)NC(=O)c1cc([O-])ccc1Cl ZINC000550644541 1047801458 /nfs/dbraw/zinc/80/14/58/1047801458.db2.gz CFFAOAUFIIQABI-UHFFFAOYSA-N -1 3 338.234 4.450 20 0 EIADHM O=C(Nc1ncccc1[O-])c1ccc(SCc2ccccc2)cc1 ZINC000071945653 1047818050 /nfs/dbraw/zinc/81/80/50/1047818050.db2.gz FNCYKAVIRAWZLU-UHFFFAOYSA-N -1 3 336.416 4.332 20 0 EIADHM O=C(CCCCc1ccc(Cl)cc1)Nc1n[n-]c(-c2ccco2)n1 ZINC001134127675 1047865722 /nfs/dbraw/zinc/86/57/22/1047865722.db2.gz AAHRHDAYKLMXAR-UHFFFAOYSA-N -1 3 344.802 4.070 20 0 EIADHM CC(F)(F)C(=O)[N-]Cc1ccc(Oc2ccccc2F)c(F)c1 ZINC000808463212 1047930474 /nfs/dbraw/zinc/93/04/74/1047930474.db2.gz WUCWJMBSNUMXAM-UHFFFAOYSA-N -1 3 327.277 4.029 20 0 EIADHM CC[C@@H](NCc1cccnc1OC)c1ccc(Cl)c(Cl)c1[O-] ZINC000155081927 1048053833 /nfs/dbraw/zinc/05/38/33/1048053833.db2.gz FXDDOKABEGBNJE-CYBMUJFWSA-N -1 3 341.238 4.344 20 0 EIADHM CCc1ccc([O-])c(C(=O)Nc2cc3sc(C)nc3cc2OC)c1 ZINC001143361814 1048115230 /nfs/dbraw/zinc/11/52/30/1048115230.db2.gz ZQMMUDUUFWZMQD-UHFFFAOYSA-N -1 3 342.420 4.134 20 0 EIADHM Cc1cc(=O)[n-]c(-c2cccc(OC(=O)CC3(C)CCCC3)c2)n1 ZINC000808988482 1048175475 /nfs/dbraw/zinc/17/54/75/1048175475.db2.gz RSSZTNSZCUHFDL-UHFFFAOYSA-N -1 3 326.396 4.033 20 0 EIADHM O=C(Cc1cccc2ccccc21)[N-]OCc1sccc1Cl ZINC000809377529 1048330932 /nfs/dbraw/zinc/33/09/32/1048330932.db2.gz JKKLUMHELIWUDL-UHFFFAOYSA-N -1 3 331.824 4.345 20 0 EIADHM CSc1cc(Cl)c(C(F)(F)F)cc1[N-]C(=O)c1cnccn1 ZINC001131811174 1048470497 /nfs/dbraw/zinc/47/04/97/1048470497.db2.gz JBIIZOMSBOGECH-UHFFFAOYSA-N -1 3 347.749 4.123 20 0 EIADHM CC(=O)c1cccc(NC(=O)c2c([O-])c(C)nc3ccccc32)c1C ZINC001149197264 1048480234 /nfs/dbraw/zinc/48/02/34/1048480234.db2.gz LTZKRWSQFBBTKL-UHFFFAOYSA-N -1 3 334.375 4.012 20 0 EIADHM Cc1sc2[n-]c([C@@H](C)OC(=O)CC(C)(C)C3CC3)nc(=O)c2c1C ZINC000815470855 1048481048 /nfs/dbraw/zinc/48/10/48/1048481048.db2.gz MAFQEMDBUJZADV-SNVBAGLBSA-N -1 3 348.468 4.444 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)[C@@H]1C[C@H]1c1ccc2ccccc2c1 ZINC000132742348 1048481625 /nfs/dbraw/zinc/48/16/25/1048481625.db2.gz ILJDTIWIOAXYME-ZWKOTPCHSA-N -1 3 335.378 4.104 20 0 EIADHM CCc1noc(C)c1[N-]C(=O)c1csc(-c2ccc(F)cc2)n1 ZINC000133088967 1048596218 /nfs/dbraw/zinc/59/62/18/1048596218.db2.gz AVDWKSVMMZYZSP-UHFFFAOYSA-N -1 3 331.372 4.060 20 0 EIADHM C[C@@H](NC(=O)c1cc(CCc2ccccc2)ccc1[O-])c1ccccn1 ZINC001135341744 1048671737 /nfs/dbraw/zinc/67/17/37/1048671737.db2.gz IHUOSLFKJFZHGZ-MRXNPFEDSA-N -1 3 346.430 4.063 20 0 EIADHM CCCCCc1ccc(NC(=O)c2cc3c(cc2[O-])OCO3)cc1 ZINC001135327948 1048672975 /nfs/dbraw/zinc/67/29/75/1048672975.db2.gz WXLSWRIZMJUCJV-UHFFFAOYSA-N -1 3 327.380 4.106 20 0 EIADHM CC(C)CC(CC(C)C)NC(=O)c1c[n-]c2c(Cl)cccc2c1=O ZINC001144529403 1048713613 /nfs/dbraw/zinc/71/36/13/1048713613.db2.gz FWCWZZUYNURXJV-UHFFFAOYSA-N -1 3 348.874 4.372 20 0 EIADHM CCOc1ccc(SCc2noc(-c3ccccc3[O-])n2)cc1 ZINC000920751566 1048770451 /nfs/dbraw/zinc/77/04/51/1048770451.db2.gz DGXNNWJZPFGYCW-UHFFFAOYSA-N -1 3 328.393 4.133 20 0 EIADHM COc1ccc(C[C@H]2CCCN(Cc3cc(F)c([O-])cc3F)C2)cc1 ZINC001144659271 1048794438 /nfs/dbraw/zinc/79/44/38/1048794438.db2.gz BAXFVSWFCOAWBT-OAHLLOKOSA-N -1 3 347.405 4.134 20 0 EIADHM O=C([N-][C@@H](c1ccco1)c1ccccc1)C(F)(F)c1ccc(F)cc1 ZINC000920842636 1048801735 /nfs/dbraw/zinc/80/17/35/1048801735.db2.gz IUMRSWLNFCHSNG-QGZVFWFLSA-N -1 3 345.320 4.416 20 0 EIADHM Cc1nc(COC(=O)c2cc3cc(Cl)sc3[n-]2)sc1C ZINC000810598580 1048819666 /nfs/dbraw/zinc/81/96/66/1048819666.db2.gz WKFZUTOKMWIIAJ-UHFFFAOYSA-N -1 3 326.830 4.313 20 0 EIADHM O=S(=O)(/C=C/c1ccc(F)cc1)[N-]c1ccccc1OCC1CC1 ZINC000747617350 1048831999 /nfs/dbraw/zinc/83/19/99/1048831999.db2.gz VSYUDMWIUDTAAT-VAWYXSNFSA-N -1 3 347.411 4.027 20 0 EIADHM CC(C)(C(=O)[O-])[C@@H]1CCCN(Cc2ncc(-c3ccccc3)s2)C1 ZINC000846286253 1048852718 /nfs/dbraw/zinc/85/27/18/1048852718.db2.gz YWRCLRLOSCIPQO-OAHLLOKOSA-N -1 3 344.480 4.133 20 0 EIADHM COc1cccc([C@H](C)C(=O)Nc2ccc([O-])c(C(F)(F)F)c2)c1 ZINC000134154670 1048887689 /nfs/dbraw/zinc/88/76/89/1048887689.db2.gz DBUDILBWGOOARS-JTQLQIEISA-N -1 3 339.313 4.162 20 0 EIADHM O=C(Nc1ccc([O-])c(C(F)(F)F)c1)C1(c2ccccc2F)CC1 ZINC000134201432 1048895310 /nfs/dbraw/zinc/89/53/10/1048895310.db2.gz YOBJAKQQOUPHNW-UHFFFAOYSA-N -1 3 339.288 4.220 20 0 EIADHM COc1ccccc1SCc1cc(=O)oc2c(C)c([O-])ccc12 ZINC000921265093 1048898402 /nfs/dbraw/zinc/89/84/02/1048898402.db2.gz MSJKSNNIYDHXFL-UHFFFAOYSA-N -1 3 328.389 4.108 20 0 EIADHM O=C(N[C@@H](c1ccccc1)C(F)F)c1cc2sccc2c([O-])c1 ZINC000817223866 1048909909 /nfs/dbraw/zinc/90/99/09/1048909909.db2.gz CXORJPDUAKLLCP-HNNXBMFYSA-N -1 3 333.359 4.343 20 0 EIADHM Cc1cccc2sc(NC(=O)CCCc3ccc([O-])c(F)c3)nc21 ZINC001135903209 1048953035 /nfs/dbraw/zinc/95/30/35/1048953035.db2.gz NEMXDXHMGRALAM-UHFFFAOYSA-N -1 3 344.411 4.411 20 0 EIADHM C[C@@H]1CCc2nc(NC(=O)c3cc([O-])c4ccccc4c3)sc2C1 ZINC001135903327 1048953818 /nfs/dbraw/zinc/95/38/18/1048953818.db2.gz QZAUUCUWLUOXBX-LLVKDONJSA-N -1 3 338.432 4.379 20 0 EIADHM O=C(CCCC(=O)c1ccc(Cl)c(Cl)c1)[N-]OCCC1CC1 ZINC000817421016 1048967673 /nfs/dbraw/zinc/96/76/73/1048967673.db2.gz KGYQBTRQUZEBHD-UHFFFAOYSA-N -1 3 344.238 4.194 20 0 EIADHM CSc1ccc([O-])c(C(=O)NCCCO[C@@H](C)c2ccccc2)c1 ZINC001135954398 1049019977 /nfs/dbraw/zinc/01/99/77/1049019977.db2.gz SRPHPIOKNBRQBN-AWEZNQCLSA-N -1 3 345.464 4.012 20 0 EIADHM CCOc1c(OC)cc(C/N=C/c2cc(Cl)ccc2[O-])cc1OC ZINC000064367159 1049076994 /nfs/dbraw/zinc/07/69/94/1049076994.db2.gz HWXIKABCQVWDBW-RGVLZGJSSA-N -1 3 349.814 4.081 20 0 EIADHM COc1ccc2cc(NC(=O)c3cc([O-])ccc3Cl)ccc2c1 ZINC000811524700 1049106896 /nfs/dbraw/zinc/10/68/96/1049106896.db2.gz NIXOZARGFIYEAV-UHFFFAOYSA-N -1 3 327.767 4.460 20 0 EIADHM COc1ccc(C(=O)N2CCCCC[C@H]2c2cccc(C)c2)c([O-])c1 ZINC001147371918 1049136712 /nfs/dbraw/zinc/13/67/12/1049136712.db2.gz ALRQKBDGMFEUDU-IBGZPJMESA-N -1 3 339.435 4.467 20 0 EIADHM Cc1cc(CN2CCC(c3ccc(Cl)cc3)CC2)oc1C(=O)[O-] ZINC000564336598 1049213910 /nfs/dbraw/zinc/21/39/10/1049213910.db2.gz ARYYFHQRYQDAQZ-UHFFFAOYSA-N -1 3 333.815 4.319 20 0 EIADHM Cc1ccc(C(=O)Nc2c[nH]c3ccc(Br)cc23)c([O-])c1 ZINC001148492858 1049326199 /nfs/dbraw/zinc/32/61/99/1049326199.db2.gz WPHRXWDCWPJZNG-UHFFFAOYSA-N -1 3 345.196 4.197 20 0 EIADHM CCO[C@@H]1C[C@H](NC(=O)c2cc3sccc3c([O-])c2)C12CCCC2 ZINC001148552719 1049330899 /nfs/dbraw/zinc/33/08/99/1049330899.db2.gz DOMOOGDKDGSAPZ-DLBZAZTESA-N -1 3 345.464 4.075 20 0 EIADHM Cc1c(F)c(C)c(F)c(C(=O)Nc2cc([O-])cc(Cl)c2)c1F ZINC001148759719 1049374507 /nfs/dbraw/zinc/37/45/07/1049374507.db2.gz ALLUUMTVBHDQBG-UHFFFAOYSA-N -1 3 329.705 4.332 20 0 EIADHM CC(C)OCc1ccccc1CNC(=O)c1ccc(C(C)C)cc1[O-] ZINC001136440094 1049623272 /nfs/dbraw/zinc/62/32/72/1049623272.db2.gz ZTWMZDJZLDEBNT-UHFFFAOYSA-N -1 3 341.451 4.371 20 0 EIADHM Cc1cc(C(=O)Nc2c([O-])cccc2Cl)c(C)n1C1CCOCC1 ZINC000615322706 1049636109 /nfs/dbraw/zinc/63/61/09/1049636109.db2.gz VGBOXRJFZVXCRJ-UHFFFAOYSA-N -1 3 348.830 4.068 20 0 EIADHM CCc1ccc([O-])c(C(=O)Nc2nc3cc(F)c(F)cc3s2)c1 ZINC001136569248 1049748407 /nfs/dbraw/zinc/74/84/07/1049748407.db2.gz KXKWESJQIRORNX-UHFFFAOYSA-N -1 3 334.347 4.095 20 0 EIADHM C[C@H](NCc1ccc([O-])c(F)c1)c1noc(-c2ccc(Cl)cc2)n1 ZINC000813338396 1049756018 /nfs/dbraw/zinc/75/60/18/1049756018.db2.gz GQRMHDDGPOARPH-JTQLQIEISA-N -1 3 347.777 4.086 20 0 EIADHM CC[C@H](NCc1cc(=O)oc2cc([O-])ccc12)c1cc(F)ccc1F ZINC000179787566 1049759444 /nfs/dbraw/zinc/75/94/44/1049759444.db2.gz BDLVRUPNKCLCHA-KRWDZBQOSA-N -1 3 345.345 4.018 20 0 EIADHM CCCC[C@](C)(F)C(=O)Nc1cccc(-c2nc(CC)cc(=O)[n-]2)c1 ZINC000822405787 1049759441 /nfs/dbraw/zinc/75/94/41/1049759441.db2.gz YIEBKHICBONTDT-IBGZPJMESA-N -1 3 345.418 4.269 20 0 EIADHM CSc1ccc([O-])c(C(=O)NCC2(Sc3ccccc3)CC2)c1 ZINC001136637427 1049803963 /nfs/dbraw/zinc/80/39/63/1049803963.db2.gz NWGGKHKPKGCENB-UHFFFAOYSA-N -1 3 345.489 4.169 20 0 EIADHM Cc1cc(C)cc([C@H](C)NC(=O)c2cc([O-])cc(Br)c2)c1 ZINC001136696542 1049833567 /nfs/dbraw/zinc/83/35/67/1049833567.db2.gz OYGZWLUGESKRDI-LBPRGKRZSA-N -1 3 348.240 4.263 20 0 EIADHM Cc1ccc(C(=O)N2CCC(c3cc4ccccc4[nH]3)CC2)c([O-])c1 ZINC000068466627 1049852212 /nfs/dbraw/zinc/85/22/12/1049852212.db2.gz ISEJNYOKTNBXRW-UHFFFAOYSA-N -1 3 334.419 4.202 20 0 EIADHM COc1ccc(C(=O)N[C@H](c2ccccc2Cl)C(C)C)c([O-])c1 ZINC001136785063 1049880342 /nfs/dbraw/zinc/88/03/42/1049880342.db2.gz NMFWEKJYUOWREO-KRWDZBQOSA-N -1 3 333.815 4.181 20 0 EIADHM CC(C)(CCCc1ccccc1)CNC(=O)Cc1ccc([O-])c(F)c1 ZINC001136815362 1049895899 /nfs/dbraw/zinc/89/58/99/1049895899.db2.gz MFUZARVTALGIDQ-UHFFFAOYSA-N -1 3 343.442 4.239 20 0 EIADHM CCOCc1nc(C)c(C(=O)[N-]c2cccc(F)c2SC)s1 ZINC000617274960 1049973538 /nfs/dbraw/zinc/97/35/38/1049973538.db2.gz OIYUKOLBLROERY-UHFFFAOYSA-N -1 3 340.445 4.101 20 0 EIADHM CCCOc1ccccc1[N-]S(=O)(=O)C1=Cc2ccccc2CC1 ZINC000069446825 1050108193 /nfs/dbraw/zinc/10/81/93/1050108193.db2.gz JBXCCKBIBWEPSU-UHFFFAOYSA-N -1 3 343.448 4.204 20 0 EIADHM [O-]C(=CC(F)(F)F)Nc1cc(-c2ccccc2)nc2ccccc21 ZINC000617960428 1050144618 /nfs/dbraw/zinc/14/46/18/1050144618.db2.gz GVZBVAKPTHESLS-UHFFFAOYSA-N -1 3 330.309 4.215 20 0 EIADHM CCn1c2ccc(C(=O)[O-])cc2nc1CN(C)C1CCC(C)(C)CC1 ZINC000572533184 1050147858 /nfs/dbraw/zinc/14/78/58/1050147858.db2.gz WMSGSBAZNXOUOO-UHFFFAOYSA-N -1 3 343.471 4.155 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N1CCSC2(CCC2)CC1 ZINC000412460650 1050193340 /nfs/dbraw/zinc/19/33/40/1050193340.db2.gz HSOVZWTVCLRPOZ-UHFFFAOYSA-N -1 3 327.449 4.047 20 0 EIADHM [O-]c1cncc(-c2nc(-c3cc(Cl)cc(C(F)(F)F)c3)no2)c1 ZINC001212708923 1050330299 /nfs/dbraw/zinc/33/02/99/1050330299.db2.gz XEBIJHHURAWOBX-UHFFFAOYSA-N -1 3 341.676 4.176 20 0 EIADHM COCc1cc(C)c(-c2cc(C(F)(F)F)[n-]c(=S)n2)c(C)c1 ZINC001206311236 1050331311 /nfs/dbraw/zinc/33/13/11/1050331311.db2.gz IPSMPDANXHTCDW-UHFFFAOYSA-N -1 3 328.359 4.214 20 0 EIADHM CCc1cc(C(=O)OC)ccc1NC(=O)c1cc([O-])c2ccccc2c1 ZINC001178212293 1050405536 /nfs/dbraw/zinc/40/55/36/1050405536.db2.gz HQJCJUAZSBYEEE-UHFFFAOYSA-N -1 3 349.386 4.147 20 0 EIADHM O=C(NCc1ccc(C(F)(F)F)cc1)Nc1c([O-])cccc1Cl ZINC001186816156 1050424901 /nfs/dbraw/zinc/42/49/01/1050424901.db2.gz STACGPBFZOAHFX-UHFFFAOYSA-N -1 3 344.720 4.386 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1cccc(Nc2nccs2)c1 ZINC000075306817 1050533695 /nfs/dbraw/zinc/53/36/95/1050533695.db2.gz BOLIVIXLWPHSAJ-UHFFFAOYSA-N -1 3 345.811 4.498 20 0 EIADHM COc1ccc(Cl)cc1NC(=O)Nc1c([O-])cccc1Cl ZINC001187928795 1050652535 /nfs/dbraw/zinc/65/25/35/1050652535.db2.gz XGSOKGCRUGBMMR-UHFFFAOYSA-N -1 3 327.167 4.352 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)N[C@@H]1C[C@H]1c1ccccc1Cl ZINC000619161730 1050669623 /nfs/dbraw/zinc/66/96/23/1050669623.db2.gz VKXVCSVSHURVAO-WMLDXEAASA-N -1 3 347.817 4.180 20 0 EIADHM O=c1[n-]nc(SCCC2=CCCCC2)n1CCc1ccccc1 ZINC001188155224 1050723826 /nfs/dbraw/zinc/72/38/26/1050723826.db2.gz QYVRYHXGKXTEPG-UHFFFAOYSA-N -1 3 329.469 4.209 20 0 EIADHM O=C(c1ccc(Nc2cc([O-])c(F)cc2F)cc1)N1CCCCC1 ZINC001174072397 1050745144 /nfs/dbraw/zinc/74/51/44/1050745144.db2.gz MXWBYJQULKYMSO-UHFFFAOYSA-N -1 3 332.350 4.040 20 0 EIADHM O=C(Nc1cc(=O)[n-]n1C1CCCC1)Nc1cccc(Cl)c1F ZINC001188381182 1050754177 /nfs/dbraw/zinc/75/41/77/1050754177.db2.gz RBLVDKJLSJCYDD-UHFFFAOYSA-N -1 3 338.770 4.140 20 0 EIADHM O=C(NCc1ccco1)c1ccc(Nc2ccc([O-])c(Cl)c2)cc1 ZINC001174156128 1050797611 /nfs/dbraw/zinc/79/76/11/1050797611.db2.gz FOOGCKQHXMSXRQ-UHFFFAOYSA-N -1 3 342.782 4.312 20 0 EIADHM O=C(NCc1ccco1)c1ccc(Nc2cccc([O-])c2Cl)cc1 ZINC001174157004 1050797641 /nfs/dbraw/zinc/79/76/41/1050797641.db2.gz GHURBKOFGUKNNP-UHFFFAOYSA-N -1 3 342.782 4.312 20 0 EIADHM O=S(=O)([N-]c1ccc(-c2ccccc2)cc1Cl)c1ccoc1 ZINC001188618150 1050806454 /nfs/dbraw/zinc/80/64/54/1050806454.db2.gz XIPHGEYYXJKNHT-UHFFFAOYSA-N -1 3 333.796 4.401 20 0 EIADHM CCCCNC(=O)c1ccc(Nc2nc3c(cccc3[O-])s2)cc1 ZINC001174121621 1050808508 /nfs/dbraw/zinc/80/85/08/1050808508.db2.gz IOFDVYQNNAUCOQ-UHFFFAOYSA-N -1 3 341.436 4.275 20 0 EIADHM Cc1cccc([O-])c1C(=O)Nc1cccc(Cn2ccnc2C(C)C)c1 ZINC001188648746 1050812582 /nfs/dbraw/zinc/81/25/82/1050812582.db2.gz MUOROELGKTVNNQ-UHFFFAOYSA-N -1 3 349.434 4.321 20 0 EIADHM Cc1cccc([O-])c1C(=O)Nc1cc2[nH]ccc2cc1Br ZINC001188655334 1050814338 /nfs/dbraw/zinc/81/43/38/1050814338.db2.gz PIFGWFMHAAESQP-UHFFFAOYSA-N -1 3 345.196 4.197 20 0 EIADHM Cc1ccc(C(=O)Nc2ccc(C)cc2OCC(F)(F)F)c([O-])c1 ZINC000619609602 1050832815 /nfs/dbraw/zinc/83/28/15/1050832815.db2.gz KREKLOKRJATVNA-UHFFFAOYSA-N -1 3 339.313 4.202 20 0 EIADHM Cc1ccc([O-])c(C(=O)Nc2nnc(-c3ccccc3Cl)s2)c1 ZINC000619607378 1050833095 /nfs/dbraw/zinc/83/30/95/1050833095.db2.gz BARAOXJUZIFCBN-UHFFFAOYSA-N -1 3 345.811 4.125 20 0 EIADHM Fc1ccc(F)c(-c2csc([N-]c3ncnc4ncccc34)n2)c1 ZINC000163105060 1050835684 /nfs/dbraw/zinc/83/56/84/1050835684.db2.gz IPJRKHSWPUUJPE-UHFFFAOYSA-N -1 3 341.346 4.170 20 0 EIADHM O=C(NC1CCCC1)c1cccc(Nc2cccc([O-])c2Cl)c1 ZINC001174200028 1050836166 /nfs/dbraw/zinc/83/61/66/1050836166.db2.gz VGKBCSUNHHZTKC-UHFFFAOYSA-N -1 3 330.815 4.462 20 0 EIADHM O=C(Nc1cc(=O)[n-]c(C2CC2)n1)Nc1cc(Cl)ccc1Cl ZINC001188966888 1050873588 /nfs/dbraw/zinc/87/35/88/1050873588.db2.gz KRJLUZHLGLOGBR-UHFFFAOYSA-N -1 3 339.182 4.010 20 0 EIADHM CC(C)(C)[C@H]1CCC[C@@H]([N-]S(=O)(=O)c2cccnc2Cl)CC1 ZINC001189288355 1050946443 /nfs/dbraw/zinc/94/64/43/1050946443.db2.gz IODGUOONOFGXHP-QWHCGFSZSA-N -1 3 344.908 4.008 20 0 EIADHM CN(Cc1ccc(OC(F)(F)F)cc1)Cc1c(F)ccc([O-])c1F ZINC001180393583 1050981069 /nfs/dbraw/zinc/98/10/69/1050981069.db2.gz OOZQMNADRMODMM-UHFFFAOYSA-N -1 3 347.283 4.201 20 0 EIADHM Cc1cccc2cccc([N-]S(=O)(=O)Cc3cccc(F)c3F)c12 ZINC001189469169 1050989936 /nfs/dbraw/zinc/98/99/36/1050989936.db2.gz AQVSXESHYURWDO-UHFFFAOYSA-N -1 3 347.386 4.368 20 0 EIADHM O=S(=O)(Cc1cc(F)ccc1F)[N-]c1cc2cccccc-2c1 ZINC001189651843 1051035002 /nfs/dbraw/zinc/03/50/02/1051035002.db2.gz YXFTZRXQGQXKPW-UHFFFAOYSA-N -1 3 333.359 4.012 20 0 EIADHM Cc1cc([N-]S(=O)(=O)Cc2cc(F)ccc2F)c(F)cc1Cl ZINC001189697188 1051039710 /nfs/dbraw/zinc/03/97/10/1051039710.db2.gz MXIXGTNRPHSFOE-UHFFFAOYSA-N -1 3 349.761 4.008 20 0 EIADHM Cc1ccc(CSc2nc(NC(=O)[C@@H](C)CC(C)C)n[n-]2)cc1 ZINC001180843183 1051087869 /nfs/dbraw/zinc/08/78/69/1051087869.db2.gz MAWAMHIGEQLFQP-ZDUSSCGKSA-N -1 3 332.473 4.026 20 0 EIADHM COc1ccc(C(F)(F)F)cc1C(=O)Nc1cc([O-])cc(Cl)c1 ZINC001190056818 1051108549 /nfs/dbraw/zinc/10/85/49/1051108549.db2.gz XHOABRZQIXUGND-UHFFFAOYSA-N -1 3 345.704 4.325 20 0 EIADHM Cc1ccc(C)c(OCCCC(C)(C)C(=O)Nc2cncc([O-])c2)c1 ZINC001180929555 1051111176 /nfs/dbraw/zinc/11/11/76/1051111176.db2.gz LVEJFMUREMNGHE-UHFFFAOYSA-N -1 3 342.439 4.228 20 0 EIADHM O=C(NCc1ccc(Cl)cc1Cl)Nc1ccc([O-])c(F)c1 ZINC001190093493 1051112487 /nfs/dbraw/zinc/11/24/87/1051112487.db2.gz QWACTTPDWXBXPD-UHFFFAOYSA-N -1 3 329.158 4.160 20 0 EIADHM O=C([N-]c1cc(-c2cccs2)no1)Nc1cccc2nsnc21 ZINC001190279035 1051144054 /nfs/dbraw/zinc/14/40/54/1051144054.db2.gz FQNBTHAMTJESKU-UHFFFAOYSA-N -1 3 343.393 4.052 20 0 EIADHM O=C(Nc1cccc2nsnc21)Nc1cc2ccccc2cc1[O-] ZINC001190304033 1051145755 /nfs/dbraw/zinc/14/57/55/1051145755.db2.gz WMHQMFPNPBDHPQ-UHFFFAOYSA-N -1 3 336.376 4.194 20 0 EIADHM CCC(CC)(C(=O)Nc1c([O-])cccc1C(C)=O)c1ccccc1 ZINC001181155164 1051169620 /nfs/dbraw/zinc/16/96/20/1051169620.db2.gz CORSNEVYZWNFGS-UHFFFAOYSA-N -1 3 325.408 4.291 20 0 EIADHM CN1CCN(c2ccc(Nc3ccc(Cl)cc3[S-])cc2)CC1 ZINC001174814650 1051183874 /nfs/dbraw/zinc/18/38/74/1051183874.db2.gz QXHKXHLTSINKQR-UHFFFAOYSA-N -1 3 333.888 4.124 20 0 EIADHM CCC[C@@H]([N-]S(=O)(=O)c1cc(Cl)ccc1Cl)C(C)(C)C ZINC001190437184 1051185121 /nfs/dbraw/zinc/18/51/21/1051185121.db2.gz DHNBYKBDOFSXES-CYBMUJFWSA-N -1 3 338.300 4.487 20 0 EIADHM CC(=O)[C@H](C)CCCCC(=O)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000153705469 1051217213 /nfs/dbraw/zinc/21/72/13/1051217213.db2.gz CDVPXTNFHDEQNQ-SNVBAGLBSA-N -1 3 331.334 4.135 20 0 EIADHM COC(=O)c1ccc2cc(Nc3c(F)cc([O-])cc3F)ccc2c1 ZINC001175099360 1051344795 /nfs/dbraw/zinc/34/47/95/1051344795.db2.gz CBVVIFUZGPGKBU-UHFFFAOYSA-N -1 3 329.302 4.354 20 0 EIADHM COc1cc(Br)c(F)cc1Nc1c(F)cc([O-])cc1F ZINC001175100378 1051347246 /nfs/dbraw/zinc/34/72/46/1051347246.db2.gz ZTLDSXCHIWBODI-UHFFFAOYSA-N -1 3 348.118 4.324 20 0 EIADHM [O-]c1cc(F)c(Nc2cccc([C@H]3CN4C=CSC4=N3)c2)c(F)c1 ZINC001175100168 1051347504 /nfs/dbraw/zinc/34/75/04/1051347504.db2.gz XNANMEZAPFXBLS-OAHLLOKOSA-N -1 3 345.374 4.345 20 0 EIADHM CC(=O)c1cc(Br)ccc1Nc1c(F)cc([O-])cc1F ZINC001175100216 1051347544 /nfs/dbraw/zinc/34/75/44/1051347544.db2.gz NVWZRMVQGBMROG-UHFFFAOYSA-N -1 3 342.139 4.379 20 0 EIADHM COc1cc(C)c(Nc2c(F)cc([O-])cc2F)cc1Br ZINC001175102938 1051349232 /nfs/dbraw/zinc/34/92/32/1051349232.db2.gz PNRUTUNTYRGIGU-UHFFFAOYSA-N -1 3 344.155 4.494 20 0 EIADHM [O-]c1cc(F)c(Nc2cccc(F)c2OC[C@H]2CCCO2)c(F)c1 ZINC001175102109 1051349494 /nfs/dbraw/zinc/34/94/94/1051349494.db2.gz FBOUGPRMNQPSED-LLVKDONJSA-N -1 3 339.313 4.111 20 0 EIADHM [O-]c1cc(F)c(Nc2c(F)cccc2OC[C@H]2CCCO2)c(F)c1 ZINC001175102546 1051350589 /nfs/dbraw/zinc/35/05/89/1051350589.db2.gz OFESQVCLJUTHOK-LLVKDONJSA-N -1 3 339.313 4.111 20 0 EIADHM COc1c(F)cc(Br)cc1Nc1c(F)cc([O-])cc1F ZINC001175103784 1051351495 /nfs/dbraw/zinc/35/14/95/1051351495.db2.gz YWLKTLRFYVKPCK-UHFFFAOYSA-N -1 3 348.118 4.324 20 0 EIADHM Cc1cccc(Nc2c(F)cc([O-])cc2F)c1N1CCCCC1=O ZINC001175103033 1051352038 /nfs/dbraw/zinc/35/20/38/1051352038.db2.gz RMHGIHMKVXJCTM-UHFFFAOYSA-N -1 3 332.350 4.239 20 0 EIADHM CCOc1cccc(Nc2cc(Br)cc(F)c2[O-])c1 ZINC001175094097 1051378944 /nfs/dbraw/zinc/37/89/44/1051378944.db2.gz RPBABFNFSLHLPO-UHFFFAOYSA-N -1 3 326.165 4.436 20 0 EIADHM CC(=O)c1ccc(Br)cc1Nc1c(F)cc([O-])cc1F ZINC001175097131 1051380495 /nfs/dbraw/zinc/38/04/95/1051380495.db2.gz QDGHRNXYKMXZTL-UHFFFAOYSA-N -1 3 342.139 4.379 20 0 EIADHM CCCCc1ccc(S(=O)(=O)[N-]c2cc(C)cnc2Cl)cc1 ZINC001191224639 1051401764 /nfs/dbraw/zinc/40/17/64/1051401764.db2.gz KKVQPAFDIKOHMD-UHFFFAOYSA-N -1 3 338.860 4.187 20 0 EIADHM COc1cccc(C(=O)Nc2ccccc2CCC(F)(F)F)c1[O-] ZINC000155331706 1051407811 /nfs/dbraw/zinc/40/78/11/1051407811.db2.gz XWNCOMYGAWSMJM-UHFFFAOYSA-N -1 3 339.313 4.148 20 0 EIADHM CCCCc1ccc(S(=O)(=O)[N-]c2cc(F)c(F)cc2F)cc1 ZINC001191248768 1051411314 /nfs/dbraw/zinc/41/13/14/1051411314.db2.gz IDVVJQXMAMFFBR-UHFFFAOYSA-N -1 3 343.370 4.247 20 0 EIADHM C[C@@H](Oc1ccccc1NCc1ccc([O-])c(F)c1)C(F)(F)F ZINC001182196378 1051423535 /nfs/dbraw/zinc/42/35/35/1051423535.db2.gz PHGRAWRTJUHIDQ-SNVBAGLBSA-N -1 3 329.293 4.473 20 0 EIADHM CCNc1ccc(C(=O)OCC)cc1Nc1c(F)ccc([O-])c1F ZINC001175268984 1051502453 /nfs/dbraw/zinc/50/24/53/1051502453.db2.gz UUCWDKVJOSZPIS-UHFFFAOYSA-N -1 3 336.338 4.023 20 0 EIADHM Cc1ccc(Cl)c(NC(=O)[N-]c2cc(-c3ccccn3)no2)c1 ZINC001191672434 1051503403 /nfs/dbraw/zinc/50/34/03/1051503403.db2.gz CQHHOFWLAONFDX-UHFFFAOYSA-N -1 3 328.759 4.342 20 0 EIADHM COC(=O)c1cc(Nc2c(F)ccc([O-])c2F)cc(C(F)(F)F)c1 ZINC001175268800 1051503615 /nfs/dbraw/zinc/50/36/15/1051503615.db2.gz WSPRXIXMGCDHPL-UHFFFAOYSA-N -1 3 347.239 4.219 20 0 EIADHM [O-]c1ccc(F)c(Nc2cccc(F)c2OC[C@@H]2CCCO2)c1F ZINC001175270580 1051505560 /nfs/dbraw/zinc/50/55/60/1051505560.db2.gz FMCMAIMAYBHZIU-JTQLQIEISA-N -1 3 339.313 4.111 20 0 EIADHM COc1ccc(C(F)(F)F)c(C(=O)Nc2cc([O-])cc(Cl)c2)c1 ZINC001191812172 1051541441 /nfs/dbraw/zinc/54/14/41/1051541441.db2.gz ATBJVDARICBNQJ-UHFFFAOYSA-N -1 3 345.704 4.325 20 0 EIADHM CCOc1ccc(C)cc1S(=O)(=O)[N-]c1cc(C)ccc1Cl ZINC001191820976 1051560909 /nfs/dbraw/zinc/56/09/09/1051560909.db2.gz AYIKMNWVSYTQEQ-UHFFFAOYSA-N -1 3 339.844 4.156 20 0 EIADHM Cc1c2c[nH]nc2ccc1Nc1cc(Br)cc(F)c1[O-] ZINC001175467369 1051600844 /nfs/dbraw/zinc/60/08/44/1051600844.db2.gz QLVRFHPMUOPSCP-UHFFFAOYSA-N -1 3 336.164 4.222 20 0 EIADHM CC(=O)c1cccc([O-])c1NC(=O)c1ccc(Oc2ccccc2)nc1 ZINC001192081827 1051622435 /nfs/dbraw/zinc/62/24/35/1051622435.db2.gz VNHXTKJAZKQAFZ-UHFFFAOYSA-N -1 3 348.358 4.034 20 0 EIADHM O=C(NCc1ncccc1[O-])Nc1c(Cl)cc(Cl)cc1Cl ZINC001192052290 1051624778 /nfs/dbraw/zinc/62/47/78/1051624778.db2.gz NTSKXFLCQZYWTO-UHFFFAOYSA-N -1 3 346.601 4.069 20 0 EIADHM O=C([N-]c1cc(-c2ccco2)no1)Nc1ccc(OC(F)F)cc1 ZINC001192147738 1051639721 /nfs/dbraw/zinc/63/97/21/1051639721.db2.gz AWHUWBFKAIASOW-UHFFFAOYSA-N -1 3 335.266 4.180 20 0 EIADHM CN(CCC(=O)c1ccccc1)C(=O)c1ccc(C(C)(C)C)cc1[O-] ZINC001192322484 1051689032 /nfs/dbraw/zinc/68/90/32/1051689032.db2.gz ANZIFCNGNIJGSO-UHFFFAOYSA-N -1 3 339.435 4.035 20 0 EIADHM CC(=O)c1cccc([O-])c1NC(=O)Nc1ccc2sccc2c1 ZINC001192454860 1051739740 /nfs/dbraw/zinc/73/97/40/1051739740.db2.gz JVZITYIFQXUFTG-UHFFFAOYSA-N -1 3 326.377 4.454 20 0 EIADHM Cc1ccc(CC2CN(Cc3cccc([O-])c3Br)C2)cc1 ZINC001182929911 1051755008 /nfs/dbraw/zinc/75/50/08/1051755008.db2.gz OPPQRQZASSEPSV-UHFFFAOYSA-N -1 3 346.268 4.138 20 0 EIADHM CC(C)(C(=O)Nc1ccc(F)c([O-])c1)c1ccc(C(=O)C2CC2)cc1 ZINC001183030711 1051765451 /nfs/dbraw/zinc/76/54/51/1051765451.db2.gz NTYBNYFPLDOTAT-UHFFFAOYSA-N -1 3 341.382 4.040 20 0 EIADHM Cc1ccc(C)c(S(=O)(=O)[N-]c2c(F)cccc2NC(C)C)c1 ZINC000158868496 1051796130 /nfs/dbraw/zinc/79/61/30/1051796130.db2.gz NQXTWERXZJPUEQ-UHFFFAOYSA-N -1 3 336.432 4.064 20 0 EIADHM CCc1ccc(OC)c(S(=O)(=O)[N-]c2c(C)cccc2Cl)c1 ZINC001192756505 1051811344 /nfs/dbraw/zinc/81/13/44/1051811344.db2.gz UITZHKIWTADYKZ-UHFFFAOYSA-N -1 3 339.844 4.020 20 0 EIADHM [O-]c1c(Nc2ccc3nn[nH]c3c2)cc(Cl)c(Cl)c1Cl ZINC001176003050 1051868775 /nfs/dbraw/zinc/86/87/75/1051868775.db2.gz AXDIOPPCLGKUST-UHFFFAOYSA-N -1 3 329.574 4.367 20 0 EIADHM [O-]c1c(Nc2ccc3n[nH]nc3c2)cc(Cl)c(Cl)c1Cl ZINC001176003050 1051868778 /nfs/dbraw/zinc/86/87/78/1051868778.db2.gz AXDIOPPCLGKUST-UHFFFAOYSA-N -1 3 329.574 4.367 20 0 EIADHM CC[C@H](C)Sc1ccc(NC([O-])=NO[C@@H]2CCCCO2)c(C)c1 ZINC000775581694 1051890730 /nfs/dbraw/zinc/89/07/30/1051890730.db2.gz INJUTYGRWDRXMS-XJKSGUPXSA-N -1 3 338.473 4.465 20 0 EIADHM CC[C@H](C)Sc1ccc(NC(=O)[N-]O[C@@H]2CCCCO2)c(C)c1 ZINC000775581694 1051890733 /nfs/dbraw/zinc/89/07/33/1051890733.db2.gz INJUTYGRWDRXMS-XJKSGUPXSA-N -1 3 338.473 4.465 20 0 EIADHM CC(C)(C)OC(=O)c1ccc(NC(=O)C2CCC3(CC3)CC2)c([O-])c1 ZINC001183882764 1051912552 /nfs/dbraw/zinc/91/25/52/1051912552.db2.gz TVRWLVPRUQUWNP-UHFFFAOYSA-N -1 3 345.439 4.256 20 0 EIADHM O=C(Nc1cc(C2CCCC2)no1)c1ccc([O-])cc1C(F)(F)F ZINC001193734514 1051978737 /nfs/dbraw/zinc/97/87/37/1051978737.db2.gz VCCGYIGACBOVFE-UHFFFAOYSA-N -1 3 340.301 4.309 20 0 EIADHM CCC[C@H](NC(=O)c1cc([O-])cc(C(F)(F)F)c1)c1ccccn1 ZINC000621856252 1051981004 /nfs/dbraw/zinc/98/10/04/1051981004.db2.gz LPFNPEKTXOUFHI-HNNXBMFYSA-N -1 3 338.329 4.077 20 0 EIADHM O=C(Nc1cncc([O-])c1)c1cc(-c2ccccc2)oc1C(F)(F)F ZINC001193787546 1051989592 /nfs/dbraw/zinc/98/95/92/1051989592.db2.gz LXEQGYSEWCJKBJ-UHFFFAOYSA-N -1 3 348.280 4.318 20 0 EIADHM O=C(Nc1cc(O)cc(Cl)c1)c1ccc([O-])cc1C(F)(F)F ZINC001193746360 1051992722 /nfs/dbraw/zinc/99/27/22/1051992722.db2.gz ACOPZOJZWDSBBF-UHFFFAOYSA-N -1 3 331.677 4.022 20 0 EIADHM CC(C)[C@H](CC(F)(F)F)NC(=O)c1cc([O-])cc(C(F)(F)F)c1 ZINC000621966827 1052042338 /nfs/dbraw/zinc/04/23/38/1052042338.db2.gz NENBOILYNMXIMR-NSHDSACASA-N -1 3 343.267 4.118 20 0 EIADHM Cc1oc(CN(C)CCCCc2cccc(Cl)c2)cc1C(=O)[O-] ZINC000622001730 1052070100 /nfs/dbraw/zinc/07/01/00/1052070100.db2.gz GKGVKWMPOIRGOV-UHFFFAOYSA-N -1 3 335.831 4.394 20 0 EIADHM O=S(=O)(Cc1cc(F)cc(F)c1)[N-]c1csc2ccccc12 ZINC001185088389 1052164896 /nfs/dbraw/zinc/16/48/96/1052164896.db2.gz PMXKLCQCINUPCK-UHFFFAOYSA-N -1 3 339.388 4.121 20 0 EIADHM O=C(Nc1nc2c(cccc2[O-])s1)Nc1ccc(F)c(F)c1F ZINC001185285133 1052211021 /nfs/dbraw/zinc/21/10/21/1052211021.db2.gz ILQQVBBETVGBRV-UHFFFAOYSA-N -1 3 339.298 4.063 20 0 EIADHM Cc1ccc(C(=O)Nc2ccc(F)cc2OCC(F)F)c([O-])c1C ZINC000622483863 1052298080 /nfs/dbraw/zinc/29/80/80/1052298080.db2.gz POYOHCHPSWRJEQ-UHFFFAOYSA-N -1 3 339.313 4.044 20 0 EIADHM O=C(NC1CC(C(F)(F)F)C1)c1cc(Cc2ccccc2)ccc1[O-] ZINC000622601486 1052344292 /nfs/dbraw/zinc/34/42/92/1052344292.db2.gz FSRZSPYEAFKTNH-UHFFFAOYSA-N -1 3 349.352 4.054 20 0 EIADHM CCc1ccc(C(=O)N2CCC[C@H]2c2ccc(F)cc2C)c([O-])c1 ZINC000622667694 1052381436 /nfs/dbraw/zinc/38/14/36/1052381436.db2.gz PFNDXXSXCJZJOW-SFHVURJKSA-N -1 3 327.399 4.379 20 0 EIADHM COc1cccc([C@@H](C)OC(=O)CCCc2ccc([O-])c(F)c2)c1 ZINC000784892296 1052490139 /nfs/dbraw/zinc/49/01/39/1052490139.db2.gz DTLARODFAPPICJ-CYBMUJFWSA-N -1 3 332.371 4.167 20 0 EIADHM CN(C)Cc1c2ccccc2oc1C(=O)Nc1cccc(Cl)c1[O-] ZINC000173473902 1052546817 /nfs/dbraw/zinc/54/68/17/1052546817.db2.gz NJUACUYNAUYQIF-UHFFFAOYSA-N -1 3 344.798 4.106 20 0 EIADHM CCc1ccsc1C(=O)Nc1cc(Br)ccc1[O-] ZINC000176431636 1052622881 /nfs/dbraw/zinc/62/28/81/1052622881.db2.gz LCRFSQBYKNESSI-UHFFFAOYSA-N -1 3 326.215 4.031 20 0 EIADHM CC(C)(NCc1cc([N+](=O)[O-])ccc1[O-])c1cccc(Cl)c1F ZINC000185847148 1052800314 /nfs/dbraw/zinc/80/03/14/1052800314.db2.gz MUZCMMXYQLOWPX-UHFFFAOYSA-N -1 3 338.766 4.118 20 0 EIADHM Cc1sc2[n-]c([C@@H](C)OC(=O)[C@H]3CCC3(C)C)nc(=O)c2c1C ZINC000850070679 1053066898 /nfs/dbraw/zinc/06/68/98/1053066898.db2.gz ULQFRVMPGDXJMB-MWLCHTKSSA-N -1 3 334.441 4.054 20 0 EIADHM COc1ccccc1C[C@@H](C)N(C)Cc1cccc(C(=O)[O-])c1Cl ZINC000381474692 1053077515 /nfs/dbraw/zinc/07/75/15/1053077515.db2.gz CZEHDMWMPASDFM-CYBMUJFWSA-N -1 3 347.842 4.110 20 0 EIADHM Cc1oc(CN2CCC(Cc3ccccc3Cl)CC2)cc1C(=O)[O-] ZINC000864361844 1053250829 /nfs/dbraw/zinc/25/08/29/1053250829.db2.gz SJVRCTXNRGEQRU-UHFFFAOYSA-N -1 3 347.842 4.394 20 0 EIADHM CCc1ccccc1[C@H](CC(=O)[O-])NCc1cnc(C2CCC2)s1 ZINC000864529453 1053307035 /nfs/dbraw/zinc/30/70/35/1053307035.db2.gz XLIMOYZOLSOWAR-KRWDZBQOSA-N -1 3 344.480 4.279 20 0 EIADHM O=C(CCC1CCCCC1)[N-]OCc1nc(Cl)ccc1Cl ZINC000764937709 1053387575 /nfs/dbraw/zinc/38/75/75/1053387575.db2.gz VEIMTWGOSJTAKD-UHFFFAOYSA-N -1 3 331.243 4.297 20 0 EIADHM Cc1nonc1[N-]C(=O)c1ccc(-c2ccc(Cl)c(Cl)c2)o1 ZINC001195405442 1053391568 /nfs/dbraw/zinc/39/15/68/1053391568.db2.gz RAAZAZHBGOFJHZ-UHFFFAOYSA-N -1 3 338.150 4.197 20 0 EIADHM Cc1nonc1[N-]C(=O)c1ccc(-c2ccc(Cl)cc2Cl)o1 ZINC001195389266 1053395774 /nfs/dbraw/zinc/39/57/74/1053395774.db2.gz MZSQJRNLXKETOX-UHFFFAOYSA-N -1 3 338.150 4.197 20 0 EIADHM CC(C)Sc1ccc(Cl)cc1[N-]C(=O)c1csc(CO)n1 ZINC000865174292 1053436576 /nfs/dbraw/zinc/43/65/76/1053436576.db2.gz VDHQUICZOHYDKU-UHFFFAOYSA-N -1 3 342.873 4.042 20 0 EIADHM CC(C)(C(=O)[O-])[C@@H]1CCCN(Cc2cc(F)cc(C(F)(F)F)c2)C1 ZINC000325412930 1053437065 /nfs/dbraw/zinc/43/70/65/1053437065.db2.gz FGPXYJYVWGCKIY-GFCCVEGCSA-N -1 3 347.352 4.167 20 0 EIADHM Nc1c(Cl)cc(C(=O)Nc2ccc(Cl)cc2[O-])cc1Cl ZINC000765179632 1053459690 /nfs/dbraw/zinc/45/96/90/1053459690.db2.gz WSRKXWOBYQDCQS-UHFFFAOYSA-N -1 3 331.586 4.187 20 0 EIADHM [O-]c1ccc(NC(=S)NCc2cccc(Cl)c2)cc1Cl ZINC001195979855 1053538732 /nfs/dbraw/zinc/53/87/32/1053538732.db2.gz OSZLTRQOLROBJW-UHFFFAOYSA-N -1 3 327.236 4.186 20 0 EIADHM Cc1ccc(NC(=S)NCc2cccc(Cl)c2)c(Cl)c1[O-] ZINC001195981497 1053538798 /nfs/dbraw/zinc/53/87/98/1053538798.db2.gz DDWXPGCRHOBINS-UHFFFAOYSA-N -1 3 341.263 4.494 20 0 EIADHM [O-]c1cccc(F)c1NC(=S)Nc1ccc(C(F)(F)F)cc1 ZINC001196188642 1053598277 /nfs/dbraw/zinc/59/82/77/1053598277.db2.gz YLLVEDLPAGAVOC-UHFFFAOYSA-N -1 3 330.306 4.359 20 0 EIADHM COc1ccccc1NC(=S)Nc1c([O-])cccc1C(F)(F)F ZINC001196256835 1053621099 /nfs/dbraw/zinc/62/10/99/1053621099.db2.gz OIEPKLRLHJAYBJ-UHFFFAOYSA-N -1 3 342.342 4.229 20 0 EIADHM Cc1ccccc1OCCN(C)C(=O)c1cc([O-])c2ccccc2c1 ZINC000471642238 1053676618 /nfs/dbraw/zinc/67/66/18/1053676618.db2.gz KPYAHWOWQDABNJ-UHFFFAOYSA-N -1 3 335.403 4.005 20 0 EIADHM COc1cc(C)c(S(=O)(=O)[N-]c2cc(C)c(C)cc2C)c(C)c1 ZINC001196887637 1053788180 /nfs/dbraw/zinc/78/81/80/1053788180.db2.gz GZNIDNGBZCTNFS-UHFFFAOYSA-N -1 3 333.453 4.038 20 0 EIADHM [O-]c1cc(Br)ccc1NC(=S)Nc1ccc(F)cc1 ZINC001196940532 1053810490 /nfs/dbraw/zinc/81/04/90/1053810490.db2.gz SBJLXHZTAUUTPJ-UHFFFAOYSA-N -1 3 341.205 4.103 20 0 EIADHM O=C(c1cc2sccc2c([O-])c1)N1CCC[C@@H](c2ccccn2)C1 ZINC000854643170 1053832953 /nfs/dbraw/zinc/83/29/53/1053832953.db2.gz VFGRCNBGCSXEDL-CYBMUJFWSA-N -1 3 338.432 4.022 20 0 EIADHM O=C(c1cc2sccc2c([O-])c1)N1CCC[C@H](c2ccccn2)C1 ZINC000854643172 1053833013 /nfs/dbraw/zinc/83/30/13/1053833013.db2.gz VFGRCNBGCSXEDL-ZDUSSCGKSA-N -1 3 338.432 4.022 20 0 EIADHM Cc1cccc([O-])c1C(=O)N1CCC[C@@H](c2cc3ccccc3[nH]2)C1 ZINC000624274187 1053846243 /nfs/dbraw/zinc/84/62/43/1053846243.db2.gz UUJNQAVGLWLOTN-MRXNPFEDSA-N -1 3 334.419 4.202 20 0 EIADHM [O-]c1cnc(NC(=S)Nc2ccccc2C(F)(F)F)c(Cl)c1 ZINC001197236677 1053857538 /nfs/dbraw/zinc/85/75/38/1053857538.db2.gz BEADLHIOXRXNNM-UHFFFAOYSA-N -1 3 347.749 4.268 20 0 EIADHM CCCCn1nc(C)c(/C=C\C(=O)c2ccc([O-])c(OC)c2)c1Cl ZINC000213715544 1053866441 /nfs/dbraw/zinc/86/64/41/1053866441.db2.gz YJFWIBSQOSVTQN-CLFYSBASSA-N -1 3 348.830 4.255 20 0 EIADHM O=c1cc(NC(=S)Nc2ccc(Cl)cc2)[n-]n1-c1ccccc1 ZINC001197306013 1053870576 /nfs/dbraw/zinc/87/05/76/1053870576.db2.gz DRHFLDNMEISTBH-UHFFFAOYSA-N -1 3 344.827 4.040 20 0 EIADHM O=C(Nc1ccc2c(c1)[C@H](O)CCCC2)c1cc([O-])ccc1Cl ZINC000855545765 1053935843 /nfs/dbraw/zinc/93/58/43/1053935843.db2.gz HHMTVCGPCXYSSU-QGZVFWFLSA-N -1 3 331.799 4.058 20 0 EIADHM O=S(=O)(Cc1ccc(Cl)c(F)c1)[N-]c1csc(Cl)c1 ZINC001197646138 1053959623 /nfs/dbraw/zinc/95/96/23/1053959623.db2.gz QKCLZVYBTWTIGP-UHFFFAOYSA-N -1 3 340.228 4.136 20 0 EIADHM O=C(c1cc2sccc2c([O-])c1)N1CCC[C@@H]([C@@H]2CCCCO2)C1 ZINC000855954962 1054000558 /nfs/dbraw/zinc/00/05/58/1054000558.db2.gz NJZVZQRTYAWVDM-DYVFJYSZSA-N -1 3 345.464 4.028 20 0 EIADHM CC(C)Oc1ccc(-c2ccccc2C(=O)Nc2cncc([O-])c2)cc1 ZINC001197962954 1054039553 /nfs/dbraw/zinc/03/95/53/1054039553.db2.gz OOSBGWSIOSYKFJ-UHFFFAOYSA-N -1 3 348.402 4.494 20 0 EIADHM [O-]c1cncc(NC(=S)Nc2cc(C(F)(F)F)ccc2Cl)c1 ZINC001198201540 1054092306 /nfs/dbraw/zinc/09/23/06/1054092306.db2.gz BMYHSNOXZJCYLK-UHFFFAOYSA-N -1 3 347.749 4.268 20 0 EIADHM O=C(NCc1ccc(COCc2ccccc2)cc1)c1ccccc1[O-] ZINC000032738973 1054112550 /nfs/dbraw/zinc/11/25/50/1054112550.db2.gz ARINCPHNKRQNPF-UHFFFAOYSA-N -1 3 347.414 4.039 20 0 EIADHM Cc1cc2c(CC(=O)[N-]OCCCC(F)(F)F)csc2s1 ZINC000871209701 1054169620 /nfs/dbraw/zinc/16/96/20/1054169620.db2.gz BLBJQDHYQAYLAD-UHFFFAOYSA-N -1 3 337.388 4.204 20 0 EIADHM O=C(c1cc2sccc2c([O-])c1)N1CCC[C@@H](OC2CCC2)CC1 ZINC000871326325 1054191529 /nfs/dbraw/zinc/19/15/29/1054191529.db2.gz DKDHMFYSAROPML-OAHLLOKOSA-N -1 3 345.464 4.171 20 0 EIADHM CC(C)(C)c1ccc2c(c1)CCCN2C(=O)Cc1ccc([O-])c(F)c1 ZINC000857480882 1054268196 /nfs/dbraw/zinc/26/81/96/1054268196.db2.gz OOBPEUGWDRARPM-UHFFFAOYSA-N -1 3 341.426 4.351 20 0 EIADHM O=C(OCc1coc(-c2cccs2)n1)c1cccc(Cl)c1[O-] ZINC000775933184 1054338227 /nfs/dbraw/zinc/33/82/27/1054338227.db2.gz HUZZROFLNHOKAD-UHFFFAOYSA-N -1 3 335.768 4.119 20 0 EIADHM C[C@H](Nc1cccc(N2CCCCC2=O)c1)c1cccc([O-])c1F ZINC000872054767 1054366609 /nfs/dbraw/zinc/36/66/09/1054366609.db2.gz ATTOLPURQQHXPS-ZDUSSCGKSA-N -1 3 328.387 4.221 20 0 EIADHM C[C@@H](Nc1cccc(OC[C@H]2CCCO2)c1)c1cccc([O-])c1F ZINC000872057341 1054367956 /nfs/dbraw/zinc/36/79/56/1054367956.db2.gz XUXVCBSRQYHRJU-CZUORRHYSA-N -1 3 331.387 4.262 20 0 EIADHM C[C@H](NCc1ccccc1N1CCCCC1)c1cccc([O-])c1F ZINC000872060591 1054370569 /nfs/dbraw/zinc/37/05/69/1054370569.db2.gz RQTLLLWAWKSDME-HNNXBMFYSA-N -1 3 328.431 4.372 20 0 EIADHM C[C@H](N[C@H]1CCc2cc(F)c(F)c(F)c21)c1cccc([O-])c1F ZINC000872076713 1054380889 /nfs/dbraw/zinc/38/08/89/1054380889.db2.gz QKXURFRVAQGPTA-UFBFGSQYSA-N -1 3 325.305 4.287 20 0 EIADHM CC1(C)[C@@H](c2cccc(Cl)c2)CCN1Cc1cc(C(=O)[O-])co1 ZINC000872168012 1054421087 /nfs/dbraw/zinc/42/10/87/1054421087.db2.gz PWFVQAYMVZKMMW-MRXNPFEDSA-N -1 3 333.815 4.399 20 0 EIADHM CC(C)c1oncc1C(=O)[N-]c1cc(-c2ccc(Cl)s2)on1 ZINC001199745240 1054460222 /nfs/dbraw/zinc/46/02/22/1054460222.db2.gz YZJGQJZLZVVPQV-UHFFFAOYSA-N -1 3 337.788 4.420 20 0 EIADHM COc1cc(Cl)c(CNCc2ccc([O-])c(Cl)c2)cc1OC ZINC000873179460 1054502059 /nfs/dbraw/zinc/50/20/59/1054502059.db2.gz IZCXQMWGMFVGBB-UHFFFAOYSA-N -1 3 342.222 4.006 20 0 EIADHM [O-]c1cccc(Cl)c1NC(=S)Nc1ccc(-n2cccn2)cc1 ZINC001200883054 1054566820 /nfs/dbraw/zinc/56/68/20/1054566820.db2.gz BWGNZBCIFYABRE-UHFFFAOYSA-N -1 3 344.827 4.040 20 0 EIADHM CCc1nc(C(C)C)ccc1COC(=O)c1cccc(Cl)c1[O-] ZINC001273874722 1054612601 /nfs/dbraw/zinc/61/26/01/1054612601.db2.gz KZXAYUHKIGGGIQ-UHFFFAOYSA-N -1 3 333.815 4.483 20 0 EIADHM CC(C)c1nsc([N-]C(=O)c2cc(C(F)(F)F)ccc2F)n1 ZINC000874695693 1054719394 /nfs/dbraw/zinc/71/93/94/1054719394.db2.gz STQPANNJFOAEKT-UHFFFAOYSA-N -1 3 333.310 4.072 20 0 EIADHM CC(C)c1ccc2nc(-c3ccc(OC(F)F)cc3)[n-]c(=O)c2c1 ZINC000060797440 1054724491 /nfs/dbraw/zinc/72/44/91/1054724491.db2.gz UVWVLUXZDVLSIM-UHFFFAOYSA-N -1 3 330.334 4.315 20 0 EIADHM Cc1ccc([N-]S(=O)(=O)c2ccc(F)c(C(F)(F)F)c2)c(C)c1 ZINC000063911200 1054842563 /nfs/dbraw/zinc/84/25/63/1054842563.db2.gz FWWMDBCDYMFIPH-UHFFFAOYSA-N -1 3 347.333 4.262 20 0 EIADHM [O-]c1cc(Nc2cncc(OCc3ccccc3)c2)c(F)cc1F ZINC001201625428 1054868372 /nfs/dbraw/zinc/86/83/72/1054868372.db2.gz BCHBBHRWLQAWAB-UHFFFAOYSA-N -1 3 328.318 4.388 20 0 EIADHM O=C(Nc1ccc(Br)cc1[O-])Nc1ccc(F)cc1F ZINC001202020572 1054982528 /nfs/dbraw/zinc/98/25/28/1054982528.db2.gz SXVGMQYMCXSDQO-UHFFFAOYSA-N -1 3 343.127 4.077 20 0 EIADHM Cc1ccc(NC(=O)Nc2ccc(-c3cc(=O)[n-]c(C)n3)cc2)c(C)c1 ZINC000339033214 1055012926 /nfs/dbraw/zinc/01/29/26/1055012926.db2.gz RVQJIMWGOSIDEY-UHFFFAOYSA-N -1 3 348.406 4.418 20 0 EIADHM CCOc1ccccc1NC(=O)[N-]c1cc(-c2cccs2)no1 ZINC001202139300 1055049167 /nfs/dbraw/zinc/04/91/67/1055049167.db2.gz RDHIGTLLFRGEMN-UHFFFAOYSA-N -1 3 329.381 4.446 20 0 EIADHM CCc1c(C)sc2[n-]c([C@H]3CSc4ccccc4O3)nc(=O)c12 ZINC000429548058 1055066421 /nfs/dbraw/zinc/06/64/21/1055066421.db2.gz LOXDFCCLAOEACG-GFCCVEGCSA-N -1 3 344.461 4.494 20 0 EIADHM CC1(c2nsc([N-]C(=O)c3sccc3SC(F)F)n2)CC1 ZINC000862609682 1055091004 /nfs/dbraw/zinc/09/10/04/1055091004.db2.gz WVOVYNDEILLMEQ-UHFFFAOYSA-N -1 3 347.437 4.218 20 0 EIADHM O=C([N-][C@H]1CCCc2ccc(Cl)cc21)C(F)(F)c1nccs1 ZINC000863208616 1055161080 /nfs/dbraw/zinc/16/10/80/1055161080.db2.gz LRPNLMFNEFEIBQ-LBPRGKRZSA-N -1 3 342.798 4.082 20 0 EIADHM CC[C@@H]1c2ccsc2CCN1Cc1nnc(-c2ccccc2[O-])o1 ZINC000877966516 1055162924 /nfs/dbraw/zinc/16/29/24/1055162924.db2.gz NGPVMKSXOIQTND-CQSZACIVSA-N -1 3 341.436 4.013 20 0 EIADHM Cc1ccc(CN(Cc2nnc(-c3ccccc3[O-])o2)C(C)C)s1 ZINC000877994500 1055171375 /nfs/dbraw/zinc/17/13/75/1055171375.db2.gz VSQIGESUYLTYTL-UHFFFAOYSA-N -1 3 343.452 4.223 20 0 EIADHM [O-]c1ccccc1-c1nnc(CN2CCCCC[C@H]2c2ccco2)o1 ZINC000878116607 1055190446 /nfs/dbraw/zinc/19/04/46/1055190446.db2.gz JXGLMXVAOVJGGI-HNNXBMFYSA-N -1 3 339.395 4.153 20 0 EIADHM CC(C)(C)[C@@H](NCc1nnc(-c2ccccc2[O-])o1)c1ccccc1 ZINC000878215586 1055208898 /nfs/dbraw/zinc/20/88/98/1055208898.db2.gz YJLKXXRGECHKLT-SFHVURJKSA-N -1 3 337.423 4.319 20 0 EIADHM C[C@H](c1ccccc1)N(Cc1nnc(-c2ccccc2[O-])o1)C1CC1 ZINC000878218902 1055212099 /nfs/dbraw/zinc/21/20/99/1055212099.db2.gz CGGNTYLSEBILQJ-CQSZACIVSA-N -1 3 335.407 4.168 20 0 EIADHM C[C@@H](NCc1nnc(-c2ccccc2[O-])o1)c1ccc2c(c1)CCCC2 ZINC000878346128 1055252006 /nfs/dbraw/zinc/25/20/06/1055252006.db2.gz DYVZINMFIGRJPU-CQSZACIVSA-N -1 3 349.434 4.172 20 0 EIADHM [O-]c1ccccc1-c1nnc(CN2CCCC[C@@H]2c2ccccc2)o1 ZINC000878434287 1055309019 /nfs/dbraw/zinc/30/90/19/1055309019.db2.gz UOQLFZBKELCWKT-QGZVFWFLSA-N -1 3 335.407 4.169 20 0 EIADHM O=C(NCc1ccc2ccccc2n1)c1cc([O-])c2ccccc2c1 ZINC000352775894 1055524420 /nfs/dbraw/zinc/52/44/20/1055524420.db2.gz OKPBSNXFLPYXHR-UHFFFAOYSA-N -1 3 328.371 4.024 20 0 EIADHM CC(C)(C)c1nnc([N-]C(=O)c2cnc(-c3ccccc3)s2)s1 ZINC000055977231 1055830259 /nfs/dbraw/zinc/83/02/59/1055830259.db2.gz DVSLVUREZUMDBD-UHFFFAOYSA-N -1 3 344.465 4.211 20 0 EIADHM O=C(CCCc1ccsc1)Nc1ccc(Br)cc1[O-] ZINC001116536109 1056036462 /nfs/dbraw/zinc/03/64/62/1056036462.db2.gz ZQSZOWGNWDEKIJ-UHFFFAOYSA-N -1 3 340.242 4.178 20 0 EIADHM CN(C)C(=O)c1cccc(Nc2c(Cl)cc(F)cc2Cl)c1[O-] ZINC001214477525 1056696181 /nfs/dbraw/zinc/69/61/81/1056696181.db2.gz UEBHQWOTLOBRBU-UHFFFAOYSA-N -1 3 343.185 4.284 20 0 EIADHM CC(C)(C)c1ccc(S(=O)(=O)[N-]c2ccc(F)c(F)c2F)cc1 ZINC000007405029 1056793254 /nfs/dbraw/zinc/79/32/54/1056793254.db2.gz CHPHZTXKSKOYNP-UHFFFAOYSA-N -1 3 343.370 4.202 20 0 EIADHM CC(C)c1cccc(S(=O)(=O)[N-]c2ccc(N3CCCC3)cc2)c1 ZINC000743046984 1058849490 /nfs/dbraw/zinc/84/94/90/1058849490.db2.gz CSIBMFPUCSXHBS-UHFFFAOYSA-N -1 3 344.480 4.211 20 0 EIADHM Cc1cc(=O)[n-]c(-c2cccc(OC(=O)C3CCCCCC3)c2)n1 ZINC000744216992 1059335401 /nfs/dbraw/zinc/33/54/01/1059335401.db2.gz MYAYCBJDBXKDGU-UHFFFAOYSA-N -1 3 326.396 4.033 20 0 EIADHM Cc1noc(C(F)(F)F)c1C(=O)[N-]c1nc2ccc(C)cc2s1 ZINC000746019227 1059967333 /nfs/dbraw/zinc/96/73/33/1059967333.db2.gz GLOXHSFRCDVLJP-UHFFFAOYSA-N -1 3 341.314 4.172 20 0 EIADHM COc1c(Cl)ccc(Nc2cc(=O)[n-]n2C2CCCC2)c1F ZINC001212582726 1060527781 /nfs/dbraw/zinc/52/77/81/1060527781.db2.gz XARJQUCMGGKAOQ-UHFFFAOYSA-N -1 3 325.771 4.249 20 0 EIADHM CCOC(=O)c1nc(Cl)sc1Nc1ccc(Cl)c([O-])c1 ZINC001212591518 1060857549 /nfs/dbraw/zinc/85/75/49/1060857549.db2.gz QGYJPGHCTLHIRV-UHFFFAOYSA-N -1 3 333.196 4.076 20 0 EIADHM Nc1cc(Br)cc(F)c1Nc1ccc(Cl)c([O-])c1 ZINC001212593216 1060886323 /nfs/dbraw/zinc/88/63/23/1060886323.db2.gz GASHXEGSBJTRHH-UHFFFAOYSA-N -1 3 331.572 4.273 20 0 EIADHM Cc1cc(/C=C\C(=O)[N-]OCC(F)(F)F)c(C)n1C1CCCCC1 ZINC000766775091 1060887420 /nfs/dbraw/zinc/88/74/20/1060887420.db2.gz VAFRKOUSABQTHF-HJWRWDBZSA-N -1 3 344.377 4.233 20 0 EIADHM Cc1cc(NCc2ncccc2[O-])nc2ccc(Br)cc12 ZINC001169733523 1060937358 /nfs/dbraw/zinc/93/73/58/1060937358.db2.gz XWROCIBXYORUTI-UHFFFAOYSA-N -1 3 344.212 4.018 20 0 EIADHM C[C@@H](NCc1cc(=O)[n-]c(-c2ccccc2)n1)c1ccccc1Cl ZINC001169964103 1061053073 /nfs/dbraw/zinc/05/30/73/1061053073.db2.gz VVDQZDUCSNJSCT-CYBMUJFWSA-N -1 3 339.826 4.353 20 0 EIADHM CCc1ccc(S(=O)(=O)[N-]c2ccc(OC(C)C)cc2C)cc1 ZINC000614863590 1032101874 /nfs/dbraw/zinc/10/18/74/1032101874.db2.gz GFBVBKCWHPFJLM-UHFFFAOYSA-N -1 3 333.453 4.145 20 0 EIADHM Cc1ccc([C@H]2CCCCN2C(=O)Cc2ccc([O-])c(F)c2)cc1 ZINC000449983427 1032188193 /nfs/dbraw/zinc/18/81/93/1032188193.db2.gz BAOCVHIOKNGXBI-GOSISDBHSA-N -1 3 327.399 4.136 20 0 EIADHM Cc1c(COC(C)(C)C)cccc1NC(=O)Cc1ccc([O-])c(F)c1 ZINC000450033402 1032228275 /nfs/dbraw/zinc/22/82/75/1032228275.db2.gz QIRJHCQPUFBHLH-UHFFFAOYSA-N -1 3 345.414 4.336 20 0 EIADHM CCN(C(=O)c1ccc(O)cc1[O-])[C@H](C)c1cc2ccccc2o1 ZINC000194244006 1032248737 /nfs/dbraw/zinc/24/87/37/1032248737.db2.gz RYRFTZUSEXJBFI-GFCCVEGCSA-N -1 3 325.364 4.067 20 0 EIADHM Cc1nc(C2CCCC2)sc1C(=O)[N-]c1nnc(C(F)F)s1 ZINC000173816558 1032378900 /nfs/dbraw/zinc/37/89/00/1032378900.db2.gz OZGYSCQMYQWSBK-UHFFFAOYSA-N -1 3 344.412 4.151 20 0 EIADHM COCCCC(=O)Nc1ccc([O-])c(-c2nc3ccccc3s2)c1 ZINC000093095314 1032763461 /nfs/dbraw/zinc/76/34/61/1032763461.db2.gz SNCHKXRAYOLAKE-UHFFFAOYSA-N -1 3 342.420 4.034 20 0 EIADHM C[C@H](CCC[C@H](C)NCc1c(Cl)cccc1OC(F)F)C(=O)[O-] ZINC000683170300 1019083095 /nfs/dbraw/zinc/08/30/95/1019083095.db2.gz JDVXVQBTXLLWMR-MNOVXSKESA-N -1 3 349.805 4.311 20 0 EIADHM CC(=O)c1ccc(C(=O)NC(C)(C)c2cccc(Cl)c2F)cc1[O-] ZINC001625793692 1019158153 /nfs/dbraw/zinc/15/81/53/1019158153.db2.gz ZVIYFPCDDKVFNU-UHFFFAOYSA-N -1 3 349.789 4.052 20 0 EIADHM C[C@@H](c1ccccc1)n1ccc([N-]c2snc(Cl)c2C#N)n1 ZINC000092683976 1019387810 /nfs/dbraw/zinc/38/78/10/1019387810.db2.gz CQHDYHWEEMSWRD-JTQLQIEISA-N -1 3 329.816 4.218 20 0 EIADHM Cc1ccc(-c2csc3[nH]c(-c4ccc([O-])cc4)nc(=O)c23)cc1 ZINC000046438361 1020838025 /nfs/dbraw/zinc/83/80/25/1020838025.db2.gz JEQIUDHHDVTSJD-UHFFFAOYSA-N -1 3 334.400 4.333 20 0 EIADHM COC([O-])=NC(=S)N(c1cc(C)cc(Cl)c1)c1ccccc1N ZINC001210464053 1021107688 /nfs/dbraw/zinc/10/76/88/1021107688.db2.gz RKOXZOJKJXAHCG-UHFFFAOYSA-N -1 3 349.843 4.010 20 0 EIADHM CSc1cc(C)ccc1[N-]C(=O)c1cc(COC(C)(C)C)on1 ZINC000413907741 1021354461 /nfs/dbraw/zinc/35/44/61/1021354461.db2.gz QTWSLSWRYIXGAB-UHFFFAOYSA-N -1 3 334.441 4.272 20 0 EIADHM O=C(N[C@@H]1CC[C@H](Cc2ccccc2)C1)c1cc(=O)c2ccccc2[n-]1 ZINC000275752261 1021504852 /nfs/dbraw/zinc/50/48/52/1021504852.db2.gz CYDXNMMCRNFMFE-IAGOWNOFSA-N -1 3 346.430 4.082 20 0 EIADHM C[C@@H]1CC[C@H](C(=O)[O-])[C@H](C)N1CCc1cccc(Cl)c1Cl ZINC000580097815 1021641794 /nfs/dbraw/zinc/64/17/94/1021641794.db2.gz CMHHBPXENZDBCX-MDZLAQPJSA-N -1 3 330.255 4.110 20 0 EIADHM CC(C)Oc1cccc([C@H](C)NC(=O)c2cc([O-])ccc2Cl)c1 ZINC000431722541 1021645485 /nfs/dbraw/zinc/64/54/85/1021645485.db2.gz MSIAESCGVXGDAQ-LBPRGKRZSA-N -1 3 333.815 4.324 20 0 EIADHM Cc1cc(Nc2cccc([O-])c2Cl)n(Cc2ccccc2F)n1 ZINC001210853863 1021803230 /nfs/dbraw/zinc/80/32/30/1021803230.db2.gz NFUKRTYTVHXBGI-UHFFFAOYSA-N -1 3 331.778 4.482 20 0 EIADHM O=C(Nc1ccc(Nc2ccccc2)nc1)c1cc([O-])ccc1Cl ZINC000431780169 1021832900 /nfs/dbraw/zinc/83/29/00/1021832900.db2.gz DKXNXFFVMGQHOQ-UHFFFAOYSA-N -1 3 339.782 4.437 20 0 EIADHM Cc1cc(C(=O)Nc2c([O-])cccc2Cl)nn1-c1ccc(C)cc1 ZINC000580365781 1021908864 /nfs/dbraw/zinc/90/88/64/1021908864.db2.gz CMQWTZSUALQFDI-UHFFFAOYSA-N -1 3 341.798 4.100 20 0 EIADHM COc1cccc(SC)c1[N-]C(=O)c1cnc(C(C)(C)C)s1 ZINC000416127099 1022501891 /nfs/dbraw/zinc/50/18/91/1022501891.db2.gz YOZYWEFKBQDHFR-UHFFFAOYSA-N -1 3 336.482 4.423 20 0 EIADHM CCSc1ccc(Cl)cc1[N-]C(=O)c1csc(COC)n1 ZINC000104482836 1022769995 /nfs/dbraw/zinc/76/99/95/1022769995.db2.gz UOPXXOLBLRELTO-UHFFFAOYSA-N -1 3 342.873 4.307 20 0 EIADHM [O-]c1cccc(Nc2ccc(Cl)c(CO)c2F)c1Br ZINC001215610693 1022841037 /nfs/dbraw/zinc/84/10/37/1022841037.db2.gz WXIZPIQPSRRQQS-UHFFFAOYSA-N -1 3 346.583 4.183 20 0 EIADHM O=C(OCc1csc(-c2ccccc2F)n1)c1ccc([O-])cc1 ZINC000728317537 1022852625 /nfs/dbraw/zinc/85/26/25/1022852625.db2.gz ZMCKILRWBWKJMS-UHFFFAOYSA-N -1 3 329.352 4.012 20 0 EIADHM CC(C)(C(=O)Nc1cccc([O-])c1F)c1cccc(C(F)(F)F)c1 ZINC000128620586 1022941961 /nfs/dbraw/zinc/94/19/61/1022941961.db2.gz BTHSCFAUPATJLL-UHFFFAOYSA-N -1 3 341.304 4.466 20 0 EIADHM CCC[C@@H](NCc1cccc([O-])c1Br)c1ccccn1 ZINC000656497320 1023055799 /nfs/dbraw/zinc/05/57/99/1023055799.db2.gz LAKSBLKSBFSLMZ-CYBMUJFWSA-N -1 3 335.245 4.181 20 0 EIADHM CC(C)c1ccc(C(=O)N2CCCC[C@@H]2[C@@H]2CCCC[C@@H]2O)c([O-])c1 ZINC000647648037 1023096741 /nfs/dbraw/zinc/09/67/41/1023096741.db2.gz PFOLYHMZXMSXKA-UHOSZYNNSA-N -1 3 345.483 4.061 20 0 EIADHM C[C@H]1C[C@H]1c1ccc(CN2CCC(C(=O)c3ccc([O-])cc3)CC2)o1 ZINC000124039163 1023193472 /nfs/dbraw/zinc/19/34/72/1023193472.db2.gz ZQGNLVIWDMHNHY-IFXJQAMLSA-N -1 3 339.435 4.204 20 0 EIADHM Cc1cc(F)cc(-c2noc(C=C([O-])c3ccccc3Cl)n2)c1 ZINC001211646921 1023209830 /nfs/dbraw/zinc/20/98/30/1023209830.db2.gz CQWPVGDPVHPNBT-UHFFFAOYSA-N -1 3 330.746 4.263 20 0 EIADHM Cc1nc(C(C)C)sc1[C@H](C)N(C)Cc1ccccc1C(=O)[O-] ZINC000584724429 1023246886 /nfs/dbraw/zinc/24/68/86/1023246886.db2.gz BZCRUCCOGTVGER-ZDUSSCGKSA-N -1 3 332.469 4.466 20 0 EIADHM CN(C[C@H]1CCc2ccccc21)[C@H](C(=O)[O-])c1c(F)cccc1Cl ZINC000659803513 1023284008 /nfs/dbraw/zinc/28/40/08/1023284008.db2.gz JQDJNYYMWDFUAE-ACJLOTCBSA-N -1 3 347.817 4.267 20 0 EIADHM CCN(CCCCCC(=O)[O-])Cc1cc(Br)ccc1F ZINC000581493766 1023303011 /nfs/dbraw/zinc/30/30/11/1023303011.db2.gz IJMBIIVKSQIVLB-UHFFFAOYSA-N -1 3 346.240 4.055 20 0 EIADHM [O-]c1ccccc1-c1nc(-c2ccc(Oc3ccc(F)cc3)nc2)no1 ZINC000182500173 1023310911 /nfs/dbraw/zinc/31/09/11/1023310911.db2.gz DLIWKKZPWMOWNY-UHFFFAOYSA-N -1 3 349.321 4.436 20 0 EIADHM O=C([N-]c1c(F)cc(Br)cc1F)c1cc(F)ccc1F ZINC000088173946 1023349386 /nfs/dbraw/zinc/34/93/86/1023349386.db2.gz JUOVRBAYRPLSHS-UHFFFAOYSA-N -1 3 348.093 4.258 20 0 EIADHM O=C([O-])[C@H]1C[C@H](NCc2cnc(C3CCCC3)s2)c2ccccc21 ZINC000417630004 1023381690 /nfs/dbraw/zinc/38/16/90/1023381690.db2.gz QQZBKWIAPZFZMA-IRXDYDNUSA-N -1 3 342.464 4.204 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)N1CCC[C@H]1c1cccs1 ZINC000468557310 1023383760 /nfs/dbraw/zinc/38/37/60/1023383760.db2.gz YNQCBYWQJYNLST-HNNXBMFYSA-N -1 3 333.428 4.279 20 0 EIADHM O=C([O-])[C@H]1C[C@@H](NCc2ccccc2C(F)(F)F)c2ccccc21 ZINC000417626007 1023386353 /nfs/dbraw/zinc/38/63/53/1023386353.db2.gz SHHOOBNRUSMUBR-GOEBONIOSA-N -1 3 335.325 4.108 20 0 EIADHM Cc1cc(CNCc2ccc(OCC(C)C)cc2)ccc1C(=O)[O-] ZINC000417670434 1023402137 /nfs/dbraw/zinc/40/21/37/1023402137.db2.gz OKHZGRBTKBFXRD-UHFFFAOYSA-N -1 3 327.424 4.018 20 0 EIADHM CCC(C)(C)c1ccc(NC(=O)c2c[n-]c3ccccc3c2=O)cc1 ZINC000468735144 1023444903 /nfs/dbraw/zinc/44/49/03/1023444903.db2.gz BXQWULGGPMCAEP-UHFFFAOYSA-N -1 3 334.419 4.468 20 0 EIADHM C[C@H](c1ccccc1)n1ccc([N-]c2snc(Cl)c2C#N)n1 ZINC000092683977 1023589277 /nfs/dbraw/zinc/58/92/77/1023589277.db2.gz CQHDYHWEEMSWRD-SNVBAGLBSA-N -1 3 329.816 4.218 20 0 EIADHM O=C(CCc1ccc(-c2ccccc2F)o1)[N-]OCCC(F)(F)F ZINC000162622139 1023623712 /nfs/dbraw/zinc/62/37/12/1023623712.db2.gz PNRRLBZKHOUFFK-UHFFFAOYSA-N -1 3 345.292 4.019 20 0 EIADHM O=C(CCCc1ccc2ccccc2c1)[N-]OCCC(F)(F)F ZINC000162688321 1023694231 /nfs/dbraw/zinc/69/42/31/1023694231.db2.gz RJORRVTULZAFPC-UHFFFAOYSA-N -1 3 325.330 4.163 20 0 EIADHM N#Cc1cc(-c2ccccc2)sc1[N-]C(=O)c1ccnc(F)c1F ZINC000193516856 1023699875 /nfs/dbraw/zinc/69/98/75/1023699875.db2.gz IWQYONNIMKOAIP-UHFFFAOYSA-N -1 3 341.342 4.212 20 0 EIADHM CCOc1cc(Cl)ccc1CNCc1c(F)ccc([O-])c1F ZINC000511714430 1023836780 /nfs/dbraw/zinc/83/67/80/1023836780.db2.gz UTBOVTOTVGWXBD-UHFFFAOYSA-N -1 3 327.758 4.012 20 0 EIADHM Fc1cc(NC2c3ccccc3-c3ccccc32)cc(-c2nnn[n-]2)c1 ZINC001167776863 1024029342 /nfs/dbraw/zinc/02/93/42/1024029342.db2.gz JBUAIWVGGVVLMK-UHFFFAOYSA-N -1 3 343.365 4.188 20 0 EIADHM Fc1cc(NC2c3ccccc3-c3ccccc32)cc(-c2nn[n-]n2)c1 ZINC001167776863 1024029362 /nfs/dbraw/zinc/02/93/62/1024029362.db2.gz JBUAIWVGGVVLMK-UHFFFAOYSA-N -1 3 343.365 4.188 20 0 EIADHM [O-]c1cc(F)cc(CN2CCCC[C@H]2c2nc3ccccc3o2)c1 ZINC000473139549 1024386120 /nfs/dbraw/zinc/38/61/20/1024386120.db2.gz KEIQGGSKAXJCFK-KRWDZBQOSA-N -1 3 326.371 4.400 20 0 EIADHM Cc1ccsc1-c1nsc([N-]C(=O)c2scnc2C2CC2)n1 ZINC000131387139 1024501287 /nfs/dbraw/zinc/50/12/87/1024501287.db2.gz URYUWQYNPKXZRQ-UHFFFAOYSA-N -1 3 348.478 4.161 20 0 EIADHM O=S(=O)([N-]C1(c2ccccc2)CCCC1)c1ccc(Cl)s1 ZINC000041572465 1024724354 /nfs/dbraw/zinc/72/43/54/1024724354.db2.gz HWXCSLFDVVMZCG-UHFFFAOYSA-N -1 3 341.885 4.149 20 0 EIADHM CN(CC[C@H](C(=O)[O-])c1ccccc1)Cc1cc(Cl)ccc1F ZINC000652436854 1024830683 /nfs/dbraw/zinc/83/06/83/1024830683.db2.gz GNVIXZGGALLWAV-INIZCTEOSA-N -1 3 335.806 4.169 20 0 EIADHM O=C([O-])c1sccc1CN1CC[C@@H](C(F)(F)F)C2(CCC2)C1 ZINC000652447143 1024837627 /nfs/dbraw/zinc/83/76/27/1024837627.db2.gz RNUSSGKMGQVPNT-LLVKDONJSA-N -1 3 333.375 4.001 20 0 EIADHM O=C(c1cc([O-])ccc1Cl)N1CCC[C@@H]1Cc1ccc(F)cc1 ZINC000341867477 1024841689 /nfs/dbraw/zinc/84/16/89/1024841689.db2.gz JJEAMWVZVPULLW-CQSZACIVSA-N -1 3 333.790 4.032 20 0 EIADHM O=C([O-])CC[C@H]1CCCCN1Cc1nc(-c2ccccc2)cs1 ZINC000652496315 1024854718 /nfs/dbraw/zinc/85/47/18/1024854718.db2.gz RLUUGKLCAPUUBK-OAHLLOKOSA-N -1 3 330.453 4.029 20 0 EIADHM O=C([O-])CCCCCCCNCc1csc(-c2cccs2)n1 ZINC000277187356 1025281888 /nfs/dbraw/zinc/28/18/88/1025281888.db2.gz FRMPGDHGGWLMFZ-UHFFFAOYSA-N -1 3 338.498 4.386 20 0 EIADHM O=C([N-]c1cc(-c2ccccc2)on1)c1cc(-c2ccccc2)ns1 ZINC000439956064 1025493098 /nfs/dbraw/zinc/49/30/98/1025493098.db2.gz GSMKUWFILPCGDE-UHFFFAOYSA-N -1 3 347.399 4.139 20 0 EIADHM [O-]c1cc(F)cc(CNc2ccc(F)cc2OCC(F)(F)F)c1 ZINC000472081131 1025703698 /nfs/dbraw/zinc/70/36/98/1025703698.db2.gz XUEAJAZLUHVFEZ-UHFFFAOYSA-N -1 3 333.256 4.224 20 0 EIADHM CC[C@H](C)c1ccc(S(=O)(=O)[N-]c2ccc(OC)cc2C)cc1 ZINC000014223703 1025773515 /nfs/dbraw/zinc/77/35/15/1025773515.db2.gz FVVSALDUOOJUBE-ZDUSSCGKSA-N -1 3 333.453 4.318 20 0 EIADHM CC[C@@H](C)[C@H](C)[N-]S(=O)(=O)c1ccc(Cl)cc1C(F)(F)F ZINC000512029400 1025791805 /nfs/dbraw/zinc/79/18/05/1025791805.db2.gz CBXOHAZHPXWREY-BDAKNGLRSA-N -1 3 343.798 4.072 20 0 EIADHM COc1ccc(S[C@H](C)C(=O)Nc2cc(Cl)ccc2[O-])cc1 ZINC000111211321 1026097398 /nfs/dbraw/zinc/09/73/98/1026097398.db2.gz OVNRSDPPRKDEFH-SNVBAGLBSA-N -1 3 337.828 4.174 20 0 EIADHM C[C@H](CCCCC(=O)[O-])NCc1csc(-c2ccc(F)cc2)n1 ZINC000426663389 1026207706 /nfs/dbraw/zinc/20/77/06/1026207706.db2.gz LHIWIWARNMRNQF-GFCCVEGCSA-N -1 3 336.432 4.072 20 0 EIADHM CCc1cc2c([n-]c([C@@H]3CSc4ccccc4O3)nc2=O)s1 ZINC000279269309 1026250654 /nfs/dbraw/zinc/25/06/54/1026250654.db2.gz NEOXCRADACVZCY-LBPRGKRZSA-N -1 3 330.434 4.185 20 0 EIADHM [O-]c1ccc(CNCc2cc(Br)ccc2F)cc1Cl ZINC000043488463 1026361105 /nfs/dbraw/zinc/36/11/05/1026361105.db2.gz YLHYCUHBGRCVTG-UHFFFAOYSA-N -1 3 344.611 4.237 20 0 EIADHM Cc1nc([N-]C(=O)c2ocnc2C(F)F)sc1Cc1ccccc1 ZINC001125590879 1026406005 /nfs/dbraw/zinc/40/60/05/1026406005.db2.gz UNLAGFOQEWTKES-UHFFFAOYSA-N -1 3 349.362 4.220 20 0 EIADHM CC(C)CCOc1ccc(CNCc2ccc(C(=O)[O-])cc2)cc1 ZINC000426682988 1026472522 /nfs/dbraw/zinc/47/25/22/1026472522.db2.gz NRRXMJQENPRYAC-UHFFFAOYSA-N -1 3 327.424 4.100 20 0 EIADHM CC(C)COc1ccc(CN[C@H](CC(=O)[O-])c2ccsc2)cc1 ZINC000426684769 1026475017 /nfs/dbraw/zinc/47/50/17/1026475017.db2.gz BOUYUUKKKJFPAR-QGZVFWFLSA-N -1 3 333.453 4.089 20 0 EIADHM O=C([O-])C[C@H](NCc1cc(Cl)cc(Cl)c1)c1ccsc1 ZINC000426684172 1026475356 /nfs/dbraw/zinc/47/53/56/1026475356.db2.gz XVHCNEMMRFATBQ-ZDUSSCGKSA-N -1 3 330.236 4.361 20 0 EIADHM O=C([O-])C[C@H](NCc1cccc(-c2cccnc2)c1)c1ccsc1 ZINC000426693064 1026493867 /nfs/dbraw/zinc/49/38/67/1026493867.db2.gz XOCOLDHABXHWEB-SFHVURJKSA-N -1 3 338.432 4.116 20 0 EIADHM O=C(Nc1ccc(C(=O)C2CCC2)cc1)c1cc([O-])ccc1Cl ZINC000506892660 1026507440 /nfs/dbraw/zinc/50/74/40/1026507440.db2.gz RCYLJPDPXLXLMN-UHFFFAOYSA-N -1 3 329.783 4.281 20 0 EIADHM O=C([O-])C[C@@H](NCc1ccc(F)cc1)c1cc(Cl)cc(Cl)c1 ZINC000426746714 1026533545 /nfs/dbraw/zinc/53/35/45/1026533545.db2.gz KQWPGYQAVUWIML-OAHLLOKOSA-N -1 3 342.197 4.438 20 0 EIADHM Cc1nc(C)c(CN[C@H](CC(=O)[O-])c2ccc(C(C)C)cc2)s1 ZINC000426769504 1026548480 /nfs/dbraw/zinc/54/84/80/1026548480.db2.gz JMOUWYGXQYNVBC-MRXNPFEDSA-N -1 3 332.469 4.189 20 0 EIADHM Cc1cc([C@H](NCc2cc3ccc(F)cc3[nH]2)C(=O)[O-])ccc1Cl ZINC000426776641 1026551714 /nfs/dbraw/zinc/55/17/14/1026551714.db2.gz HAEZTJIQPYSANB-KRWDZBQOSA-N -1 3 346.789 4.184 20 0 EIADHM COc1cccc([C@@H](CC(=O)[O-])NCc2ccc(C(C)(C)C)cc2)c1 ZINC000426767660 1026560651 /nfs/dbraw/zinc/56/06/51/1026560651.db2.gz PECOREGMHNGNCH-LJQANCHMSA-N -1 3 341.451 4.298 20 0 EIADHM COc1cccc([C@@H](CC(=O)[O-])NCc2ccc(C(C)C)cc2)c1 ZINC000426767894 1026561312 /nfs/dbraw/zinc/56/13/12/1026561312.db2.gz RTQVVNPSWWNBKT-LJQANCHMSA-N -1 3 327.424 4.124 20 0 EIADHM O=C([O-])[C@H](NCc1cccc(Oc2ccccc2)c1)c1ccc(O)cc1 ZINC000426812071 1026574638 /nfs/dbraw/zinc/57/46/38/1026574638.db2.gz WPHRPDGQAIPTRX-HXUWFJFHSA-N -1 3 349.386 4.100 20 0 EIADHM CSc1ccc(CN[C@@H](C(=O)[O-])c2ccc(Cl)c(C)c2)cc1 ZINC000426828381 1026586222 /nfs/dbraw/zinc/58/62/22/1026586222.db2.gz LFVPYDCPNLHTEQ-MRXNPFEDSA-N -1 3 335.856 4.286 20 0 EIADHM Cc1ccc([N-]S(=O)(=O)c2ccc(OC(C)C)c(C)c2)cc1F ZINC000511146187 1026741489 /nfs/dbraw/zinc/74/14/89/1026741489.db2.gz QCAFMKZTUZHZIN-UHFFFAOYSA-N -1 3 337.416 4.031 20 0 EIADHM CN(Cc1cccc(C(F)(F)F)c1)[C@H](C(=O)[O-])c1ccsc1 ZINC000582671422 1026922568 /nfs/dbraw/zinc/92/25/68/1026922568.db2.gz OMWYIAKULIMCLD-ZDUSSCGKSA-N -1 3 329.343 4.025 20 0 EIADHM COc1cc(F)c([N-]C(=O)c2cc(-c3ccccc3F)on2)cc1F ZINC000125679470 1026931566 /nfs/dbraw/zinc/93/15/66/1026931566.db2.gz QUHICPBHOZKDJA-UHFFFAOYSA-N -1 3 348.280 4.020 20 0 EIADHM CC(C)CCn1ncc([N-]S(=O)(=O)CCC(C)(C)C)c1C(C)C ZINC000519852111 1027019076 /nfs/dbraw/zinc/01/90/76/1027019076.db2.gz QEHKSILWDRPSJL-UHFFFAOYSA-N -1 3 343.537 4.231 20 0 EIADHM O=C(CCn1ccc2ccccc21)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000440981174 1027205931 /nfs/dbraw/zinc/20/59/31/1027205931.db2.gz NZDDQLQYKGUIPH-UHFFFAOYSA-N -1 3 348.324 4.395 20 0 EIADHM Cc1ccc(-c2noc([N-]Cc3coc(-c4ccccc4)n3)n2)cc1 ZINC000302071911 1027207863 /nfs/dbraw/zinc/20/78/63/1027207863.db2.gz USADHYMBRFYXTN-UHFFFAOYSA-N -1 3 332.363 4.312 20 0 EIADHM Cc1ccc(-c2nc(C(=O)Nc3cc(Cl)ccc3[O-])cs2)o1 ZINC000520231032 1027340233 /nfs/dbraw/zinc/34/02/33/1027340233.db2.gz SMKGVVNHWXBJQL-UHFFFAOYSA-N -1 3 334.784 4.323 20 0 EIADHM CC(C)CCOc1ccc([N-]C(=O)c2ocnc2C(F)F)c(F)c1 ZINC000628026804 1027432135 /nfs/dbraw/zinc/43/21/35/1027432135.db2.gz ZZEXDRKJUYNVGO-UHFFFAOYSA-N -1 3 342.317 4.429 20 0 EIADHM C=CCNC(=S)Nc1ccc([O-])c(-c2nc3ccccc3s2)c1 ZINC000007582961 1027439950 /nfs/dbraw/zinc/43/99/50/1027439950.db2.gz LBNWMKGRXWZZOC-UHFFFAOYSA-N -1 3 341.461 4.141 20 0 EIADHM O=C([O-])c1ccc(-c2nc(CN3CCC4(C3)CCCCC4)co2)cc1 ZINC000582850708 1027507931 /nfs/dbraw/zinc/50/79/31/1027507931.db2.gz DGHWJRQPTIFVEH-UHFFFAOYSA-N -1 3 340.423 4.196 20 0 EIADHM Cc1ccccc1[N-]S(=O)(=O)c1ccc(OCCC(C)C)cc1 ZINC000520404548 1027517857 /nfs/dbraw/zinc/51/78/57/1027517857.db2.gz NDXPWUZFKALYQB-UHFFFAOYSA-N -1 3 333.453 4.221 20 0 EIADHM O=C(Nc1c([O-])cccc1Cl)c1cc(F)ccc1Br ZINC000560822434 1027550749 /nfs/dbraw/zinc/55/07/49/1027550749.db2.gz PHIFFRPDYUAOCH-UHFFFAOYSA-N -1 3 344.567 4.200 20 0 EIADHM CC(C)(C)[C@@H]1CCC[C@H](NC(=O)c2cc(=O)c3ccccc3[n-]2)CC1 ZINC000444438198 1027745168 /nfs/dbraw/zinc/74/51/68/1027745168.db2.gz RGBLKXQWROLJTA-CABCVRRESA-N -1 3 340.467 4.253 20 0 EIADHM CCc1cccc(C(=O)N2CCCc3c(OC(F)F)cccc32)c1[O-] ZINC000582985167 1027806201 /nfs/dbraw/zinc/80/62/01/1027806201.db2.gz BDEDVHDCXBIAHZ-UHFFFAOYSA-N -1 3 347.361 4.149 20 0 EIADHM Cc1c(NC(=O)c2ccc3c(c2[O-])CCCC3)cnn1C1CCCC1 ZINC000444492833 1027848026 /nfs/dbraw/zinc/84/80/26/1027848026.db2.gz CVXQZAZPHXHNTJ-UHFFFAOYSA-N -1 3 339.439 4.143 20 0 EIADHM CC(C)Sc1cccc(Cl)c1CN1CC[C@H](C)[C@@H](C(=O)[O-])C1 ZINC000583024767 1027860330 /nfs/dbraw/zinc/86/03/30/1027860330.db2.gz JKXBSKOANSNBOD-STQMWFEESA-N -1 3 341.904 4.383 20 0 EIADHM CC(C)Sc1cccc(Cl)c1CN1CC[C@@H](C)[C@@H](C(=O)[O-])C1 ZINC000583024765 1027861972 /nfs/dbraw/zinc/86/19/72/1027861972.db2.gz JKXBSKOANSNBOD-OLZOCXBDSA-N -1 3 341.904 4.383 20 0 EIADHM CC(C)[C@H]1C[C@@H](CC(=O)Nc2ccc([O-])c(C(F)(F)F)c2)CCO1 ZINC000330809626 1027889253 /nfs/dbraw/zinc/88/92/53/1027889253.db2.gz LHAIQIUCLNSKLF-XHDPSFHLSA-N -1 3 345.361 4.191 20 0 EIADHM O=C([N-]c1c(F)cc(Br)cc1F)c1ccoc1Cl ZINC000192392252 1027940637 /nfs/dbraw/zinc/94/06/37/1027940637.db2.gz DHLRWWGNGPDCGC-UHFFFAOYSA-N -1 3 336.519 4.226 20 0 EIADHM Cc1cc(S(=O)(=O)[N-]c2ccc(OC(C)C)cc2Cl)c(C)o1 ZINC000188601781 1028006455 /nfs/dbraw/zinc/00/64/55/1028006455.db2.gz DMRYTKREYNVRAB-UHFFFAOYSA-N -1 3 343.832 4.138 20 0 EIADHM O=C(N[C@H]1CC[C@H](c2ccccc2F)C1)c1cc([O-])ccc1Cl ZINC000511235796 1028308310 /nfs/dbraw/zinc/30/83/10/1028308310.db2.gz PFDBAUNEKPDPMJ-RYUDHWBXSA-N -1 3 333.790 4.251 20 0 EIADHM CC(C)c1ccc(-c2nc(-c3ccc(-c4nnco4)cc3)no2)c([O-])c1 ZINC000445392789 1028499765 /nfs/dbraw/zinc/49/97/65/1028499765.db2.gz NDGRFVXXODWGGZ-UHFFFAOYSA-N -1 3 348.362 4.283 20 0 EIADHM CCc1ccc([O-])c(C(=O)N2CCC(c3ccccc3F)CC2)c1 ZINC000524245389 1028827996 /nfs/dbraw/zinc/82/79/96/1028827996.db2.gz DCTIUXWXRBZNHQ-UHFFFAOYSA-N -1 3 327.399 4.114 20 0 EIADHM O=S(=O)([N-][C@H](c1ccc(Cl)cc1)C1CCCC1)c1ccco1 ZINC000445743313 1028869367 /nfs/dbraw/zinc/86/93/67/1028869367.db2.gz QVFKRRBPMXDPCC-INIZCTEOSA-N -1 3 339.844 4.143 20 0 EIADHM CCc1ccc(-c2nc([C@@H]3CCOC4(CCCC4)C3)no2)c([O-])c1 ZINC000897187294 1029525491 /nfs/dbraw/zinc/52/54/91/1029525491.db2.gz SPQQMEASCHISNA-CQSZACIVSA-N -1 3 328.412 4.211 20 0 EIADHM CC1(C)CN([C@@H](C(=O)[O-])c2cccc(Cl)c2)CC[C@@H]1C(F)(F)F ZINC000584178024 1029661517 /nfs/dbraw/zinc/66/15/17/1029661517.db2.gz XQOJQGKWLMMIAK-QWHCGFSZSA-N -1 3 349.780 4.376 20 0 EIADHM CC1(C)CN([C@@H](C(=O)[O-])c2cccc(Cl)c2)CC[C@H]1C(F)(F)F ZINC000584178022 1029662119 /nfs/dbraw/zinc/66/21/19/1029662119.db2.gz XQOJQGKWLMMIAK-CHWSQXEVSA-N -1 3 349.780 4.376 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(NC[C@@H]3CCC[C@H](C)C3)nc2)n1 ZINC000301191734 1029684124 /nfs/dbraw/zinc/68/41/24/1029684124.db2.gz ZXZCFIGSUJOOSE-UONOGXRCSA-N -1 3 326.444 4.045 20 0 EIADHM O=C([N-]c1cc(F)ccc1F)c1c(F)ccc(Br)c1F ZINC000447105300 1029696981 /nfs/dbraw/zinc/69/69/81/1029696981.db2.gz GEJKJCYGLHPHDO-UHFFFAOYSA-N -1 3 348.093 4.258 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@H]3CCC[C@@H](CC)C3)nc2)n1 ZINC000301353764 1029715816 /nfs/dbraw/zinc/71/58/16/1029715816.db2.gz MIPRHZCLBWHJDO-CJNGLKHVSA-N -1 3 326.444 4.187 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(NCCc3cc(C)cc(C)c3)nc2)n1 ZINC000301369743 1029718726 /nfs/dbraw/zinc/71/87/26/1029718726.db2.gz SJFDXMVMCQFXOP-UHFFFAOYSA-N -1 3 348.450 4.078 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(NCC3(CC(C)C)CC3)nc2)n1 ZINC000301602899 1029771178 /nfs/dbraw/zinc/77/11/78/1029771178.db2.gz KPWOWYUTFYWCQU-UHFFFAOYSA-N -1 3 326.444 4.045 20 0 EIADHM Cc1ccc2ncnc(NCc3ccc([O-])c(Br)c3)c2c1 ZINC000301698377 1029791888 /nfs/dbraw/zinc/79/18/88/1029791888.db2.gz OJSPLBBQVRHYCX-UHFFFAOYSA-N -1 3 344.212 4.018 20 0 EIADHM Cc1ccc(Cl)c(S(=O)(=O)[N-]CC(C2CC2)C2CC2)c1Cl ZINC000525701427 1029930590 /nfs/dbraw/zinc/93/05/90/1029930590.db2.gz QYOXMZRPGUGVGW-UHFFFAOYSA-N -1 3 348.295 4.016 20 0 EIADHM Cc1cccc(S(=O)(=O)[N-]c2ccc(-c3ccco3)cc2F)c1 ZINC000447264680 1029950041 /nfs/dbraw/zinc/95/00/41/1029950041.db2.gz NFUDZDFSFLFVOI-UHFFFAOYSA-N -1 3 331.368 4.195 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N3CC[C@H](CC(C)(C)C)C3)nc2)n1 ZINC000450943698 1030123587 /nfs/dbraw/zinc/12/35/87/1030123587.db2.gz IKYYBNAHYWNOOV-CQSZACIVSA-N -1 3 340.471 4.069 20 0 EIADHM C[C@H]1CC(C(=O)[O-])C[C@H](C)N1Cc1coc(-c2ccc(Cl)cc2)n1 ZINC000530178994 1030201128 /nfs/dbraw/zinc/20/11/28/1030201128.db2.gz KHVKOBBMTSVCTB-RYUDHWBXSA-N -1 3 348.830 4.069 20 0 EIADHM COc1ccccc1[C@H](NCc1cc([O-])cc(F)c1)c1ccco1 ZINC000185583664 1030207298 /nfs/dbraw/zinc/20/72/98/1030207298.db2.gz FASMTVWKTLOZAH-IBGZPJMESA-N -1 3 327.355 4.012 20 0 EIADHM CC[C@@H](CC1CCCC1)C(=O)OCc1noc(-c2ccccc2[O-])n1 ZINC000783673831 1030307985 /nfs/dbraw/zinc/30/79/85/1030307985.db2.gz OPDWKVRJZNUJJQ-AWEZNQCLSA-N -1 3 344.411 4.092 20 0 EIADHM CC[C@H](CC1CCCC1)C(=O)OCc1noc(-c2ccccc2[O-])n1 ZINC000783673833 1030310396 /nfs/dbraw/zinc/31/03/96/1030310396.db2.gz OPDWKVRJZNUJJQ-CQSZACIVSA-N -1 3 344.411 4.092 20 0 EIADHM CCc1cccc(C(=O)N2C[C@H](c3ccc(F)cc3)C[C@@H]2C)c1[O-] ZINC000530719669 1030670794 /nfs/dbraw/zinc/67/07/94/1030670794.db2.gz SVCOQQXEKATLMQ-XJKSGUPXSA-N -1 3 327.399 4.112 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1cccc(C(=O)c2ccco2)c1 ZINC001137701683 1030703494 /nfs/dbraw/zinc/70/34/94/1030703494.db2.gz HFSDBFVOQAHWKS-UHFFFAOYSA-N -1 3 341.750 4.122 20 0 EIADHM CSc1ccc([O-])c(C(=O)N(Cc2ccccc2F)C(C)C)c1 ZINC001625961249 1030759408 /nfs/dbraw/zinc/75/94/08/1030759408.db2.gz LGMIRQVMXLPGMN-UHFFFAOYSA-N -1 3 333.428 4.304 20 0 EIADHM Cc1nc(-c2ccccc2)sc1C(=O)Nc1cc(F)ccc1[O-] ZINC000530895989 1030787185 /nfs/dbraw/zinc/78/71/85/1030787185.db2.gz WXXZBZIMBJPZTQ-UHFFFAOYSA-N -1 3 328.368 4.216 20 0 EIADHM C[C@@H](CC(=O)Nc1cc(Br)ccc1[O-])c1ccccc1 ZINC000531393968 1031166891 /nfs/dbraw/zinc/16/68/91/1031166891.db2.gz PDSCQXKEPUFDPP-NSHDSACASA-N -1 3 334.213 4.287 20 0 EIADHM O=[S@](Cc1ncc(-c2cccc(Cl)c2)o1)c1ccc([O-])cc1 ZINC000108083111 1031286456 /nfs/dbraw/zinc/28/64/56/1031286456.db2.gz MXAAAAQMRFUJLW-QFIPXVFZSA-N -1 3 333.796 4.008 20 0 EIADHM CC(=O)N(Cc1ccc(NCc2c([O-])cccc2Cl)cc1)C1CC1 ZINC000150936794 1031317948 /nfs/dbraw/zinc/31/79/48/1031317948.db2.gz IMHLLFSLQVFTBA-UHFFFAOYSA-N -1 3 344.842 4.169 20 0 EIADHM CC(C)C(=O)c1ccc(NC(=O)CCCc2ccc([O-])c(F)c2)cc1 ZINC000452970077 1031453235 /nfs/dbraw/zinc/45/32/35/1031453235.db2.gz FIANJYYSVIYGMQ-UHFFFAOYSA-N -1 3 343.398 4.331 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N1CCC(Cc2cccnc2)CC1 ZINC000375919473 1031510485 /nfs/dbraw/zinc/51/04/85/1031510485.db2.gz NRGLXONITKZYPK-UHFFFAOYSA-N -1 3 346.430 4.035 20 0 EIADHM CC(C)COc1ccccc1-c1noc(Cc2ccc([O-])c(F)c2)n1 ZINC000453087405 1031575695 /nfs/dbraw/zinc/57/56/95/1031575695.db2.gz PKWKTAYSBDBEIW-UHFFFAOYSA-N -1 3 342.370 4.207 20 0 EIADHM O=C([N-]c1n[nH]c(-c2ccccc2F)n1)c1occc1-c1ccccc1 ZINC000500921623 1034161112 /nfs/dbraw/zinc/16/11/12/1034161112.db2.gz GBBQUCFPWAUEOS-UHFFFAOYSA-N -1 3 348.337 4.123 20 0 EIADHM O=C(Nc1cccc(Nc2ccccc2)c1)c1cc(F)cc2n[n-]nc21 ZINC000433344968 1034252404 /nfs/dbraw/zinc/25/24/04/1034252404.db2.gz VKPDXCSBERVCDJ-UHFFFAOYSA-N -1 3 347.353 4.093 20 0 EIADHM C[C@@H](c1ccc(OC(F)F)cc1)N1Cc2ccccc2[C@@H](C(=O)[O-])C1 ZINC000327504949 1034645888 /nfs/dbraw/zinc/64/58/88/1034645888.db2.gz LKLBYOYZABGDSD-SJCJKPOMSA-N -1 3 347.361 4.033 20 0 EIADHM C[C@@H]1CCN(C(=O)CCCc2ccc([O-])c(F)c2)c2ccccc21 ZINC000469096744 1034889436 /nfs/dbraw/zinc/88/94/36/1034889436.db2.gz VFKARWYJNITAJT-CQSZACIVSA-N -1 3 327.399 4.394 20 0 EIADHM Cc1ccc2oc([N-][C@H](c3nccn3C)c3ccccc3F)nc2c1 ZINC000513650439 1035078325 /nfs/dbraw/zinc/07/83/25/1035078325.db2.gz NGZCQFAJLRVJBY-KRWDZBQOSA-N -1 3 336.370 4.210 20 0 EIADHM Cc1ccc(-c2nc(-c3ccsc3C(F)(F)F)no2)c([O-])c1 ZINC000904922275 1035660995 /nfs/dbraw/zinc/66/09/95/1035660995.db2.gz CCYLZYUPPPHCLM-UHFFFAOYSA-N -1 3 326.299 4.498 20 0 EIADHM O=C(Nc1nnc(-c2cc3ccccc3o2)[n-]1)c1ccccc1Cl ZINC000485106576 1035708916 /nfs/dbraw/zinc/70/89/16/1035708916.db2.gz LJIZUYWKHWGBFI-UHFFFAOYSA-N -1 3 338.754 4.124 20 0 EIADHM O=C(Nc1n[n-]c(-c2cc3ccccc3o2)n1)c1ccccc1Cl ZINC000485106576 1035708937 /nfs/dbraw/zinc/70/89/37/1035708937.db2.gz LJIZUYWKHWGBFI-UHFFFAOYSA-N -1 3 338.754 4.124 20 0 EIADHM CC(C)c1ccc2occ(C(=O)N=c3cc(-c4cccnc4)[n-][nH]3)c2c1 ZINC000490952597 1035738320 /nfs/dbraw/zinc/73/83/20/1035738320.db2.gz RYWSGGSJESXXMX-UHFFFAOYSA-N -1 3 346.390 4.016 20 0 EIADHM CC(C)(C)Oc1ccc(-c2nc3cc(F)c(F)cc3c(=O)[n-]2)cc1 ZINC000485322556 1035822257 /nfs/dbraw/zinc/82/22/57/1035822257.db2.gz QTPBKRHPULPPJQ-UHFFFAOYSA-N -1 3 330.334 4.458 20 0 EIADHM CC(C)(C)Oc1ccc(-c2nc3ccc(Cl)cc3c(=O)[n-]2)cc1 ZINC000485351871 1035844811 /nfs/dbraw/zinc/84/48/11/1035844811.db2.gz SBQSESUUXOUYIP-UHFFFAOYSA-N -1 3 328.799 4.421 20 0 EIADHM O=S(=O)([N-]c1ccc(F)cc1F)c1ccc(Cl)cc1Cl ZINC000485403967 1035862694 /nfs/dbraw/zinc/86/26/94/1035862694.db2.gz KVYOQPYIGGRABE-UHFFFAOYSA-N -1 3 338.162 4.072 20 0 EIADHM COc1ccc(C(=O)N2CCC[C@@H]2c2cccc(Cl)c2)c([O-])c1 ZINC000195646864 1035875581 /nfs/dbraw/zinc/87/55/81/1035875581.db2.gz ZFYLXBLJHNPGCL-MRXNPFEDSA-N -1 3 331.799 4.032 20 0 EIADHM COc1ccc(C(=O)N2CCC[C@@H]2c2ccccc2Cl)c([O-])c1 ZINC000195703162 1035883001 /nfs/dbraw/zinc/88/30/01/1035883001.db2.gz HIVHWGZSJOFPFI-MRXNPFEDSA-N -1 3 331.799 4.032 20 0 EIADHM O=C(Nc1c[nH]nc1-c1ccccc1F)c1cc([O-])c2ccccc2c1 ZINC000513790434 1035914172 /nfs/dbraw/zinc/91/41/72/1035914172.db2.gz XYSXGSOOASRNRR-UHFFFAOYSA-N -1 3 347.349 4.327 20 0 EIADHM CSCC1(Cc2noc(-c3cc4ccccc4cc3[O-])n2)CC1 ZINC000596608753 1035923780 /nfs/dbraw/zinc/92/37/80/1035923780.db2.gz KEBJMBMMEFWWNV-UHFFFAOYSA-N -1 3 326.421 4.281 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1cnc2c(F)ccc(F)c2c1 ZINC000485504496 1035961760 /nfs/dbraw/zinc/96/17/60/1035961760.db2.gz LSZFFLLAIKYBOG-UHFFFAOYSA-N -1 3 334.709 4.124 20 0 EIADHM CCCCCC(C)(C)C(=O)OCc1noc(-c2ccccc2[O-])n1 ZINC000784068256 1036159037 /nfs/dbraw/zinc/15/90/37/1036159037.db2.gz VPEXOURWHNERLY-UHFFFAOYSA-N -1 3 332.400 4.092 20 0 EIADHM CCCCc1nc(NC(=O)CCCC2CCCC2)c(C(=O)OCC)[n-]1 ZINC001269124718 1036329214 /nfs/dbraw/zinc/32/92/14/1036329214.db2.gz WLNNZCOBPIGEPI-UHFFFAOYSA-N -1 3 349.475 4.228 20 0 EIADHM CCCCc1nc(NC(=O)[C@H]2CCC(C)=C(C)C2)c(C(=O)OCC)[n-]1 ZINC001269128160 1036348194 /nfs/dbraw/zinc/34/81/94/1036348194.db2.gz BPBOLQDKWZVXEL-AWEZNQCLSA-N -1 3 347.459 4.004 20 0 EIADHM O=C([O-])c1cccc(OCCN2CCC[C@H]2c2ccccc2Cl)c1 ZINC000572127694 1036438478 /nfs/dbraw/zinc/43/84/78/1036438478.db2.gz OOPISNJCIGYIRF-SFHVURJKSA-N -1 3 345.826 4.254 20 0 EIADHM CC(F)(F)CCC(=O)N=c1cc(-c2cc(Cl)cc(Cl)c2)[n-][nH]1 ZINC000589165857 1036681005 /nfs/dbraw/zinc/68/10/05/1036681005.db2.gz HQWHUVAGVIITRV-UHFFFAOYSA-N -1 3 348.180 4.179 20 0 EIADHM [O-]c1cccc(CN2CC3(CCOCC3)[C@@H]2c2ccccc2)c1Cl ZINC000414561683 1036879942 /nfs/dbraw/zinc/87/99/42/1036879942.db2.gz SHYJGHYGGLVTKZ-IBGZPJMESA-N -1 3 343.854 4.399 20 0 EIADHM CC[C@H](NC(=O)Nc1ccc(-c2cc(=O)[n-]c(C)n2)cc1)C(C)(C)C ZINC000591822846 1037608083 /nfs/dbraw/zinc/60/80/83/1037608083.db2.gz UGTWZIXTJGPKGF-INIZCTEOSA-N -1 3 342.443 4.104 20 0 EIADHM CCCCCSc1nc2c(cnn2-c2cccc(Cl)c2)c(=O)[n-]1 ZINC000605076803 1037652551 /nfs/dbraw/zinc/65/25/51/1037652551.db2.gz FLWWNBZRHCRZLW-UHFFFAOYSA-N -1 3 348.859 4.457 20 0 EIADHM CC[C@@H](NCc1nc(-c2cc(Cl)ccc2Cl)cs1)C(=O)[O-] ZINC000414685843 1037814370 /nfs/dbraw/zinc/81/43/70/1037814370.db2.gz UNJXTYRASFEMDA-LLVKDONJSA-N -1 3 345.251 4.070 20 0 EIADHM CCc1cccc(CC)c1S(=O)(=O)[N-]c1ccc(F)c(F)c1F ZINC000605492972 1037822109 /nfs/dbraw/zinc/82/21/09/1037822109.db2.gz QVCJSURRXLAFGT-UHFFFAOYSA-N -1 3 343.370 4.030 20 0 EIADHM Cc1ccccc1C1CC(N(Cc2cc(C(=O)[O-])co2)C2CC2)C1 ZINC000574093889 1037935978 /nfs/dbraw/zinc/93/59/78/1037935978.db2.gz WGTDKAJRCUGHDH-UHFFFAOYSA-N -1 3 325.408 4.197 20 0 EIADHM Cc1cccc(CN(C)Cc2cc(F)c([O-])c(Br)c2)c1 ZINC001232630159 1038119576 /nfs/dbraw/zinc/11/95/76/1038119576.db2.gz KVCOMXIXCSCFNJ-UHFFFAOYSA-N -1 3 338.220 4.234 20 0 EIADHM Cc1nnsc1C(=O)[N-]c1c(F)cccc1Oc1ccccc1 ZINC000489870128 1038254072 /nfs/dbraw/zinc/25/40/72/1038254072.db2.gz IPQIMZASBYZJQN-UHFFFAOYSA-N -1 3 329.356 4.030 20 0 EIADHM Cc1cc([C@@H](C)N2CC[C@@H](c3c(F)cccc3F)C2)oc1C(=O)[O-] ZINC000574524882 1038288118 /nfs/dbraw/zinc/28/81/18/1038288118.db2.gz KDLIARKEFABJAP-VXGBXAGGSA-N -1 3 335.350 4.115 20 0 EIADHM Cc1oc(-c2cccs2)nc1C(=O)[N-]c1ccc([N+](=O)[O-])cc1F ZINC000063446689 1038328108 /nfs/dbraw/zinc/32/81/08/1038328108.db2.gz LXKYTRMHBVBZRO-UHFFFAOYSA-N -1 3 347.327 4.011 20 0 EIADHM O=C([O-])CC[C@@H]1CCCCN1Cc1csc(-c2ccc(F)cc2)n1 ZINC000424268381 1038763530 /nfs/dbraw/zinc/76/35/30/1038763530.db2.gz ZYCCCKINPWCIBG-INIZCTEOSA-N -1 3 348.443 4.169 20 0 EIADHM CSCc1ccc([N-]S(=O)(=O)c2ccc3c(c2)CCCC3)cc1 ZINC000608955628 1038991137 /nfs/dbraw/zinc/99/11/37/1038991137.db2.gz HKOQMTZIVQHMDA-UHFFFAOYSA-N -1 3 347.505 4.229 20 0 EIADHM O=c1nc(COCc2ccccc2)[n-]c2sc(-c3ccccc3)cc21 ZINC000057771541 1038997896 /nfs/dbraw/zinc/99/78/96/1038997896.db2.gz QSJASMUSPMYJFQ-UHFFFAOYSA-N -1 3 348.427 4.368 20 0 EIADHM [O-]c1ccc(F)c(CNC[C@@H](Cc2ccccc2)C(F)(F)F)c1F ZINC000552051703 1039072057 /nfs/dbraw/zinc/07/20/57/1039072057.db2.gz CALOKRGZHALPEM-GFCCVEGCSA-N -1 3 345.311 4.181 20 0 EIADHM CC(C)(C)c1nnc([N-]C(=O)c2cc3cc(Cl)ccc3o2)s1 ZINC000615153125 1039080314 /nfs/dbraw/zinc/08/03/14/1039080314.db2.gz BTWAWQNCLYPINZ-UHFFFAOYSA-N -1 3 335.816 4.488 20 0 EIADHM O=C(NCC(F)(F)c1ccc(Cl)cc1)c1cc([O-])ccc1Cl ZINC000552380523 1039458062 /nfs/dbraw/zinc/45/80/62/1039458062.db2.gz WBTCFDHDRMLIKO-UHFFFAOYSA-N -1 3 346.160 4.221 20 0 EIADHM C[C@@H](Oc1ccc(F)cc1Cl)C(=O)Nc1c([O-])cccc1Cl ZINC000552434684 1039511352 /nfs/dbraw/zinc/51/13/52/1039511352.db2.gz VVQMVADIDASNPG-MRVPVSSYSA-N -1 3 344.169 4.244 20 0 EIADHM O=C(CCSc1ccccc1F)Nc1c([O-])cccc1Cl ZINC000552435388 1039516673 /nfs/dbraw/zinc/51/66/73/1039516673.db2.gz FACRLHCSOCFVMH-UHFFFAOYSA-N -1 3 325.792 4.306 20 0 EIADHM CCCCCN(C(=O)c1cc(NC(C)=O)ccc1[O-])[C@H](C)CCC ZINC000121995231 1039554146 /nfs/dbraw/zinc/55/41/46/1039554146.db2.gz PKGYYNZXXZFLRH-CQSZACIVSA-N -1 3 334.460 4.172 20 0 EIADHM O=C(Nc1ccc(Oc2cccnc2)cc1)c1cc([O-])ccc1Cl ZINC000552615985 1039713928 /nfs/dbraw/zinc/71/39/28/1039713928.db2.gz HLFLMAXGLNALAR-UHFFFAOYSA-N -1 3 340.766 4.485 20 0 EIADHM COc1cc(C)cc(C)c1S(=O)(=O)[N-]c1cc(C)ccc1Cl ZINC000434625765 1039748821 /nfs/dbraw/zinc/74/88/21/1039748821.db2.gz FRFHTSIUBAPURZ-UHFFFAOYSA-N -1 3 339.844 4.075 20 0 EIADHM CC1(C)C[C@@H](c2ccccc2)N(C(=O)Cc2ccc([O-])c(F)c2)C1 ZINC000425123449 1039780362 /nfs/dbraw/zinc/78/03/62/1039780362.db2.gz SHPRYJKGOCRTLX-KRWDZBQOSA-N -1 3 327.399 4.074 20 0 EIADHM Cc1nc(-c2ccccc2)oc1C(=O)Nc1c([O-])cccc1Cl ZINC000552780824 1039818015 /nfs/dbraw/zinc/81/80/15/1039818015.db2.gz RFFKYEPSARIRGB-UHFFFAOYSA-N -1 3 328.755 4.261 20 0 EIADHM O=C(Cc1ccc([O-])c(F)c1)N[C@H]1CC[C@@H](c2cccc(Cl)c2)C1 ZINC000457076754 1039829871 /nfs/dbraw/zinc/82/98/71/1039829871.db2.gz KZPBDYXSQROYAD-ZBFHGGJFSA-N -1 3 347.817 4.180 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)NCc1ccc(C2CC2)cc1 ZINC000481888614 1039887162 /nfs/dbraw/zinc/88/71/62/1039887162.db2.gz FGXJXLTYODZEMS-UHFFFAOYSA-N -1 3 327.399 4.048 20 0 EIADHM CC1(C)Cc2ccsc2CN1C(=O)CCCc1ccc([O-])c(F)c1 ZINC000457301311 1039909841 /nfs/dbraw/zinc/90/98/41/1039909841.db2.gz CHNFVCGDSNRUKP-UHFFFAOYSA-N -1 3 347.455 4.279 20 0 EIADHM Cc1csc(C(=O)Nc2cc(Br)ccc2[O-])c1Cl ZINC000478875491 1039992060 /nfs/dbraw/zinc/99/20/60/1039992060.db2.gz WLXYPTCAQULEOL-UHFFFAOYSA-N -1 3 346.633 4.430 20 0 EIADHM Cc1ccccc1CC(C)(C)[N-]S(=O)(=O)c1ccc(Cl)s1 ZINC000477003521 1040113905 /nfs/dbraw/zinc/11/39/05/1040113905.db2.gz LHSRJOMUGUGCDH-UHFFFAOYSA-N -1 3 343.901 4.010 20 0 EIADHM CC(C)c1nn(C)c2sc(C(=O)Nc3cc(Cl)ccc3[O-])cc12 ZINC000535440160 1040273360 /nfs/dbraw/zinc/27/33/60/1040273360.db2.gz FPJBEUYBPAZWFA-UHFFFAOYSA-N -1 3 349.843 4.370 20 0 EIADHM CC[C@@H](CC(F)F)C(=O)Nc1c(C)c(Br)ccc1[O-] ZINC000457840607 1040306463 /nfs/dbraw/zinc/30/64/63/1040306463.db2.gz HLZAZSUYNJQGBD-QMMMGPOBSA-N -1 3 336.176 4.083 20 0 EIADHM O=c1nc(COc2ccc3ccccc3c2)[n-]c2sc3c(c21)CCC3 ZINC000042138676 1040341481 /nfs/dbraw/zinc/34/14/81/1040341481.db2.gz XOHYSORUUHQADB-UHFFFAOYSA-N -1 3 348.427 4.206 20 0 EIADHM Cc1cccc(-c2nc(CC(=O)Nc3cccc([O-])c3F)cs2)c1 ZINC000551487046 1040343645 /nfs/dbraw/zinc/34/36/45/1040343645.db2.gz HCPNMSBOSNGOHO-UHFFFAOYSA-N -1 3 342.395 4.144 20 0 EIADHM O=C(N[C@H](C1CCCCC1)C(F)(F)F)c1cc([O-])ccc1Cl ZINC000551511775 1040361386 /nfs/dbraw/zinc/36/13/86/1040361386.db2.gz FJIXNVYZDWUDRI-CYBMUJFWSA-N -1 3 335.753 4.287 20 0 EIADHM CCc1cccc(C(=O)N(C)c2cccc(OC(F)(F)F)c2)c1[O-] ZINC000539890938 1040862542 /nfs/dbraw/zinc/86/25/42/1040862542.db2.gz WYMDJQYKGCOUJM-UHFFFAOYSA-N -1 3 339.313 4.130 20 0 EIADHM Cc1ccc([N-]S(=O)(=O)c2ccc(OC(C)C)c(C)c2)c(C)c1 ZINC000515614930 1040900746 /nfs/dbraw/zinc/90/07/46/1040900746.db2.gz JGGUDCBBTQRUCL-UHFFFAOYSA-N -1 3 333.453 4.200 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@@H](C)C3CCC(F)CC3)nc2)n1 ZINC000664538279 1041008248 /nfs/dbraw/zinc/00/82/48/1041008248.db2.gz BJTJRGXMAKOEFD-OPFPJEHXSA-N -1 3 344.434 4.135 20 0 EIADHM COc1ccc([O-])c(C(=O)N2C[C@H](c3ccccc3)c3ccccc32)c1 ZINC000436292911 1041060702 /nfs/dbraw/zinc/06/07/02/1041060702.db2.gz CUWHUFKRYUBGTA-LJQANCHMSA-N -1 3 345.398 4.193 20 0 EIADHM C[C@@H]1[C@H](C(=O)[N-][C@@H](c2ccc(F)c(Cl)c2)C(F)(F)F)C1(F)F ZINC000436445917 1041248010 /nfs/dbraw/zinc/24/80/10/1041248010.db2.gz CVJWZQKRELIQNZ-PDFZIDOMSA-N -1 3 345.670 4.100 20 0 EIADHM Cc1cc(C)c(/C=C/CNCc2cc(F)c(C(=O)[O-])c(F)c2)c(C)c1 ZINC000904017575 1041261126 /nfs/dbraw/zinc/26/11/26/1041261126.db2.gz LBYYHBROQHBTSE-SNAWJCMRSA-N -1 3 345.389 4.391 20 0 EIADHM Cc1cccc(Cl)c1[N-]S(=O)(=O)c1cnc2ccsc2c1 ZINC000461147857 1041262898 /nfs/dbraw/zinc/26/28/98/1041262898.db2.gz QGIGVZAVNVQNNX-UHFFFAOYSA-N -1 3 338.841 4.059 20 0 EIADHM C[C@@H](C(=O)[O-])[C@@H](NCc1ccc(C(F)(F)F)s1)c1ccccc1 ZINC000904005167 1041267531 /nfs/dbraw/zinc/26/75/31/1041267531.db2.gz PVPJAXQITYOARD-QMTHXVAHSA-N -1 3 343.370 4.319 20 0 EIADHM CC(C)CCC[C@H](NCc1c(Cl)cccc1OC(F)F)C(=O)[O-] ZINC000904035334 1041283257 /nfs/dbraw/zinc/28/32/57/1041283257.db2.gz CRTDDKSKAXKRHK-ZDUSSCGKSA-N -1 3 349.805 4.311 20 0 EIADHM CC(C)(C)c1nc(CN[C@H](CCc2ccccc2)CC(=O)[O-])cs1 ZINC000904038534 1041289713 /nfs/dbraw/zinc/28/97/13/1041289713.db2.gz NYOIWLPAHIINOL-OAHLLOKOSA-N -1 3 346.496 4.006 20 0 EIADHM O=C(Nc1ccc2nc(C(F)F)[nH]c2c1)c1cc(Cl)ccc1[O-] ZINC000436518119 1041324061 /nfs/dbraw/zinc/32/40/61/1041324061.db2.gz WWJPXFOJDWZJFW-UHFFFAOYSA-N -1 3 337.713 4.112 20 0 EIADHM CCC(=O)Nc1ccc(Cl)c(NC(=O)c2cc(CC)ccc2[O-])c1 ZINC000436544937 1041338103 /nfs/dbraw/zinc/33/81/03/1041338103.db2.gz FAASCCGKYANIPA-UHFFFAOYSA-N -1 3 346.814 4.209 20 0 EIADHM Cc1ccc(CO)cc1NC(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436593619 1041350993 /nfs/dbraw/zinc/35/09/93/1041350993.db2.gz FNNHZFORLSVRSQ-UHFFFAOYSA-N -1 3 349.386 4.238 20 0 EIADHM CC(C)c1ccc(C(=O)N(C[C@H]2CCCO2)C2CCCC2)c([O-])c1 ZINC000436581462 1041361065 /nfs/dbraw/zinc/36/10/65/1041361065.db2.gz FJNQDBOEGAEXBG-QGZVFWFLSA-N -1 3 331.456 4.079 20 0 EIADHM CC[C@H]1CCCC[C@@H]1c1noc(-c2cc(OC)c([O-])c(OC)c2)n1 ZINC000436588677 1041363077 /nfs/dbraw/zinc/36/30/77/1041363077.db2.gz ITKGXFRULQNRJW-AAEUAGOBSA-N -1 3 332.400 4.143 20 0 EIADHM CCc1ccc([O-])c(C(=O)Nc2cnn([C@H](C)CC)c2C2CC2)c1 ZINC000436601757 1041367274 /nfs/dbraw/zinc/36/72/74/1041367274.db2.gz KFNVMJOHSHVPLB-GFCCVEGCSA-N -1 3 327.428 4.252 20 0 EIADHM CN(Cc1ccc(F)cc1)C(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436605830 1041369019 /nfs/dbraw/zinc/36/90/19/1041369019.db2.gz GCUIIWOHAARYCR-UHFFFAOYSA-N -1 3 349.405 4.394 20 0 EIADHM COc1ccc(C(=O)N2CCC[C@@H]2CCCc2ccccc2)c([O-])c1 ZINC000436608348 1041371176 /nfs/dbraw/zinc/37/11/76/1041371176.db2.gz UJEMTMLBIWYCED-KRWDZBQOSA-N -1 3 339.435 4.028 20 0 EIADHM CCCC[C@@H](C)N(CCCC)C(=O)c1cc(NC(C)=O)ccc1[O-] ZINC000436709556 1041424585 /nfs/dbraw/zinc/42/45/85/1041424585.db2.gz OERYQSSPDOHMPA-CQSZACIVSA-N -1 3 334.460 4.172 20 0 EIADHM COc1cccc(C(=O)Nc2cc(Cl)ccc2OC(C)C)c1[O-] ZINC000436694383 1041427227 /nfs/dbraw/zinc/42/72/27/1041427227.db2.gz AORNKLPXJSZZDZ-UHFFFAOYSA-N -1 3 335.787 4.094 20 0 EIADHM Cc1[nH]c2ccccc2c1C1CCN(C(=O)c2ccccc2[O-])CC1 ZINC000436722111 1041443019 /nfs/dbraw/zinc/44/30/19/1041443019.db2.gz JOVVWBMMECULIP-UHFFFAOYSA-N -1 3 334.419 4.202 20 0 EIADHM CC(C)c1ccc(C(=O)N[C@@H](c2ccccc2)[C@H]2CCOC2)c([O-])c1 ZINC000436762284 1041459664 /nfs/dbraw/zinc/45/96/64/1041459664.db2.gz BVQAHWPLDGNNLC-PXNSSMCTSA-N -1 3 339.435 4.023 20 0 EIADHM CC(C)c1ccc(C(=O)N(C)CCCOc2ccc(F)cc2)c([O-])c1 ZINC000436781519 1041479578 /nfs/dbraw/zinc/47/95/78/1041479578.db2.gz UNPPHTJCCMKDNU-UHFFFAOYSA-N -1 3 345.414 4.196 20 0 EIADHM O=C(c1ccc(O)cc1[O-])N1CCCCC[C@H]1/C=C\c1cccs1 ZINC000436809438 1041491296 /nfs/dbraw/zinc/49/12/96/1041491296.db2.gz OSPFHHVUXDMMSL-LEJCZOIISA-N -1 3 343.448 4.258 20 0 EIADHM O=c1nc(-c2cc([O-])cc(F)c2)[nH]c2sc3c(c21)CCCCC3 ZINC000436829823 1041495798 /nfs/dbraw/zinc/49/57/98/1041495798.db2.gz UASXMKUYWDLGQM-UHFFFAOYSA-N -1 3 330.384 4.178 20 0 EIADHM CCc1ccc(-c2nc(Cc3ccc(OC(F)F)cc3)no2)c([O-])c1 ZINC000436835024 1041497920 /nfs/dbraw/zinc/49/79/20/1041497920.db2.gz SINFCJVTUXDTQW-UHFFFAOYSA-N -1 3 346.333 4.197 20 0 EIADHM CCc1ccc(-c2nc([C@@H](OC)c3cccc(Cl)c3)no2)c([O-])c1 ZINC000436863288 1041522646 /nfs/dbraw/zinc/52/26/46/1041522646.db2.gz IJCATENQVWCRIN-INIZCTEOSA-N -1 3 344.798 4.394 20 0 EIADHM Cc1ccc(-c2nc(-c3cc(OC(F)F)ccc3F)no2)c([O-])c1 ZINC000436864654 1041524039 /nfs/dbraw/zinc/52/40/39/1041524039.db2.gz OWWYDDVWNBRAPD-UHFFFAOYSA-N -1 3 336.269 4.158 20 0 EIADHM CC[C@H](NC(=O)c1ccc(C(C)=O)c([O-])c1)c1ccc(Cl)cc1 ZINC000436869612 1041527203 /nfs/dbraw/zinc/52/72/03/1041527203.db2.gz NAHYGEAAWIZUCC-INIZCTEOSA-N -1 3 331.799 4.129 20 0 EIADHM CCc1ccc(-c2nc([C@H]3CSc4ccccc4O3)no2)c([O-])c1 ZINC000436879330 1041537322 /nfs/dbraw/zinc/53/73/22/1041537322.db2.gz GFJQAVHBADWRAQ-OAHLLOKOSA-N -1 3 340.404 4.230 20 0 EIADHM COc1ccc([O-])c(C(=O)N(CC(C)C)c2ccc(Cl)cc2)c1 ZINC000538782002 1041542725 /nfs/dbraw/zinc/54/27/25/1041542725.db2.gz KANZVHOAVFODOU-UHFFFAOYSA-N -1 3 333.815 4.357 20 0 EIADHM Cc1noc(-c2ccccc2)c1NC(=O)c1cc2c(cc1[O-])CCCC2 ZINC000436910244 1041548180 /nfs/dbraw/zinc/54/81/80/1041548180.db2.gz PEHWTZDOVOXLIM-UHFFFAOYSA-N -1 3 348.402 4.487 20 0 EIADHM COCc1ccc(-c2noc(-c3cc4ccccc4cc3[O-])n2)cc1 ZINC000436910029 1041548370 /nfs/dbraw/zinc/54/83/70/1041548370.db2.gz MUZKUZSWHJRPLB-UHFFFAOYSA-N -1 3 332.359 4.409 20 0 EIADHM O=C(c1ccc(O)cc1[O-])N1CCCC[C@H]1c1cccc(Cl)c1 ZINC000436913833 1041554250 /nfs/dbraw/zinc/55/42/50/1041554250.db2.gz ZLWHYJRZHZGYNK-INIZCTEOSA-N -1 3 331.799 4.119 20 0 EIADHM O=c1nc(-c2cc([O-])cc(Cl)c2)[nH]c2sc3c(c21)CCCC3 ZINC000436929008 1041562010 /nfs/dbraw/zinc/56/20/10/1041562010.db2.gz CSRSZIZCLDRLHE-UHFFFAOYSA-N -1 3 332.812 4.302 20 0 EIADHM CCC(C)(C)OCc1ccccc1NC(=O)c1cccc(OC)c1[O-] ZINC000436936320 1041565157 /nfs/dbraw/zinc/56/51/57/1041565157.db2.gz BCCWDPLYVAYHNA-UHFFFAOYSA-N -1 3 343.423 4.358 20 0 EIADHM CCCCOc1ccc(C(=O)N(CC)CCc2cccs2)c([O-])c1 ZINC000436971590 1041576533 /nfs/dbraw/zinc/57/65/33/1041576533.db2.gz KSXCHTQGOWMNKI-UHFFFAOYSA-N -1 3 347.480 4.337 20 0 EIADHM Cc1ccc(C(=O)N2CCC(c3ccc(Cl)cc3)CC2)c([O-])c1 ZINC000436979169 1041578925 /nfs/dbraw/zinc/57/89/25/1041578925.db2.gz LANIVNLKVRSUID-UHFFFAOYSA-N -1 3 329.827 4.374 20 0 EIADHM CCOc1c(Cl)cc(-c2noc(-c3ccccc3[O-])n2)cc1OC ZINC000436995127 1041585443 /nfs/dbraw/zinc/58/54/43/1041585443.db2.gz HGEBFUOJSZSGOO-UHFFFAOYSA-N -1 3 346.770 4.170 20 0 EIADHM CSc1ccc(S(=O)(=O)[N-]c2cccc(C)c2F)cc1Cl ZINC000463799948 1041762176 /nfs/dbraw/zinc/76/21/76/1041762176.db2.gz ZAHBRACQEYJNPH-UHFFFAOYSA-N -1 3 345.848 4.310 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@@H]3CC[C@H](C)[C@H](C)C3)nc2)n1 ZINC000541593779 1042026391 /nfs/dbraw/zinc/02/63/91/1042026391.db2.gz ACLDDRIOAVJBRF-WOSRLPQWSA-N -1 3 326.444 4.043 20 0 EIADHM C[C@H]1C[C@H](c2ccccc2)CCN1C(=O)NCc1ccc([O-])c(F)c1 ZINC000542184829 1042324345 /nfs/dbraw/zinc/32/43/45/1042324345.db2.gz FTXRKAJAJSWZGJ-WMLDXEAASA-N -1 3 342.414 4.009 20 0 EIADHM COc1ccc(S(=O)(=O)[N-]c2cccc(-c3cccs3)c2)cc1 ZINC000509576854 1042385808 /nfs/dbraw/zinc/38/58/08/1042385808.db2.gz IHCPWIWQVOKDDT-UHFFFAOYSA-N -1 3 345.445 4.225 20 0 EIADHM O=S(=O)([N-]c1ccccc1F)c1cccc(-c2ccccc2)c1 ZINC000506586164 1042640529 /nfs/dbraw/zinc/64/05/29/1042640529.db2.gz YXQFXWZQPJHPHD-UHFFFAOYSA-N -1 3 327.380 4.294 20 0 EIADHM Cc1cc(C)cc(-c2cc(=NC(=O)c3c(F)cccc3Cl)[nH][n-]2)c1 ZINC000439560095 1042690727 /nfs/dbraw/zinc/69/07/27/1042690727.db2.gz HFCBLVAURIZNOZ-UHFFFAOYSA-N -1 3 343.789 4.160 20 0 EIADHM CC(C)c1ccc(C(=O)NCc2coc(-c3ccccc3)n2)c([O-])c1 ZINC000439868566 1042796076 /nfs/dbraw/zinc/79/60/76/1042796076.db2.gz YAIXVVPBJAAOGI-UHFFFAOYSA-N -1 3 336.391 4.101 20 0 EIADHM C[C@H]1C[C@@H]1c1ccc(CNCc2cccc([O-])c2Br)o1 ZINC000579444986 1042850446 /nfs/dbraw/zinc/85/04/46/1042850446.db2.gz MSHOHAGHSYBFRM-GWCFXTLKSA-N -1 3 336.229 4.161 20 0 EIADHM O=C(NCC1(c2ccccc2Cl)CC1)c1cc([O-])ccc1Cl ZINC000494062113 1043010658 /nfs/dbraw/zinc/01/06/58/1043010658.db2.gz DBMXCXTZCWOZOV-UHFFFAOYSA-N -1 3 336.218 4.161 20 0 EIADHM CC(C)c1nnc(C(=O)[N-]c2csc(-c3ccccc3)n2)s1 ZINC000672333064 1043121517 /nfs/dbraw/zinc/12/15/17/1043121517.db2.gz GLTFVRPIDNLMDN-UHFFFAOYSA-N -1 3 330.438 4.037 20 0 EIADHM CCc1noc(-c2ccc(C)c(NCc3cc([O-])cc(F)c3)c2)n1 ZINC000185600729 1043203975 /nfs/dbraw/zinc/20/39/75/1043203975.db2.gz RSEFAWWTLHBATP-UHFFFAOYSA-N -1 3 327.359 4.064 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N(CCC(F)(F)F)CC1CC1 ZINC000280169961 1043211992 /nfs/dbraw/zinc/21/19/92/1043211992.db2.gz CGWMIQAUPOVYLS-UHFFFAOYSA-N -1 3 337.341 4.350 20 0 EIADHM Cc1ccc(NCc2c(F)ccc([O-])c2F)c(OC[C@@H]2CCCO2)c1 ZINC000509185185 1043238644 /nfs/dbraw/zinc/23/86/44/1043238644.db2.gz OZVUKSCJLHXOIC-ZDUSSCGKSA-N -1 3 349.377 4.149 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N1CCOC2(C1)CCCCCC2 ZINC000526918002 1043245363 /nfs/dbraw/zinc/24/53/63/1043245363.db2.gz CXXKMZUNXHBIJF-UHFFFAOYSA-N -1 3 339.435 4.111 20 0 EIADHM O=C(N[C@@H]1CCO[C@@H](c2ccccc2)C1)c1cc([O-])c2ccccc2c1 ZINC000526924234 1043245682 /nfs/dbraw/zinc/24/56/82/1043245682.db2.gz CMVQPHPTKPPJOI-WIYYLYMNSA-N -1 3 347.414 4.196 20 0 EIADHM C[C@@H](CCCC(F)(F)F)NC(=O)c1cc([O-])c2ccccc2c1 ZINC000526934810 1043246373 /nfs/dbraw/zinc/24/63/73/1043246373.db2.gz IDPOFAPLXIVDRC-NSHDSACASA-N -1 3 325.330 4.396 20 0 EIADHM CN(C)c1nc2cc(NC(=O)c3cc([O-])c4ccccc4c3)ccc2o1 ZINC000526918279 1043246534 /nfs/dbraw/zinc/24/65/34/1043246534.db2.gz MNFIWLSYTSZLFL-UHFFFAOYSA-N -1 3 347.374 4.005 20 0 EIADHM O=C(N[C@@H](c1ccccc1)[C@@H]1CCCO1)c1cc([O-])c2ccccc2c1 ZINC000527450145 1043261064 /nfs/dbraw/zinc/26/10/64/1043261064.db2.gz PVUKNIALENOKBG-SFTDATJTSA-N -1 3 347.414 4.196 20 0 EIADHM O=C(Nc1ccc(Cn2cccn2)cc1)c1cc([O-])c2ccccc2c1 ZINC000527451772 1043261563 /nfs/dbraw/zinc/26/15/63/1043261563.db2.gz RXCAYAURJSGSBU-UHFFFAOYSA-N -1 3 343.386 4.043 20 0 EIADHM Cc1nc(C)c([C@H](C)N(C)C(=O)c2cc([O-])c3ccccc3c2)s1 ZINC000280988344 1043262016 /nfs/dbraw/zinc/26/20/16/1043262016.db2.gz STALFCKEIDZVPP-LBPRGKRZSA-N -1 3 340.448 4.452 20 0 EIADHM C[C@H](NC(=O)c1cc([O-])c2ccccc2c1)c1ccc(Cl)cn1 ZINC000527469306 1043263014 /nfs/dbraw/zinc/26/30/14/1043263014.db2.gz RWKACHCIVUULGV-NSHDSACASA-N -1 3 326.783 4.085 20 0 EIADHM CCO[C@@H](CNC(=O)c1cc([O-])c2ccccc2c1)c1ccccc1 ZINC000527475125 1043263349 /nfs/dbraw/zinc/26/33/49/1043263349.db2.gz AHYCFYQAYHBTPB-FQEVSTJZSA-N -1 3 335.403 4.053 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)N1CCCC2(C1)CCCCCC2 ZINC000465983116 1043284242 /nfs/dbraw/zinc/28/42/42/1043284242.db2.gz QSSGUVUCEVKZOM-UHFFFAOYSA-N -1 3 334.435 4.177 20 0 EIADHM [O-]c1cccc(CN2CCC[C@H]2c2ccc3c(c2)OCO3)c1Cl ZINC000508194430 1043306275 /nfs/dbraw/zinc/30/62/75/1043306275.db2.gz LNOQKTNLDBWCQQ-AWEZNQCLSA-N -1 3 331.799 4.111 20 0 EIADHM Cc1[nH]c(S[C@@H](C)c2nc(C)cc(=O)[n-]2)nc1-c1ccccc1 ZINC000187154169 1043332622 /nfs/dbraw/zinc/33/26/22/1043332622.db2.gz PCLHKPDMZILXMT-LBPRGKRZSA-N -1 3 326.425 4.042 20 0 EIADHM Cc1cccc([N-]S(=O)(=O)c2ccc(CC(F)(F)F)cc2)c1F ZINC000189321135 1043539354 /nfs/dbraw/zinc/53/93/54/1043539354.db2.gz PVDDAPLORMBFDZ-UHFFFAOYSA-N -1 3 347.333 4.040 20 0 EIADHM O=S(=O)([N-]c1cc(Cl)cc(F)c1F)c1ccc(Cl)cc1 ZINC000442220662 1043574518 /nfs/dbraw/zinc/57/45/18/1043574518.db2.gz JYPLATPZDHFBAW-UHFFFAOYSA-N -1 3 338.162 4.072 20 0 EIADHM CSc1cc(O)ccc1[N-]C(=O)c1nc(C)oc1-c1ccccc1 ZINC000191550688 1043825165 /nfs/dbraw/zinc/82/51/65/1043825165.db2.gz MHKCUNQBWGRDKC-UHFFFAOYSA-N -1 3 340.404 4.330 20 0 EIADHM CC(C)(C)C[C@H](NC(=O)c1nnc2ccccc2c1[O-])c1ccccc1 ZINC000731869882 1043841968 /nfs/dbraw/zinc/84/19/68/1043841968.db2.gz QAFQFTCCBJVYPW-KRWDZBQOSA-N -1 3 349.434 4.243 20 0 EIADHM C[C@@H](Oc1c([O-])cc(Cl)cc1F)c1cccc(Br)n1 ZINC001234448550 1044054348 /nfs/dbraw/zinc/05/43/48/1044054348.db2.gz UQIFWRQLCLYUGJ-SSDOTTSWSA-N -1 3 346.583 4.482 20 0 EIADHM CC(C)C(=O)Nc1cccc(OC(=O)c2cc3ccsc3[n-]2)c1 ZINC000733170873 1044124895 /nfs/dbraw/zinc/12/48/95/1044124895.db2.gz MFGKUFHULDSCSY-UHFFFAOYSA-N -1 3 328.393 4.043 20 0 EIADHM C[C@@H](c1ccc(Br)cc1)N1CCC[C@@H](CCC(=O)[O-])C1 ZINC000226454723 1044211651 /nfs/dbraw/zinc/21/16/51/1044211651.db2.gz WOKPHXNLUKKFIN-STQMWFEESA-N -1 3 340.261 4.087 20 0 EIADHM O=[S@](c1ccc([O-])cc1)[C@@H]1CCc2c1cc(Cl)cc2Cl ZINC000443391984 1044245542 /nfs/dbraw/zinc/24/55/42/1044245542.db2.gz IZWDRRSLAYAVER-FOIQADDNSA-N -1 3 327.232 4.494 20 0 EIADHM O=C(CCc1ncc(-c2ccccc2)o1)Nc1cc(Cl)ccc1[O-] ZINC000063803283 1044297933 /nfs/dbraw/zinc/29/79/33/1044297933.db2.gz IEGVBNBDNYPVHY-UHFFFAOYSA-N -1 3 342.782 4.272 20 0 EIADHM CCCc1ccc(-c2nc([N-]C(=O)c3nonc3C)sc2C)cc1 ZINC000733874281 1044322244 /nfs/dbraw/zinc/32/22/44/1044322244.db2.gz NRSBMFCKVSNYCL-UHFFFAOYSA-N -1 3 342.424 4.015 20 0 EIADHM Cc1ccc([O-])c(C(=O)Nc2ccc(NC(=O)OC(C)(C)C)cc2)c1 ZINC000729536416 1044342213 /nfs/dbraw/zinc/34/22/13/1044342213.db2.gz YKOUIAVGJPMKMU-UHFFFAOYSA-N -1 3 342.395 4.300 20 0 EIADHM C[C@H](c1ccncc1)N(C)C(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000094067878 1044503452 /nfs/dbraw/zinc/50/34/52/1044503452.db2.gz YBNMGTXXQAMRJN-MRXNPFEDSA-N -1 3 346.430 4.211 20 0 EIADHM C[C@H](OC(=O)c1cc2ccsc2[n-]1)C(=O)c1ccc(Cl)cc1 ZINC000914889589 1044852024 /nfs/dbraw/zinc/85/20/24/1044852024.db2.gz JHHYKTIQAUPIQT-VIFPVBQESA-N -1 3 333.796 4.311 20 0 EIADHM Cc1cc(C)cc(NC(=O)[C@@H](C)OC(=O)c2cc3ccsc3[n-]2)c1 ZINC000914890444 1044852525 /nfs/dbraw/zinc/85/25/25/1044852525.db2.gz GJNJHWDDHOJGLP-GFCCVEGCSA-N -1 3 342.420 4.030 20 0 EIADHM COc1ccc([O-])c(-c2nc(-c3cc(Cl)cc(Cl)c3)no2)c1 ZINC000389191774 1044935835 /nfs/dbraw/zinc/93/58/35/1044935835.db2.gz VKOHHAHHNRQZFE-UHFFFAOYSA-N -1 3 337.162 4.425 20 0 EIADHM CCCc1nnc([N-]C(=O)c2csc(-c3ccc(F)cc3)n2)s1 ZINC000096949022 1044957540 /nfs/dbraw/zinc/95/75/40/1044957540.db2.gz PKYNOWVZNRBYON-UHFFFAOYSA-N -1 3 348.428 4.006 20 0 EIADHM CCCOc1ccc(NC(=O)CCCc2ccc([O-])c(F)c2)cc1 ZINC000469814967 1045010826 /nfs/dbraw/zinc/01/08/26/1045010826.db2.gz YPERWCQMQVKGNM-UHFFFAOYSA-N -1 3 331.387 4.282 20 0 EIADHM CSc1ccc(CO[N-]C(=O)Cc2cccc3ccccc32)cc1 ZINC000738295374 1045056809 /nfs/dbraw/zinc/05/68/09/1045056809.db2.gz WPDZVAJJEOYRJE-UHFFFAOYSA-N -1 3 337.444 4.352 20 0 EIADHM CCn1c2ccccc2nc1[C@H]1CCCN1C(=O)c1c(C)cccc1[O-] ZINC000625067471 1045066435 /nfs/dbraw/zinc/06/64/35/1045066435.db2.gz OYXDVGOGZWXVIK-QGZVFWFLSA-N -1 3 349.434 4.048 20 0 EIADHM [O-]c1cccc(CN(CCCO)Cc2cccc(Cl)c2)c1Cl ZINC000509083867 1045087970 /nfs/dbraw/zinc/08/79/70/1045087970.db2.gz NFQSCEBCYZZOSP-UHFFFAOYSA-N -1 3 340.250 4.084 20 0 EIADHM CC[C@]1(C(=O)[O-])CCCN(Cc2csc(-c3ccccc3F)n2)C1 ZINC000923471477 1045122422 /nfs/dbraw/zinc/12/24/22/1045122422.db2.gz REFIDINOBVMPRV-SFHVURJKSA-N -1 3 348.443 4.026 20 0 EIADHM CC[C@@]1(C(=O)[O-])CCCN(Cc2csc(-c3ccc(F)cc3)n2)C1 ZINC000923472994 1045129078 /nfs/dbraw/zinc/12/90/78/1045129078.db2.gz YQARQBXOGACYBJ-GOSISDBHSA-N -1 3 348.443 4.026 20 0 EIADHM Cc1c(Cl)c(CN2CCCC[C@@H]2CC(=O)[O-])nc2ccccc12 ZINC000390901336 1045202024 /nfs/dbraw/zinc/20/20/24/1045202024.db2.gz QRYXTVAHYCHGIE-CYBMUJFWSA-N -1 3 332.831 4.026 20 0 EIADHM CC[C@H]([N-]C(=O)C(F)(F)c1ccccc1)c1cc(F)ccc1F ZINC000740798494 1045222695 /nfs/dbraw/zinc/22/26/95/1045222695.db2.gz AGDFQFIYDWKWCW-HNNXBMFYSA-N -1 3 325.305 4.324 20 0 EIADHM S=c1[n-]nc(Cc2cccs2)n1CN1CCC2(CCCC2)CC1 ZINC000153584795 1045303130 /nfs/dbraw/zinc/30/31/30/1045303130.db2.gz UPEKSNASOGWVLE-UHFFFAOYSA-N -1 3 348.541 4.207 20 0 EIADHM Cc1ccccc1[C@@H](C)NCc1cc(=O)oc2cc([O-])c(Cl)cc12 ZINC000915870795 1045523335 /nfs/dbraw/zinc/52/33/35/1045523335.db2.gz OWWNWQKHIWZPBJ-GFCCVEGCSA-N -1 3 343.810 4.311 20 0 EIADHM O=C1[N-]C(=O)C(=CNc2cc(C(F)F)ccc2Cl)c2ccccc21 ZINC000767693547 1045597132 /nfs/dbraw/zinc/59/71/32/1045597132.db2.gz UHHZOSJIUBBEHU-WQLSENKSSA-N -1 3 348.736 4.001 20 0 EIADHM Cc1cc(=O)[n-]c(CS[C@H](C)c2ccc(Br)cc2)n1 ZINC000763207916 1045742658 /nfs/dbraw/zinc/74/26/58/1045742658.db2.gz FKGZQWMSMWMQJB-SNVBAGLBSA-N -1 3 339.258 4.248 20 0 EIADHM CC[C@@](C)(NC(=O)c1cc2sccc2c([O-])c1)c1nc(C)cs1 ZINC000791369699 1045726995 /nfs/dbraw/zinc/72/69/95/1045726995.db2.gz BRYWCVVRWJXLLY-QGZVFWFLSA-N -1 3 346.477 4.427 20 0 EIADHM Cc1cnc(C(C)(C)NC(=O)c2cc3sccc3c([O-])c2)s1 ZINC000791380058 1045727062 /nfs/dbraw/zinc/72/70/62/1045727062.db2.gz MZAZKPXGMJJZHK-UHFFFAOYSA-N -1 3 332.450 4.037 20 0 EIADHM CCC(CC)[C@@H]1C[C@H](NC(=O)c2cc3sccc3c([O-])c2)CCO1 ZINC000791398023 1045735199 /nfs/dbraw/zinc/73/51/99/1045735199.db2.gz FPVYGPDTFREPEF-PBHICJAKSA-N -1 3 347.480 4.321 20 0 EIADHM CCC(CC)[C@@H]1C[C@@H](NC(=O)c2cc3sccc3c([O-])c2)CCO1 ZINC000791398026 1045736817 /nfs/dbraw/zinc/73/68/17/1045736817.db2.gz FPVYGPDTFREPEF-YOEHRIQHSA-N -1 3 347.480 4.321 20 0 EIADHM Cc1cc(C)n(-c2ccc(C(=O)Nc3cc(Cl)ccc3[O-])cc2)n1 ZINC000069693128 1045764222 /nfs/dbraw/zinc/76/42/22/1045764222.db2.gz UUHBPTPCYPUEGE-UHFFFAOYSA-N -1 3 341.798 4.100 20 0 EIADHM CC(C)(C)[C@@H](NC(=O)c1cc(=O)c2ccccc2[n-]1)c1ccccc1 ZINC000056081426 1045779847 /nfs/dbraw/zinc/77/98/47/1045779847.db2.gz RLOAELLRKNCAHL-IBGZPJMESA-N -1 3 334.419 4.045 20 0 EIADHM CCCOc1ccc(NCc2cc(=O)oc3c(C)c([O-])ccc23)cc1 ZINC000768301665 1045783232 /nfs/dbraw/zinc/78/32/32/1045783232.db2.gz GWKBRBMPYIHWJX-UHFFFAOYSA-N -1 3 339.391 4.208 20 0 EIADHM [O-]c1ccc(Nc2nc(Cl)ccc2Br)c(F)c1F ZINC001212002901 1045821981 /nfs/dbraw/zinc/82/19/81/1045821981.db2.gz JPFMKKRCFNNNRV-UHFFFAOYSA-N -1 3 335.535 4.225 20 0 EIADHM [O-]c1ccc(Nc2ccccc2I)c(F)c1F ZINC001212007579 1045828020 /nfs/dbraw/zinc/82/80/20/1045828020.db2.gz OQTMKOOJIYKOEH-UHFFFAOYSA-N -1 3 347.102 4.019 20 0 EIADHM Cc1cc(N)c(Nc2ccc([O-])c(F)c2F)c(Br)c1 ZINC001212011068 1045832242 /nfs/dbraw/zinc/83/22/42/1045832242.db2.gz PQEBZNMVIWZAJM-UHFFFAOYSA-N -1 3 329.144 4.067 20 0 EIADHM Fc1cccc([N-]c2nonc2C2CC2)c1OCc1ccccc1 ZINC001212019040 1045836432 /nfs/dbraw/zinc/83/64/32/1045836432.db2.gz KKRSYRRJYYZFSV-UHFFFAOYSA-N -1 3 325.343 4.409 20 0 EIADHM CC(C)n1cc2c(n1)[C@H](NC(=O)c1cc([O-])c3ccccc3c1)CCC2 ZINC000792308042 1045888341 /nfs/dbraw/zinc/88/83/41/1045888341.db2.gz UPOPDHYBNTXYCV-GOSISDBHSA-N -1 3 349.434 4.130 20 0 EIADHM CC[C@@H](C)Oc1ccccc1/C=C/C(=O)NCc1ccc([O-])c(F)c1 ZINC000769554780 1046019846 /nfs/dbraw/zinc/01/98/46/1046019846.db2.gz LUGKQKYLTVJNIE-CFRMROPGSA-N -1 3 343.398 4.038 20 0 EIADHM Cc1coc(C)c1C(=O)O[C@@H](C)c1nc(=O)c2c(C)c(C)sc2[n-]1 ZINC000792759174 1046063244 /nfs/dbraw/zinc/06/32/44/1046063244.db2.gz XSYINODNBVSLKY-JTQLQIEISA-N -1 3 346.408 4.142 20 0 EIADHM COc1ccc(N(C(=O)c2ccc(C)cc2[O-])[C@@H](C)C2CC2)cc1 ZINC000124611133 1046251009 /nfs/dbraw/zinc/25/10/09/1046251009.db2.gz LNIOCYLEPTWBEB-AWEZNQCLSA-N -1 3 325.408 4.155 20 0 EIADHM CCc1cccc(S(=O)(=O)[N-]c2c(F)cccc2NC(C)C)c1 ZINC000124894102 1046271763 /nfs/dbraw/zinc/27/17/63/1046271763.db2.gz XZRYJMJBXOXSIJ-UHFFFAOYSA-N -1 3 336.432 4.009 20 0 EIADHM O=C([O-])[C@@H]1C[C@H]2CCCC[C@@H]2N1Cc1csc(Cl)c1Cl ZINC000263454823 1046292596 /nfs/dbraw/zinc/29/25/96/1046292596.db2.gz ANPWSXLAYGWPLK-MIMYLULJSA-N -1 3 334.268 4.273 20 0 EIADHM O=C(CCC(=O)c1ccccc1)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000125255771 1046293709 /nfs/dbraw/zinc/29/37/09/1046293709.db2.gz PQMZEPAWIGXIBU-UHFFFAOYSA-N -1 3 337.297 4.013 20 0 EIADHM Cc1cc(=O)[n-]c(-c2ccc(NC(=O)c3ccc(C(C)C)cc3)cc2)n1 ZINC000064446717 1046301711 /nfs/dbraw/zinc/30/17/11/1046301711.db2.gz CMSCXEGHRVKUMG-UHFFFAOYSA-N -1 3 347.418 4.121 20 0 EIADHM CCC(CC)n1ccc(COC(=O)c2cc(Cl)c(Cl)[n-]2)n1 ZINC000771324467 1046372485 /nfs/dbraw/zinc/37/24/85/1046372485.db2.gz DLMKFNTZAABGIL-UHFFFAOYSA-N -1 3 330.215 4.236 20 0 EIADHM CC(C)c1ccc(-c2nc(Cc3ccc4c[nH]nc4c3)no2)c([O-])c1 ZINC000771489797 1046416708 /nfs/dbraw/zinc/41/67/08/1046416708.db2.gz QRRFEKROUGSQJG-UHFFFAOYSA-N -1 3 334.379 4.033 20 0 EIADHM O=C(CCc1ccc(F)cc1)[N-]OCc1ccc(C(F)(F)F)cc1 ZINC000746523310 1046550648 /nfs/dbraw/zinc/55/06/48/1046550648.db2.gz RTBKNRICSHWFGC-UHFFFAOYSA-N -1 3 341.304 4.025 20 0 EIADHM [O-]c1cccc(CN[C@H]2CCCOc3ccccc32)c1Br ZINC000459420133 1046649724 /nfs/dbraw/zinc/64/97/24/1046649724.db2.gz XXBZTFJKFYWSBL-AWEZNQCLSA-N -1 3 348.240 4.158 20 0 EIADHM CCOc1cc(CNc2cc(F)ccc2OC)cc(Cl)c1[O-] ZINC000459442136 1046672522 /nfs/dbraw/zinc/67/25/22/1046672522.db2.gz OUTFGRWLKOZVRV-UHFFFAOYSA-N -1 3 325.767 4.204 20 0 EIADHM CCSc1cc(Cl)ccc1C(=O)NCc1ccc([O-])c(F)c1 ZINC000127532010 1046691222 /nfs/dbraw/zinc/69/12/22/1046691222.db2.gz DJSPZDGKCLECBA-UHFFFAOYSA-N -1 3 339.819 4.227 20 0 EIADHM CCOc1cc(CNc2ccccc2OCCF)cc(Cl)c1[O-] ZINC000459561511 1046777639 /nfs/dbraw/zinc/77/76/39/1046777639.db2.gz DZCQGWOOPXXNIZ-UHFFFAOYSA-N -1 3 339.794 4.405 20 0 EIADHM O=C(OCc1csc(-c2ccsc2)n1)c1cc2occc2[n-]1 ZINC000786032875 1046803758 /nfs/dbraw/zinc/80/37/58/1046803758.db2.gz FIUJVWUWFAKOCV-UHFFFAOYSA-N -1 3 330.390 4.303 20 0 EIADHM CCCC(C)(C)CC(=O)Oc1cccc(-c2nc(C)cc(=O)[n-]2)c1 ZINC000786424509 1046836296 /nfs/dbraw/zinc/83/62/96/1046836296.db2.gz LLLDCWKZKYQWOW-UHFFFAOYSA-N -1 3 328.412 4.279 20 0 EIADHM CSc1cc(F)ccc1[N-]C(=O)c1cc(F)c(F)c(F)c1F ZINC001130088451 1046852401 /nfs/dbraw/zinc/85/24/01/1046852401.db2.gz TYUXBKKGEUASLE-UHFFFAOYSA-N -1 3 333.281 4.356 20 0 EIADHM CC(C)(NC(=O)CCCc1ccc([O-])c(F)c1)c1ccc(F)cc1 ZINC000786888478 1046882530 /nfs/dbraw/zinc/88/25/30/1046882530.db2.gz KBQNZKPYAWXMPN-UHFFFAOYSA-N -1 3 333.378 4.045 20 0 EIADHM Cc1ccc(C(C)C)cc1O[C@H](C)C(=O)Nc1cccc([O-])c1F ZINC000128574498 1046959086 /nfs/dbraw/zinc/95/90/86/1046959086.db2.gz YPVHVWWSTPHCKF-CYBMUJFWSA-N -1 3 331.387 4.369 20 0 EIADHM CSc1cccc([C@@H]([N-]C(=O)C(F)F)c2cc(F)ccc2F)c1 ZINC000787397619 1047007473 /nfs/dbraw/zinc/00/74/73/1047007473.db2.gz WIKKOWFTHWDJNH-CQSZACIVSA-N -1 3 343.345 4.157 20 0 EIADHM O=C(Nc1cccc([O-])c1F)c1ccc(OC2CCCCC2)cc1 ZINC000128667899 1047012434 /nfs/dbraw/zinc/01/24/34/1047012434.db2.gz CTUJIEMJSBYMLJ-UHFFFAOYSA-N -1 3 329.371 4.495 20 0 EIADHM Cc1cc(F)ccc1[N-]S(=O)(=O)c1ccc(OC2CCCC2)cc1 ZINC000917723367 1047088024 /nfs/dbraw/zinc/08/80/24/1047088024.db2.gz YZQOJUFVZIEVIZ-UHFFFAOYSA-N -1 3 349.427 4.256 20 0 EIADHM Cc1cc(C(F)F)oc1C(=O)[N-]c1nnc(Cc2ccccc2)s1 ZINC001130675002 1047312994 /nfs/dbraw/zinc/31/29/94/1047312994.db2.gz RKJXJHDZPKFAEB-UHFFFAOYSA-N -1 3 349.362 4.220 20 0 EIADHM O=C(Nc1cccc([O-])c1F)[C@@H]1C[C@@H]1c1ccccc1C(F)(F)F ZINC000129263259 1047341015 /nfs/dbraw/zinc/34/10/15/1047341015.db2.gz JXQCNCSHLSGSTR-GHMZBOCLSA-N -1 3 339.288 4.292 20 0 EIADHM Cn1cccc1C(=O)Nc1ccc([O-])c(-c2nc3ccccc3s2)c1 ZINC000129491440 1047403568 /nfs/dbraw/zinc/40/35/68/1047403568.db2.gz OIYJXYNMVUYJEC-UHFFFAOYSA-N -1 3 349.415 4.260 20 0 EIADHM CCOCCC(=O)Nc1ccc([O-])c(-c2nc3ccccc3s2)c1 ZINC000129512471 1047412444 /nfs/dbraw/zinc/41/24/44/1047412444.db2.gz ANXKDJSSOKSTDT-UHFFFAOYSA-N -1 3 342.420 4.034 20 0 EIADHM CCc1c([N-]C(=O)C(F)(F)c2ccc(C)cc2)onc1C(F)(F)F ZINC000807267692 1047435866 /nfs/dbraw/zinc/43/58/66/1047435866.db2.gz AWFGAGCEZOZQBI-UHFFFAOYSA-N -1 3 348.271 4.295 20 0 EIADHM COc1cc(C(=O)Nc2cc(Cl)ccc2[O-])ccc1OC(C)C ZINC000069693214 1047450229 /nfs/dbraw/zinc/45/02/29/1047450229.db2.gz LTOFZACOJONWTC-UHFFFAOYSA-N -1 3 335.787 4.094 20 0 EIADHM O=C([N-]c1ccccc1SCc1ccccc1)c1cnsn1 ZINC000918556662 1047498051 /nfs/dbraw/zinc/49/80/51/1047498051.db2.gz IVOUEQUNSRRJFM-UHFFFAOYSA-N -1 3 327.434 4.083 20 0 EIADHM Cc1ccccc1C[C@@H]1CCCN1C(=O)c1cc([O-])ccc1Cl ZINC000556183652 1047542551 /nfs/dbraw/zinc/54/25/51/1047542551.db2.gz BZCKOAFUVNOBCC-HNNXBMFYSA-N -1 3 329.827 4.201 20 0 EIADHM CSc1ccsc1C(=O)[N-]c1nc(-c2ccccc2)ns1 ZINC000107115271 1047721329 /nfs/dbraw/zinc/72/13/29/1047721329.db2.gz LFMKMLRCYYOCKJ-UHFFFAOYSA-N -1 3 333.463 4.241 20 0 EIADHM Cc1ccc(C(=O)Nc2cccc([O-])c2F)cc1Oc1ccncc1 ZINC000556555184 1047817114 /nfs/dbraw/zinc/81/71/14/1047817114.db2.gz QCWVOUKWCRDPAI-UHFFFAOYSA-N -1 3 338.338 4.279 20 0 EIADHM CCCN(C(=O)c1ccc(CC)cc1[O-])[C@@H]1C[C@@H](OCC)C1(C)C ZINC001136849020 1047851390 /nfs/dbraw/zinc/85/13/90/1047851390.db2.gz WDZSEOSMVOJXSZ-QZTJIDSGSA-N -1 3 333.472 4.010 20 0 EIADHM CC(C)c1ccc(C(=O)N[C@@H](C)c2cccc(-n3cccn3)c2)c([O-])c1 ZINC001137006958 1048055808 /nfs/dbraw/zinc/05/58/08/1048055808.db2.gz IBLBAMRLGYWQGE-HNNXBMFYSA-N -1 3 349.434 4.192 20 0 EIADHM CCCCCC[C@](C)(CC)C(=O)NCc1cc(=O)[n-]c(C2CCC2)n1 ZINC000825304586 1048066544 /nfs/dbraw/zinc/06/65/44/1048066544.db2.gz CLGGOENNLWIQSG-FQEVSTJZSA-N -1 3 347.503 4.453 20 0 EIADHM [O-]c1ccc(F)c(CN2CCCn3c(cc4ccccc43)C2)c1F ZINC000556878091 1048111616 /nfs/dbraw/zinc/11/16/16/1048111616.db2.gz VZOFYPUQUQRABF-UHFFFAOYSA-N -1 3 328.362 4.031 20 0 EIADHM CC(=O)c1cccc(NC(=O)Cc2c(Cl)cccc2Cl)c1[O-] ZINC000556894036 1048118428 /nfs/dbraw/zinc/11/84/28/1048118428.db2.gz JFDYWXNGYLGKBQ-UHFFFAOYSA-N -1 3 338.190 4.083 20 0 EIADHM CC(=O)c1cccc(NC(=O)[C@H](C)Cc2ccccc2Cl)c1[O-] ZINC000556892573 1048137415 /nfs/dbraw/zinc/13/74/15/1048137415.db2.gz MRLXRGVEZNYSQJ-LLVKDONJSA-N -1 3 331.799 4.066 20 0 EIADHM Cc1ccc([O-])c(C(=O)Nc2ccnn2[C@@H]2CCCc3ccccc32)c1 ZINC001143720381 1048163211 /nfs/dbraw/zinc/16/32/11/1048163211.db2.gz BQGVXPLNENNOKX-GOSISDBHSA-N -1 3 347.418 4.075 20 0 EIADHM CCCCCc1nnc([N-]C(=O)c2c(F)ccc(C)c2F)s1 ZINC000499120770 1048302075 /nfs/dbraw/zinc/30/20/75/1048302075.db2.gz FRWYMOHKQRGCCD-UHFFFAOYSA-N -1 3 325.384 4.110 20 0 EIADHM [O-]c1cccc(CNC[C@@H](O)c2c(Cl)cccc2Cl)c1Cl ZINC000815125310 1048339409 /nfs/dbraw/zinc/33/94/09/1048339409.db2.gz CVBZPBMGUIGUFX-CYBMUJFWSA-N -1 3 346.641 4.176 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)[C@H]1C[C@@H]1c1ccc2ccccc2c1 ZINC000132742117 1048481431 /nfs/dbraw/zinc/48/14/31/1048481431.db2.gz ILJDTIWIOAXYME-MSOLQXFVSA-N -1 3 335.378 4.104 20 0 EIADHM Cc1cc(C)c(S(=O)(=O)[N-]c2cccc(-c3ncco3)c2)c(C)c1 ZINC000132751252 1048485011 /nfs/dbraw/zinc/48/50/11/1048485011.db2.gz PNYHXFVRYLMLJN-UHFFFAOYSA-N -1 3 342.420 4.068 20 0 EIADHM Cc1c(C(=O)NCc2ccc([O-])c(F)c2)sc2cccc(F)c12 ZINC000132853827 1048513556 /nfs/dbraw/zinc/51/35/56/1048513556.db2.gz LQIRWRPNQFLUIE-UHFFFAOYSA-N -1 3 333.359 4.124 20 0 EIADHM Cc1cc(OC(F)F)c(C(=O)[N-]c2nnc(C(C)(C)C)s2)s1 ZINC000074510689 1048514354 /nfs/dbraw/zinc/51/43/54/1048514354.db2.gz QGMYTIYVWUBIHT-UHFFFAOYSA-N -1 3 347.412 4.059 20 0 EIADHM CC[C@@H]1CCCCN1Cc1nc(=O)c2c(-c3ccco3)csc2[n-]1 ZINC000195333848 1048666092 /nfs/dbraw/zinc/66/60/92/1048666092.db2.gz ZFSUMMXARJAGDL-GFCCVEGCSA-N -1 3 343.452 4.009 20 0 EIADHM COc1cccc([C@@H]2CCCN(Cc3c(F)cc([O-])cc3F)C2)c1 ZINC001144561976 1048731342 /nfs/dbraw/zinc/73/13/42/1048731342.db2.gz SFYNXSHEMUYVRH-CQSZACIVSA-N -1 3 333.378 4.059 20 0 EIADHM CCC/C(C)=C/C(=O)O[C@H](C)c1nc(=O)c2c(C)c(C)sc2[n-]1 ZINC000920694116 1048750080 /nfs/dbraw/zinc/75/00/80/1048750080.db2.gz UTCMBFHLMPVUCV-ANYFNZRUSA-N -1 3 334.441 4.364 20 0 EIADHM CCC[C@H]1CC[C@H](C(=O)Nc2ncc([O-])cc2Br)CC1 ZINC001144638184 1048762694 /nfs/dbraw/zinc/76/26/94/1048762694.db2.gz DSTLTFIXMJKBFB-XYPYZODXSA-N -1 3 341.249 4.095 20 0 EIADHM O=C(Cc1ccc([O-])c(F)c1)Nc1ccc(-c2cccc(O)c2)cc1 ZINC001144631103 1048765238 /nfs/dbraw/zinc/76/52/38/1048765238.db2.gz GYZHFGKPJMAXNO-UHFFFAOYSA-N -1 3 337.350 4.085 20 0 EIADHM O=C([O-])c1ccsc1CN1CCC(c2ccccc2Cl)CC1 ZINC001144680155 1048801262 /nfs/dbraw/zinc/80/12/62/1048801262.db2.gz KMCAVWQWJZSQOT-UHFFFAOYSA-N -1 3 335.856 4.479 20 0 EIADHM CN(Cc1ccc(C(F)(F)F)cc1)Cc1c(F)ccc([O-])c1F ZINC000816478267 1048810393 /nfs/dbraw/zinc/81/03/93/1048810393.db2.gz ZYQBJAPAMKEDSK-UHFFFAOYSA-N -1 3 331.284 4.321 20 0 EIADHM CC(=O)Nc1cccc(COC(=O)c2cc3cc(Cl)sc3[n-]2)c1 ZINC000810560527 1048812689 /nfs/dbraw/zinc/81/26/89/1048812689.db2.gz DCGBZYRAVCUIQL-UHFFFAOYSA-N -1 3 348.811 4.198 20 0 EIADHM O=C(OCc1nc2ccccc2[nH]1)c1cc2cc(Cl)sc2[n-]1 ZINC000810539939 1048816206 /nfs/dbraw/zinc/81/62/06/1048816206.db2.gz UXWGDVNQUJVQEU-UHFFFAOYSA-N -1 3 331.784 4.116 20 0 EIADHM [O-]c1cccc(CN2CCC([C@@H](O)c3ccc(F)cc3)CC2)c1Cl ZINC000816507254 1048821720 /nfs/dbraw/zinc/82/17/20/1048821720.db2.gz BJECFXLNQWCDJB-IBGZPJMESA-N -1 3 349.833 4.130 20 0 EIADHM [O-]c1ccc(F)c(CNc2cc3c(cc2Cl)OCCCO3)c1F ZINC000816559546 1048835559 /nfs/dbraw/zinc/83/55/59/1048835559.db2.gz NGLAQZYFAHNHFJ-UHFFFAOYSA-N -1 3 341.741 4.097 20 0 EIADHM COc1ccc(/C=C(/C)C(=O)Nc2c([O-])cccc2Cl)cc1F ZINC000816769101 1048856500 /nfs/dbraw/zinc/85/65/00/1048856500.db2.gz UDRUTZXDYFQKLV-NTMALXAHSA-N -1 3 335.762 4.235 20 0 EIADHM CCC[C@H](Cc1ccccc1)N(CCC)C(=O)c1ccc(N)cc1[O-] ZINC000817933892 1049061113 /nfs/dbraw/zinc/06/11/13/1049061113.db2.gz VWCKGUOGICBRSA-GOSISDBHSA-N -1 3 340.467 4.238 20 0 EIADHM CCc1ccc([O-])c(C(=O)N2CC3(CCCC3)[C@H]2c2ccco2)c1 ZINC001146911234 1049068962 /nfs/dbraw/zinc/06/89/62/1049068962.db2.gz TZTIGYJLFVTZGE-GOSISDBHSA-N -1 3 325.408 4.305 20 0 EIADHM O=C(c1cc2sccc2c([O-])c1)N1CC[C@H](c2ccccc2F)C1 ZINC000818027316 1049082363 /nfs/dbraw/zinc/08/23/63/1049082363.db2.gz ORBMLGVLQMXWLN-LBPRGKRZSA-N -1 3 341.407 4.376 20 0 EIADHM CCCc1ccccc1NC(=O)c1c[n-]c2c(Cl)cccc2c1=O ZINC001136116238 1049099863 /nfs/dbraw/zinc/09/98/63/1049099863.db2.gz JMKITSWDPYYOPZ-UHFFFAOYSA-N -1 3 340.810 4.386 20 0 EIADHM O=C(Nc1nc2ccsc2s1)c1cc2c(cc1[O-])CCCC2 ZINC001147397267 1049143722 /nfs/dbraw/zinc/14/37/22/1049143722.db2.gz BFISLRBBYYBKJP-UHFFFAOYSA-N -1 3 330.434 4.195 20 0 EIADHM CCc1cc(C(=O)Nc2ccc(C(=O)OC(C)(C)C)cc2[O-])cs1 ZINC001147714653 1049206210 /nfs/dbraw/zinc/20/62/10/1049206210.db2.gz VLWSKTKISBYJCR-UHFFFAOYSA-N -1 3 347.436 4.224 20 0 EIADHM Cc1noc(C2CC2)c1NC(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000135587597 1049217742 /nfs/dbraw/zinc/21/77/42/1049217742.db2.gz WDRSDWUQDLBMBM-UHFFFAOYSA-N -1 3 348.402 4.409 20 0 EIADHM O=C(NCCCC1CCC1)c1cc(Oc2ccccc2)ccc1[O-] ZINC001147792311 1049218681 /nfs/dbraw/zinc/21/86/81/1049218681.db2.gz HZEBOGUJIHDQAQ-UHFFFAOYSA-N -1 3 325.408 4.495 20 0 EIADHM [O-]c1cccnc1CNc1c(Cl)nc(Cl)c(Cl)c1Cl ZINC001158770773 1049320038 /nfs/dbraw/zinc/32/00/38/1049320038.db2.gz MCDZCHMVHHZQDO-UHFFFAOYSA-N -1 3 339.009 4.408 20 0 EIADHM CCO[C@H]1C[C@@H](NC(=O)c2cc([O-])c3ccccc3c2)C12CCCC2 ZINC001148553447 1049333000 /nfs/dbraw/zinc/33/30/00/1049333000.db2.gz QFPIATYCZMHFHA-MOPGFXCFSA-N -1 3 339.435 4.013 20 0 EIADHM CCCCN(Cc1ccccc1)C(=O)c1ccc([O-])c(C(C)=O)c1 ZINC001148663305 1049356383 /nfs/dbraw/zinc/35/63/83/1049356383.db2.gz WKXPTDLLHTVOCN-UHFFFAOYSA-N -1 3 325.408 4.037 20 0 EIADHM Cc1ccc(C(=O)Nc2cccc(-c3n[nH]c4c3CCCC4)c2)c([O-])c1 ZINC001136255406 1049358918 /nfs/dbraw/zinc/35/89/18/1049358918.db2.gz SNOAOLCMOOKDQN-UHFFFAOYSA-N -1 3 347.418 4.222 20 0 EIADHM CCc1ccc(C(=O)N2CCC[C@H](c3ccc(F)c(F)c3)C2)c([O-])c1 ZINC001148744246 1049366983 /nfs/dbraw/zinc/36/69/83/1049366983.db2.gz XAFORLCNHXYCJC-HNNXBMFYSA-N -1 3 345.389 4.253 20 0 EIADHM CC(=O)c1cccc([O-])c1NC(=O)c1ccc(-c2ccc(O)cc2)cc1 ZINC001148878832 1049387887 /nfs/dbraw/zinc/38/78/87/1049387887.db2.gz JZFNLWXKDWIGLR-UHFFFAOYSA-N -1 3 347.370 4.220 20 0 EIADHM CSc1ccc([O-])c(C(=O)NCCc2csc3ccccc23)c1 ZINC001136285086 1049390958 /nfs/dbraw/zinc/39/09/58/1049390958.db2.gz PHPJTZSSELZODS-UHFFFAOYSA-N -1 3 343.473 4.301 20 0 EIADHM CCO[C@H]1C[C@@H](N(C)C(=O)c2cc([O-])ccc2Cl)C1(CC)CC ZINC001148987491 1049408592 /nfs/dbraw/zinc/40/85/92/1049408592.db2.gz FJZVNOLOBHJYRS-CVEARBPZSA-N -1 3 339.863 4.101 20 0 EIADHM Cc1cc([C@@H](C)NCc2nc3c4ccccc4oc3c(=O)[n-]2)c(C)o1 ZINC000348099912 1049419278 /nfs/dbraw/zinc/41/92/78/1049419278.db2.gz XPJHQERNAQWDFS-LLVKDONJSA-N -1 3 337.379 4.142 20 0 EIADHM Cc1nc(-c2ccccc2)oc1C(=O)Nc1cc(Cl)ccc1[O-] ZINC000080004023 1049542572 /nfs/dbraw/zinc/54/25/72/1049542572.db2.gz HOEUCUSNYWSRGV-UHFFFAOYSA-N -1 3 328.755 4.261 20 0 EIADHM CCCc1ccc(S(=O)(=O)[N-]c2cnc(Cl)cc2Cl)cc1 ZINC000820799560 1049560575 /nfs/dbraw/zinc/56/05/75/1049560575.db2.gz WAHYTQXTHVMNAN-UHFFFAOYSA-N -1 3 345.251 4.142 20 0 EIADHM O=C(Nc1cccc(OC2CCCC2)c1)c1[n-]cnc1C(F)(F)F ZINC000820910709 1049570113 /nfs/dbraw/zinc/57/01/13/1049570113.db2.gz ITABLEXOAFIGCU-UHFFFAOYSA-N -1 3 339.317 4.002 20 0 EIADHM O=C(Nc1cccc(OC2CCCC2)c1)c1nc[n-]c1C(F)(F)F ZINC000820910709 1049570130 /nfs/dbraw/zinc/57/01/30/1049570130.db2.gz ITABLEXOAFIGCU-UHFFFAOYSA-N -1 3 339.317 4.002 20 0 EIADHM C[C@H](NCc1cc([N+](=O)[O-])ccc1[O-])c1ccc(Cl)cc1Cl ZINC000237579824 1049632834 /nfs/dbraw/zinc/63/28/34/1049632834.db2.gz BWTCVIAOAGIQRZ-VIFPVBQESA-N -1 3 341.194 4.458 20 0 EIADHM COc1ccc([C@@H]2C[C@H]2CC(=O)Nc2c([O-])cccc2Cl)cc1 ZINC000615321753 1049635468 /nfs/dbraw/zinc/63/54/68/1049635468.db2.gz JIBOJRUUVHLKMF-JSGCOSHPSA-N -1 3 331.799 4.187 20 0 EIADHM CO[C@@H](C)CC(=O)Nc1ccc([O-])c(-c2nc3ccccc3s2)c1 ZINC000179934119 1049802784 /nfs/dbraw/zinc/80/27/84/1049802784.db2.gz VCYKAQBHMYKNAT-NSHDSACASA-N -1 3 342.420 4.032 20 0 EIADHM O=C(OC[C@@H]1CC[C@@H](c2ccccc2)O1)c1cc(Cl)c(Cl)[n-]1 ZINC000814056478 1049865968 /nfs/dbraw/zinc/86/59/68/1049865968.db2.gz POGKPWQNSNMMNW-FZMZJTMJSA-N -1 3 340.206 4.399 20 0 EIADHM N=C(Nc1[n-]c(=O)c(Cl)cc1Cl)c1ccc2ccccc2n1 ZINC001171039530 1049890599 /nfs/dbraw/zinc/89/05/99/1049890599.db2.gz HDXSCQDXWUXXGM-UHFFFAOYSA-N -1 3 333.178 4.080 20 0 EIADHM CC(C)CCc1nnc([N-]C(=O)c2cc(F)c(F)cc2Cl)s1 ZINC000617097967 1049949478 /nfs/dbraw/zinc/94/94/78/1049949478.db2.gz KDSHZDLWIDCPAG-UHFFFAOYSA-N -1 3 345.802 4.311 20 0 EIADHM CC(C)Oc1cc(F)ccc1Nc1cc(=O)n(-c2ccccc2)[n-]1 ZINC001212292478 1049967957 /nfs/dbraw/zinc/96/79/57/1049967957.db2.gz SNIQQMHXVDSECY-UHFFFAOYSA-N -1 3 327.359 4.248 20 0 EIADHM CC[C@@]1(C(=O)[O-])CCCN(Cc2coc(-c3ccc(Cl)cc3)n2)C1 ZINC000324843330 1050123121 /nfs/dbraw/zinc/12/31/21/1050123121.db2.gz CPBOMRPGPSNLHE-GOSISDBHSA-N -1 3 348.830 4.072 20 0 EIADHM CCc1nc(C)c([C@@H](C)N(C)C(=O)c2cc(CC)ccc2[O-])s1 ZINC000091735879 1050277904 /nfs/dbraw/zinc/27/79/04/1050277904.db2.gz DHILRSYHUJEITF-GFCCVEGCSA-N -1 3 332.469 4.115 20 0 EIADHM [O-]c1cncc(-c2nc(-c3ccc(OCc4ccccc4)cc3)no2)c1 ZINC001212708350 1050330937 /nfs/dbraw/zinc/33/09/37/1050330937.db2.gz FYJGRAJFRKNUKE-UHFFFAOYSA-N -1 3 345.358 4.083 20 0 EIADHM Cc1ccc(C(=O)Nc2cc3n[nH]cc3c(C(F)(F)F)c2)c([O-])c1C ZINC001178339866 1050438743 /nfs/dbraw/zinc/43/87/43/1050438743.db2.gz YBOIJEZGSOILFK-UHFFFAOYSA-N -1 3 349.312 4.156 20 0 EIADHM Cc1sc2[n-]c([C@H](C)OC(=O)[C@@H]3C[C@]3(C)C(C)C)nc(=O)c2c1C ZINC000775071704 1050463858 /nfs/dbraw/zinc/46/38/58/1050463858.db2.gz KDUHINWYHXEKLD-KWFDTGPKSA-N -1 3 348.468 4.300 20 0 EIADHM CC[C@@H]1CCC[C@@H]([N-]S(=O)(=O)c2cccc(Cl)c2Cl)C1 ZINC001187137850 1050489839 /nfs/dbraw/zinc/48/98/39/1050489839.db2.gz KIPVWYMCGLQMNT-GHMZBOCLSA-N -1 3 336.284 4.241 20 0 EIADHM CC1(C)[C@H](c2ccc(Cl)cc2)CCN1C(=O)c1ccccc1[O-] ZINC001178530294 1050492852 /nfs/dbraw/zinc/49/28/52/1050492852.db2.gz KYNJOSZXSCPUQH-INIZCTEOSA-N -1 3 329.827 4.454 20 0 EIADHM O=S(=O)(CCc1cccc2ccccc21)[N-]c1cc(F)ccc1F ZINC001187608570 1050579860 /nfs/dbraw/zinc/57/98/60/1050579860.db2.gz WERROMCGVJTTFL-UHFFFAOYSA-N -1 3 347.386 4.102 20 0 EIADHM CCc1ccccc1NC(=O)Nc1ccc(Br)cc1[O-] ZINC001187637993 1050585760 /nfs/dbraw/zinc/58/57/60/1050585760.db2.gz WAGHGMOEIQYCFA-UHFFFAOYSA-N -1 3 335.201 4.361 20 0 EIADHM CCOc1ccc(Nc2cc(Br)cc(F)c2[O-])cc1 ZINC001173854351 1050586055 /nfs/dbraw/zinc/58/60/55/1050586055.db2.gz WRPSTRNJKYVAMX-UHFFFAOYSA-N -1 3 326.165 4.436 20 0 EIADHM O=S(=O)([N-]c1ccc(Cl)c(Cl)c1Cl)c1ccoc1 ZINC001188610197 1050804737 /nfs/dbraw/zinc/80/47/37/1050804737.db2.gz LFCIYVOECRGQAV-UHFFFAOYSA-N -1 3 326.588 4.041 20 0 EIADHM Cc1cccc([O-])c1C(=O)Nc1ccc(OC(F)F)c(Cl)c1 ZINC001188649217 1050812950 /nfs/dbraw/zinc/81/29/50/1050812950.db2.gz VLZRPZGWZNFGSS-UHFFFAOYSA-N -1 3 327.714 4.208 20 0 EIADHM CCN(Cc1ccccn1)C(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000152677011 1050827979 /nfs/dbraw/zinc/82/79/79/1050827979.db2.gz LBVOCHGFFLBUHT-UHFFFAOYSA-N -1 3 348.402 4.242 20 0 EIADHM O=C(NC1CCCC1)c1cccc(Nc2cccc(Cl)c2[O-])c1 ZINC001174196831 1050832544 /nfs/dbraw/zinc/83/25/44/1050832544.db2.gz GXCPLWFPYKZDKU-UHFFFAOYSA-N -1 3 330.815 4.462 20 0 EIADHM COc1cc([C@H](C)NC(=O)c2c(C)cccc2[O-])cc2ccccc21 ZINC001179986208 1050842984 /nfs/dbraw/zinc/84/29/84/1050842984.db2.gz DJMWGAYHPDHNEB-AWEZNQCLSA-N -1 3 335.403 4.353 20 0 EIADHM CC(C)(C)c1cccc(C(=O)Nc2ncc([O-])cc2Br)c1 ZINC001188970255 1050876087 /nfs/dbraw/zinc/87/60/87/1050876087.db2.gz IFCWDEVVUROAIC-UHFFFAOYSA-N -1 3 349.228 4.100 20 0 EIADHM O=C(c1cc(Nc2cccc([O-])c2Cl)ccc1F)N1CCCC1 ZINC001188993318 1050882287 /nfs/dbraw/zinc/88/22/87/1050882287.db2.gz PTBHWLBQWBXLCG-UHFFFAOYSA-N -1 3 334.778 4.164 20 0 EIADHM [O-]c1cccc(Nc2ccc(N3CCCCC3)nc2)c1Br ZINC001174525436 1051022386 /nfs/dbraw/zinc/02/23/86/1051022386.db2.gz YXOXJVAYWHMICJ-UHFFFAOYSA-N -1 3 348.244 4.284 20 0 EIADHM [O-]c1cccc(Nc2cccc(-c3cc[nH]n3)c2)c1Br ZINC001174510194 1051043143 /nfs/dbraw/zinc/04/31/43/1051043143.db2.gz WQVDMXOZKGHNRK-UHFFFAOYSA-N -1 3 330.185 4.288 20 0 EIADHM O=C(Nc1ccc([O-])cc1F)c1ccccc1C(=O)c1ccccc1 ZINC000183257770 1051046562 /nfs/dbraw/zinc/04/65/62/1051046562.db2.gz TUWRSTFZIKYQKY-UHFFFAOYSA-N -1 3 335.334 4.015 20 0 EIADHM O=C(Cc1coc(-c2ccc(F)cc2)n1)Nc1ccc(Cl)cc1[O-] ZINC000153513476 1051065762 /nfs/dbraw/zinc/06/57/62/1051065762.db2.gz NUHVJDKHYFWJAX-UHFFFAOYSA-N -1 3 346.745 4.021 20 0 EIADHM COc1cccc([C@@H]2C[C@H](C)CN2Cc2c(F)ccc([O-])c2F)c1 ZINC001180834934 1051084340 /nfs/dbraw/zinc/08/43/40/1051084340.db2.gz INCCVGNRINLFHU-SJCJKPOMSA-N -1 3 333.378 4.262 20 0 EIADHM O=C([N-]c1cnoc1)c1c(Cl)cc(C(F)(F)F)cc1Cl ZINC001190005794 1051102675 /nfs/dbraw/zinc/10/26/75/1051102675.db2.gz BCOUUZWRHNAPMG-UHFFFAOYSA-N -1 3 325.073 4.253 20 0 EIADHM O=C(NCc1ccc(Cl)cc1Cl)Nc1cc(F)ccc1[O-] ZINC001190093175 1051112274 /nfs/dbraw/zinc/11/22/74/1051112274.db2.gz ITZWPFWTVNEKKQ-UHFFFAOYSA-N -1 3 329.158 4.160 20 0 EIADHM O=C1CCc2ccc(Nc3ccc([O-])c(F)c3)c(Br)c21 ZINC001174740702 1051158485 /nfs/dbraw/zinc/15/84/85/1051158485.db2.gz GYRIFNQJWVFLRM-UHFFFAOYSA-N -1 3 336.160 4.166 20 0 EIADHM COc1ccc2ccc(C(=O)Nc3c([O-])cccc3C(C)=O)cc2c1 ZINC001174823162 1051188394 /nfs/dbraw/zinc/18/83/94/1051188394.db2.gz GMLYBPIVDFTYCA-UHFFFAOYSA-N -1 3 335.359 4.009 20 0 EIADHM CCc1ccc([O-])c(C(=O)N2CCC3(C=Cc4ccccc4O3)CC2)c1 ZINC000620720043 1051243127 /nfs/dbraw/zinc/24/31/27/1051243127.db2.gz UIWCNDSGMZZDRU-UHFFFAOYSA-N -1 3 349.430 4.035 20 0 EIADHM CC(C)(CC[N-]S(=O)(=O)c1cccc(Cl)c1Cl)C1CC1 ZINC001190798409 1051279783 /nfs/dbraw/zinc/27/97/83/1051279783.db2.gz NGSPBIQWOCXMMO-UHFFFAOYSA-N -1 3 336.284 4.098 20 0 EIADHM COc1ccc(Nc2cc(Br)cc(F)c2[O-])c(F)c1F ZINC001175026137 1051288387 /nfs/dbraw/zinc/28/83/87/1051288387.db2.gz CIUXTDPSNNZUEU-UHFFFAOYSA-N -1 3 348.118 4.324 20 0 EIADHM O=C(NCc1cccc(-c2cccs2)c1)c1ccc(=O)[n-]c1Cl ZINC001190918516 1051310864 /nfs/dbraw/zinc/31/08/64/1051310864.db2.gz STSVNZOPVCOBDS-UHFFFAOYSA-N -1 3 344.823 4.099 20 0 EIADHM O=C(Nc1ccc(F)c([O-])c1)[C@@H](Cc1ccccc1)c1ccccc1 ZINC001181830518 1051323866 /nfs/dbraw/zinc/32/38/66/1051323866.db2.gz RCTDDSPESBLOLD-SFHVURJKSA-N -1 3 335.378 4.496 20 0 EIADHM [O-]c1cc(F)c(Nc2ccc(I)cc2)c(F)c1 ZINC001175097102 1051380838 /nfs/dbraw/zinc/38/08/38/1051380838.db2.gz PLIIJMJLOWVNPO-UHFFFAOYSA-N -1 3 347.102 4.019 20 0 EIADHM Cc1ccc(F)cc1NC(=O)Nc1ccc([O-])c(Br)c1 ZINC001191410624 1051450523 /nfs/dbraw/zinc/45/05/23/1051450523.db2.gz PKLHOJVBMGNXGQ-UHFFFAOYSA-N -1 3 339.164 4.246 20 0 EIADHM Cc1cc(=O)[n-]c(-c2cccc(OC(=O)[C@@H](C)CC(C)(C)C)c2)n1 ZINC000774102680 1051454665 /nfs/dbraw/zinc/45/46/65/1051454665.db2.gz ACPVXPIVRJPQLS-LBPRGKRZSA-N -1 3 328.412 4.135 20 0 EIADHM O=C(Nc1cc(F)cc(C(F)(F)F)c1)Nc1cc(F)ccc1[O-] ZINC001191588049 1051484016 /nfs/dbraw/zinc/48/40/16/1051484016.db2.gz CMQWRANDSSBCEO-UHFFFAOYSA-N -1 3 332.228 4.333 20 0 EIADHM CCOc1ccc(-c2cc(Nc3c(F)ccc([O-])c3F)on2)cc1 ZINC001175261838 1051500126 /nfs/dbraw/zinc/50/01/26/1051500126.db2.gz RYCZMMPWFDTXAG-UHFFFAOYSA-N -1 3 332.306 4.468 20 0 EIADHM NC(=O)c1cc(-c2ccccc2)sc1Nc1c(F)ccc([O-])c1F ZINC001175262961 1051501661 /nfs/dbraw/zinc/50/16/61/1051501661.db2.gz FEUSDVGOOBLMFC-UHFFFAOYSA-N -1 3 346.358 4.241 20 0 EIADHM COC(=O)c1cc2cc(Nc3c(F)ccc([O-])c3F)ccc2s1 ZINC001175267770 1051502391 /nfs/dbraw/zinc/50/23/91/1051502391.db2.gz FZJTUZUIWWAPDR-UHFFFAOYSA-N -1 3 335.331 4.415 20 0 EIADHM CCOC(=O)c1ccc(Nc2c(F)ccc([O-])c2F)c(Cl)c1 ZINC001175268765 1051502718 /nfs/dbraw/zinc/50/27/18/1051502718.db2.gz UMECUHAMUWOJMV-UHFFFAOYSA-N -1 3 327.714 4.244 20 0 EIADHM COc1cc(Br)ccc1Nc1c(F)ccc([O-])c1F ZINC001175266038 1051504317 /nfs/dbraw/zinc/50/43/17/1051504317.db2.gz SYJGSNQBCOQAID-UHFFFAOYSA-N -1 3 330.128 4.185 20 0 EIADHM [O-]c1ccc(F)c(Nc2ccc3cnn([C@H]4CCCCO4)c3c2)c1F ZINC001175267894 1051505007 /nfs/dbraw/zinc/50/50/07/1051505007.db2.gz BSKVVOITNZCIBP-MRXNPFEDSA-N -1 3 345.349 4.463 20 0 EIADHM CCOC(=O)c1ccc2c(cccc2Nc2c(F)ccc([O-])c2F)n1 ZINC001175269707 1051508132 /nfs/dbraw/zinc/50/81/32/1051508132.db2.gz JQOPFMUMMYRFTE-UHFFFAOYSA-N -1 3 344.317 4.139 20 0 EIADHM COc1ccc(-c2ccccc2Nc2c(F)ccc([O-])c2F)nc1 ZINC001175271570 1051509602 /nfs/dbraw/zinc/50/96/02/1051509602.db2.gz VVGAZZNMKQRWNQ-UHFFFAOYSA-N -1 3 328.318 4.485 20 0 EIADHM [O-]c1ccc(F)c(Nc2c(F)cccc2OC[C@H]2CCCO2)c1F ZINC001175270888 1051510437 /nfs/dbraw/zinc/51/04/37/1051510437.db2.gz NCNOFLHFISJNRO-SNVBAGLBSA-N -1 3 339.313 4.111 20 0 EIADHM O=C(Nc1ccc(F)c([O-])c1)[C@H]1C[C@H]1c1ccccc1C(F)(F)F ZINC001182363103 1051524595 /nfs/dbraw/zinc/52/45/95/1051524595.db2.gz LKQPRKZMBFBFJY-RYUDHWBXSA-N -1 3 339.288 4.292 20 0 EIADHM Cc1noc(C2CC2)c1[N-]C(=O)c1cnc(Cc2ccccc2)s1 ZINC000156632914 1051549050 /nfs/dbraw/zinc/54/90/50/1051549050.db2.gz XHVHAKJCBOTWSP-UHFFFAOYSA-N -1 3 339.420 4.160 20 0 EIADHM COc1ncc([N-]c2nc3ccc(Br)cc3s2)s1 ZINC001175386550 1051567595 /nfs/dbraw/zinc/56/75/95/1051567595.db2.gz CFBCUKBZCWODTQ-UHFFFAOYSA-N -1 3 342.243 4.268 20 0 EIADHM CCCCCCNC(=O)Nc1cc(Br)c(C)cc1[O-] ZINC001191977335 1051606103 /nfs/dbraw/zinc/60/61/03/1051606103.db2.gz BMLWAIDEQDNPMK-UHFFFAOYSA-N -1 3 329.238 4.165 20 0 EIADHM O=C([N-]c1nc(-c2ccccc2)no1)c1c(Cl)oc2ccccc21 ZINC001182541984 1051636497 /nfs/dbraw/zinc/63/64/97/1051636497.db2.gz YGBMFCUWQUVNKH-UHFFFAOYSA-N -1 3 339.738 4.389 20 0 EIADHM COC(=O)c1cc([O-])c(F)cc1NC(=O)Nc1ccccc1C(C)C ZINC001192259404 1051675428 /nfs/dbraw/zinc/67/54/28/1051675428.db2.gz HJYVRNHGDOLABS-UHFFFAOYSA-N -1 3 346.358 4.085 20 0 EIADHM Cc1cc(Cl)ncc1S(=O)(=O)[N-]c1c(F)cccc1C(C)C ZINC001192368279 1051706489 /nfs/dbraw/zinc/70/64/89/1051706489.db2.gz NMLCHHZDTCDBAS-UHFFFAOYSA-N -1 3 342.823 4.107 20 0 EIADHM O=C(Nc1cc2ccccc2cc1[O-])C(F)(F)c1ccc(F)cc1 ZINC001182890622 1051732521 /nfs/dbraw/zinc/73/25/21/1051732521.db2.gz MTHWEISLVZWPDN-UHFFFAOYSA-N -1 3 331.293 4.415 20 0 EIADHM CCc1ccc(OC)c(S(=O)(=O)[N-]c2ccc(C)cc2Cl)c1 ZINC001192755988 1051810556 /nfs/dbraw/zinc/81/05/56/1051810556.db2.gz GZAXQCPQRQLSMM-UHFFFAOYSA-N -1 3 339.844 4.020 20 0 EIADHM CC(=O)c1cccc([O-])c1NC(=O)Cc1sc2ccccc2c1C ZINC001183245400 1051814544 /nfs/dbraw/zinc/81/45/44/1051814544.db2.gz ULTKXBFRGVXWJM-UHFFFAOYSA-N -1 3 339.416 4.299 20 0 EIADHM Cc1cc(S(=O)(=O)[N-]CC[C@H]2CCCC2(C)C)sc1Cl ZINC001192857893 1051825144 /nfs/dbraw/zinc/82/51/44/1051825144.db2.gz SJIPDOGIZRVOHD-LLVKDONJSA-N -1 3 335.922 4.205 20 0 EIADHM O=C(Nc1ccc(F)c([O-])c1)[C@H](O)c1ccccc1C1CCCCC1 ZINC001183656102 1051884222 /nfs/dbraw/zinc/88/42/22/1051884222.db2.gz MJJRKSNYRNOGON-LJQANCHMSA-N -1 3 343.398 4.251 20 0 EIADHM O=S(=O)([N-]CC[C@@H]1CC=CCC1)c1c(Cl)cccc1Cl ZINC001193597163 1051946231 /nfs/dbraw/zinc/94/62/31/1051946231.db2.gz XWOVSFWAGQJAAM-LLVKDONJSA-N -1 3 334.268 4.018 20 0 EIADHM O=C(N[C@@H]1C[C@@H]2CCCC[C@H]12)c1cc(Oc2ccccc2)ccc1[O-] ZINC001176258381 1051984853 /nfs/dbraw/zinc/98/48/53/1051984853.db2.gz NJOWVJPCPFZBKM-UCLAIMLFSA-N -1 3 337.419 4.493 20 0 EIADHM O=C(Nc1ccccc1-c1cnco1)c1ccc([O-])cc1C(F)(F)F ZINC001193748917 1051991617 /nfs/dbraw/zinc/99/16/17/1051991617.db2.gz WJCMEXCHDVJLKQ-UHFFFAOYSA-N -1 3 348.280 4.318 20 0 EIADHM C[C@H]1C[C@H](NC(=O)c2ccc([O-])cc2C(F)(F)F)c2ccccc21 ZINC001193758054 1051992817 /nfs/dbraw/zinc/99/28/17/1051992817.db2.gz JXJUQPGZJMOBFX-QFYYESIMSA-N -1 3 335.325 4.389 20 0 EIADHM CCN(CC)C(=O)c1cc(F)cc(Nc2cc(F)c([O-])c(F)c2)c1 ZINC001176297658 1052002975 /nfs/dbraw/zinc/00/29/75/1052002975.db2.gz FHCJOZPFPVOMAQ-UHFFFAOYSA-N -1 3 338.329 4.035 20 0 EIADHM Cc1nc(-c2ccc(C)cc2)c(C(=O)Nc2nc(C)ccc2[O-])s1 ZINC001193885251 1052011172 /nfs/dbraw/zinc/01/11/72/1052011172.db2.gz OPPKIQHGZLHNKA-UHFFFAOYSA-N -1 3 339.420 4.088 20 0 EIADHM [O-]c1c(F)cc(Nc2cccc3c2cnn3[C@H]2CCCCO2)cc1F ZINC001176315372 1052022032 /nfs/dbraw/zinc/02/20/32/1052022032.db2.gz GRWJIYKEXAMJFH-QGZVFWFLSA-N -1 3 345.349 4.463 20 0 EIADHM CCc1ccc(N(Cc2cc(=O)[n-]c(C3CC3)n2)CC(C)C)cc1 ZINC001194067183 1052068050 /nfs/dbraw/zinc/06/80/50/1052068050.db2.gz YLWZXFJTBSYOHU-UHFFFAOYSA-N -1 3 325.456 4.285 20 0 EIADHM O=C([O-])[C@H]1CN(CCCCc2cccc(Cl)c2)Cc2ccccc21 ZINC000622002034 1052068445 /nfs/dbraw/zinc/06/84/45/1052068445.db2.gz SPWSKBOYWGUXQM-IBGZPJMESA-N -1 3 343.854 4.347 20 0 EIADHM CC[C@H](CNC(=O)c1cc([O-])cc(C(F)(F)F)c1)CC(F)(F)F ZINC000622103879 1052110098 /nfs/dbraw/zinc/11/00/98/1052110098.db2.gz HGSYYIZHOLANCH-QMMMGPOBSA-N -1 3 343.267 4.119 20 0 EIADHM Cn1cc(Nc2cccc([O-])c2Br)c(-c2ccccc2)n1 ZINC001176569847 1052135277 /nfs/dbraw/zinc/13/52/77/1052135277.db2.gz HOFHDWAVESXPEK-UHFFFAOYSA-N -1 3 344.212 4.299 20 0 EIADHM Cc1cc(F)c(S(=O)(=O)[N-][C@]2(C)C[C@H](C)CC(C)(C)C2)cc1F ZINC001194408706 1052141294 /nfs/dbraw/zinc/14/12/94/1052141294.db2.gz KCLDRFLSFNNMIQ-PIGZYNQJSA-N -1 3 345.455 4.156 20 0 EIADHM Cc1nccn1Cc1ccc(Nc2c(F)cc(F)c([O-])c2F)cc1 ZINC001176672464 1052159893 /nfs/dbraw/zinc/15/98/93/1052159893.db2.gz WUTHFJQAFAZWKT-UHFFFAOYSA-N -1 3 333.313 4.106 20 0 EIADHM COc1ccc(OC(=O)Nc2c([O-])cccc2C(F)(F)F)cc1 ZINC001194541030 1052165649 /nfs/dbraw/zinc/16/56/49/1052165649.db2.gz MREQSHIHSXUZMF-UHFFFAOYSA-N -1 3 327.258 4.031 20 0 EIADHM Cc1cccc(C)c1S(=O)(=O)[N-]c1ccc(CC(F)(F)F)cc1 ZINC001194637758 1052181114 /nfs/dbraw/zinc/18/11/14/1052181114.db2.gz DGDSZZVXJDZHBG-UHFFFAOYSA-N -1 3 343.370 4.209 20 0 EIADHM CCN(Cc1ccccc1C)C(=O)c1cc([O-])cc(C(F)(F)F)c1 ZINC000622299348 1052193730 /nfs/dbraw/zinc/19/37/30/1052193730.db2.gz UXZISXCAYIPOTF-UHFFFAOYSA-N -1 3 337.341 4.382 20 0 EIADHM CC(C)(C)[C@H]1CCCC[C@@H]1[N-]S(=O)(=O)c1cc(F)ccc1Cl ZINC001185319350 1052208334 /nfs/dbraw/zinc/20/83/34/1052208334.db2.gz XRMBTNFIEQJBNF-JSGCOSHPSA-N -1 3 347.883 4.362 20 0 EIADHM C[C@H]1Cc2cc(Cl)ccc2N1Cc1nnc(-c2ccccc2[O-])o1 ZINC001177015933 1052218943 /nfs/dbraw/zinc/21/89/43/1052218943.db2.gz SYGLBKFEHGUARY-NSHDSACASA-N -1 3 341.798 4.047 20 0 EIADHM CC(C)(C)C1CCN(C(=O)c2cc([O-])cc(C(F)(F)F)c2)CC1 ZINC000622376935 1052243590 /nfs/dbraw/zinc/24/35/90/1052243590.db2.gz XPKITWMWEISPBX-UHFFFAOYSA-N -1 3 329.362 4.309 20 0 EIADHM CC(C)(C)c1ccc(O)c(NC(=O)CCCc2ccc([O-])c(F)c2)c1 ZINC000622455907 1052274413 /nfs/dbraw/zinc/27/44/13/1052274413.db2.gz HHSNSWDPKAPTSM-UHFFFAOYSA-N -1 3 345.414 4.496 20 0 EIADHM Cc1cc(Cl)cc(NC(=O)c2cc([O-])cc(C(F)(F)F)c2)c1O ZINC000622467887 1052291746 /nfs/dbraw/zinc/29/17/46/1052291746.db2.gz LHONJBOSKZJONB-UHFFFAOYSA-N -1 3 345.704 4.331 20 0 EIADHM CCCc1nc(C)c(NC(=O)c2cc([O-])cc(C(F)(F)F)c2)s1 ZINC000622523761 1052302782 /nfs/dbraw/zinc/30/27/82/1052302782.db2.gz URAXBPSSKMECNC-UHFFFAOYSA-N -1 3 344.358 4.381 20 0 EIADHM O=C(Nc1ccc(C2CCC2)cn1)c1cc([O-])cc(C(F)(F)F)c1 ZINC000622622332 1052352398 /nfs/dbraw/zinc/35/23/98/1052352398.db2.gz JHXUUZQVDSGUFM-UHFFFAOYSA-N -1 3 336.313 4.326 20 0 EIADHM CC(C)CN(C(=O)Cc1ccc([O-])c(F)c1)c1cccc(Cl)c1 ZINC000622666144 1052367577 /nfs/dbraw/zinc/36/75/77/1052367577.db2.gz LLIYWJMOCQNDLS-UHFFFAOYSA-N -1 3 335.806 4.416 20 0 EIADHM O=C(Nc1cc(Br)ccc1[O-])c1ccccc1Cl ZINC000176431108 1052622903 /nfs/dbraw/zinc/62/29/03/1052622903.db2.gz YPXGUPHHQKPVON-UHFFFAOYSA-N -1 3 326.577 4.060 20 0 EIADHM CCOc1cccc2cc([C@H](C)N[C@H](C)c3nc(C)cc(=O)[n-]3)oc21 ZINC000192779929 1052639637 /nfs/dbraw/zinc/63/96/37/1052639637.db2.gz WIXUJKZEMIEQES-QWHCGFSZSA-N -1 3 341.411 4.047 20 0 EIADHM Cc1cc(C(=O)Nc2cc(F)ccc2[O-])ccc1NC(=O)CC(C)C ZINC000178326434 1052704277 /nfs/dbraw/zinc/70/42/77/1052704277.db2.gz AAJPDEGDYCUAGD-UHFFFAOYSA-N -1 3 344.386 4.077 20 0 EIADHM O=C([N-]c1cnoc1)c1oc2ccccc2c1COc1ccccc1 ZINC000623943003 1052840332 /nfs/dbraw/zinc/84/03/32/1052840332.db2.gz AXOLPWKCPCAXOV-UHFFFAOYSA-N -1 3 334.331 4.252 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)c1ccc(C(F)(F)F)cc1Cl ZINC000181670862 1052891955 /nfs/dbraw/zinc/89/19/55/1052891955.db2.gz DIUTXRJFXVGDKR-UHFFFAOYSA-N -1 3 347.695 4.134 20 0 EIADHM O=C(Nc1cccc(-c2cccs2)c1)c1cnc(C(F)(F)F)[n-]1 ZINC001194783408 1053090578 /nfs/dbraw/zinc/09/05/78/1053090578.db2.gz NBDAZJLEBALNPS-UHFFFAOYSA-N -1 3 337.326 4.409 20 0 EIADHM Cc1ccc([C@@H](C)NCc2cc(=O)oc3cc([O-])c(Cl)cc23)s1 ZINC000794569856 1053090819 /nfs/dbraw/zinc/09/08/19/1053090819.db2.gz LQMZYWKIUPEGDB-SNVBAGLBSA-N -1 3 349.839 4.373 20 0 EIADHM O=c1ccnc(C=Cc2ccc(Oc3cc(F)cc(F)c3)cc2)[n-]1 ZINC000764433067 1053100562 /nfs/dbraw/zinc/10/05/62/1053100562.db2.gz AYAXCEJMADYPCV-UTCJRWHESA-N -1 3 326.302 4.423 20 0 EIADHM Cc1oc(CN2CCC(Cc3ccc(Cl)cc3)CC2)cc1C(=O)[O-] ZINC000864361462 1053247684 /nfs/dbraw/zinc/24/76/84/1053247684.db2.gz GOACMEICCSDFTC-UHFFFAOYSA-N -1 3 347.842 4.394 20 0 EIADHM [O-]c1ccc(CN[C@@H](CCc2ccccc2)C(F)(F)F)cc1F ZINC000775632120 1053251952 /nfs/dbraw/zinc/25/19/52/1053251952.db2.gz HINAYUWOQUUQAE-INIZCTEOSA-N -1 3 327.321 4.185 20 0 EIADHM CC(C)(C)Oc1cccc(CN[C@H](CC(=O)[O-])c2cccs2)c1 ZINC000864510335 1053295439 /nfs/dbraw/zinc/29/54/39/1053295439.db2.gz ZXWBYUYWKFUQKH-OAHLLOKOSA-N -1 3 333.453 4.231 20 0 EIADHM O=C([O-])CCc1cccc(CNCc2ccccc2C(F)(F)F)c1 ZINC000864518163 1053299562 /nfs/dbraw/zinc/29/95/62/1053299562.db2.gz WJAWUOAMLZHNGL-UHFFFAOYSA-N -1 3 337.341 4.012 20 0 EIADHM CCc1ccccc1[C@H](CC(=O)[O-])NCc1cnc(C(C)C)s1 ZINC000864528319 1053307372 /nfs/dbraw/zinc/30/73/72/1053307372.db2.gz NTZSFEZOKMHRRH-INIZCTEOSA-N -1 3 332.469 4.135 20 0 EIADHM Cc1cccc(Cl)c1S(=O)(=O)[N-]c1ccc(Cl)cc1F ZINC001195308187 1053371577 /nfs/dbraw/zinc/37/15/77/1053371577.db2.gz KQVIAAFINCHHIV-UHFFFAOYSA-N -1 3 334.199 4.242 20 0 EIADHM Cc1cccc(Cl)c1S(=O)(=O)[N-]c1cc(F)ccc1Cl ZINC001195309062 1053373659 /nfs/dbraw/zinc/37/36/59/1053373659.db2.gz ZEHHJYNTIIFSMI-UHFFFAOYSA-N -1 3 334.199 4.242 20 0 EIADHM Cc1cc(=O)[n-]c(-c2cccc(OC(=O)[C@H]3CCCC4(CC4)C3)c2)n1 ZINC000850860091 1053375397 /nfs/dbraw/zinc/37/53/97/1053375397.db2.gz CTCGFSONNWFTCN-HNNXBMFYSA-N -1 3 338.407 4.033 20 0 EIADHM Cc1cccc(Cl)c1S(=O)(=O)[N-]c1ccc(F)c(C)c1F ZINC001195316763 1053375580 /nfs/dbraw/zinc/37/55/80/1053375580.db2.gz HKGMSEOEJLQQIV-UHFFFAOYSA-N -1 3 331.771 4.036 20 0 EIADHM CCc1cc(=O)[n-]c(CN(CC)C(c2ccccc2)c2ccccc2)n1 ZINC001195476934 1053416769 /nfs/dbraw/zinc/41/67/69/1053416769.db2.gz LHLCEQWRSGPAJW-UHFFFAOYSA-N -1 3 347.462 4.356 20 0 EIADHM CC(C)(C(=O)[O-])[C@@H]1CCCN(Cc2ccc(F)cc2C(F)(F)F)C1 ZINC000325413727 1053436331 /nfs/dbraw/zinc/43/63/31/1053436331.db2.gz FOSWSURWVFKEGY-GFCCVEGCSA-N -1 3 347.352 4.167 20 0 EIADHM Cc1ccc(N(Cc2nc3c4ccccc4oc3c(=O)[n-]2)C(C)C)cc1 ZINC000110182917 1053515349 /nfs/dbraw/zinc/51/53/49/1053515349.db2.gz QUHUTGHHWDBITJ-UHFFFAOYSA-N -1 3 347.418 4.393 20 0 EIADHM Cc1ccc(C(=O)CCC(=O)Nc2cc(Cl)ccc2[O-])cc1C ZINC000111210518 1053663784 /nfs/dbraw/zinc/66/37/84/1053663784.db2.gz VDDYWXJDOWJSMZ-UHFFFAOYSA-N -1 3 331.799 4.264 20 0 EIADHM Cc1cccc(C(C)C)c1[N-]S(=O)(=O)c1ccc2c(c1)CCC2 ZINC000016130595 1053672280 /nfs/dbraw/zinc/67/22/80/1053672280.db2.gz USBJDKNOHDDKLR-UHFFFAOYSA-N -1 3 329.465 4.408 20 0 EIADHM CCc1ccc(C(=O)N(Cc2cccc(OC)c2)CC(C)C)c([O-])c1 ZINC001626916789 1053676798 /nfs/dbraw/zinc/67/67/98/1053676798.db2.gz NAWLYCNLEASTGG-UHFFFAOYSA-N -1 3 341.451 4.262 20 0 EIADHM CCCCc1nnc([N-]C(=O)c2oc3ccc(F)cc3c2C)s1 ZINC000020676697 1053725921 /nfs/dbraw/zinc/72/59/21/1053725921.db2.gz DFQDZKRYXGSOBR-UHFFFAOYSA-N -1 3 333.388 4.327 20 0 EIADHM CC1(C)CN(Cc2cc(=O)[n-]c(C3CC3)n2)c2ccc(Cl)cc21 ZINC001196771871 1053763877 /nfs/dbraw/zinc/76/38/77/1053763877.db2.gz HPVRROMBRRIHBR-UHFFFAOYSA-N -1 3 329.831 4.011 20 0 EIADHM CCCCc1nnc([N-]C(=O)c2nc(-c3ccco3)sc2C)s1 ZINC000023098744 1053768206 /nfs/dbraw/zinc/76/82/06/1053768206.db2.gz KXTDXYAVTLOROA-UHFFFAOYSA-N -1 3 348.453 4.158 20 0 EIADHM COc1ccc(F)cc1[C@H](C)NC(=O)c1cc([O-])c2ccccc2c1 ZINC000471787659 1053834165 /nfs/dbraw/zinc/83/41/65/1053834165.db2.gz NINWGTLZGLLGCV-LBPRGKRZSA-N -1 3 339.366 4.184 20 0 EIADHM COc1c(Cl)cc(NC(=O)c2cc(C)ccc2[O-])cc1Cl ZINC001292516102 1053851298 /nfs/dbraw/zinc/85/12/98/1053851298.db2.gz PZOZVRBOYYATDN-UHFFFAOYSA-N -1 3 326.179 4.268 20 0 EIADHM [O-]c1cccc(F)c1NC(=S)Nc1ccc(OC(F)(F)F)cc1 ZINC001197516541 1053922792 /nfs/dbraw/zinc/92/27/92/1053922792.db2.gz HMDGCTCWLPNGCM-UHFFFAOYSA-N -1 3 346.305 4.239 20 0 EIADHM Cc1ccc(C(=O)Nc2cccc(SC(=O)N(C)C)c2)c([O-])c1C ZINC000113434466 1053935052 /nfs/dbraw/zinc/93/50/52/1053935052.db2.gz DXTITQJEHRITKN-UHFFFAOYSA-N -1 3 344.436 4.035 20 0 EIADHM Cc1ccc(NC(=O)c2cc(OCc3ccccc3)ccc2[O-])cc1O ZINC001197722482 1053983610 /nfs/dbraw/zinc/98/36/10/1053983610.db2.gz FSWXDQHROHTPHA-UHFFFAOYSA-N -1 3 349.386 4.238 20 0 EIADHM O=C([N-]OCC1CCC1)[C@H]1CC=CC[C@@H]1c1nc2ccccc2s1 ZINC000856346074 1054060758 /nfs/dbraw/zinc/06/07/58/1054060758.db2.gz NUBOBBHLSLRBHT-GJZGRUSLSA-N -1 3 342.464 4.194 20 0 EIADHM O=C(c1cc2sccc2c([O-])c1)N1CCC[C@H](OC2CCC2)CC1 ZINC000871326324 1054191184 /nfs/dbraw/zinc/19/11/84/1054191184.db2.gz DKDHMFYSAROPML-HNNXBMFYSA-N -1 3 345.464 4.171 20 0 EIADHM CC[C@](C)(NC(=O)c1cc([O-])c2ccccc2c1)c1nccs1 ZINC000472203298 1054246770 /nfs/dbraw/zinc/24/67/70/1054246770.db2.gz FONOYKKSLBFKCR-SFHVURJKSA-N -1 3 326.421 4.057 20 0 EIADHM C[C@H]1CN(C)c2ccccc2N(C(=O)c2cc([O-])c3ccccc3c2)C1 ZINC000472215177 1054255550 /nfs/dbraw/zinc/25/55/50/1054255550.db2.gz PTOBJPUKSIKKBG-HNNXBMFYSA-N -1 3 346.430 4.278 20 0 EIADHM C[C@H](NCc1cccc(OCC(F)F)c1)c1cccc([O-])c1F ZINC000872047271 1054359388 /nfs/dbraw/zinc/35/93/88/1054359388.db2.gz RAIZTTJNBXMZLI-NSHDSACASA-N -1 3 325.330 4.026 20 0 EIADHM O=C([N-]c1c2nsnc2ccc1Cl)c1cc2cccc(F)c2o1 ZINC000776962051 1054360299 /nfs/dbraw/zinc/36/02/99/1054360299.db2.gz JJGDPFAJSVVFAB-UHFFFAOYSA-N -1 3 347.758 4.482 20 0 EIADHM C[C@@H](NCc1ccc(OC(F)F)c(F)c1)c1cccc([O-])c1F ZINC000872072001 1054378772 /nfs/dbraw/zinc/37/87/72/1054378772.db2.gz BMRXBKIFXHJTFH-SECBINFHSA-N -1 3 329.293 4.123 20 0 EIADHM Cc1ccc(OC2CCN(Cc3ccc(C)c(C(=O)[O-])c3)CC2)cc1 ZINC000872157981 1054412188 /nfs/dbraw/zinc/41/21/88/1054412188.db2.gz XWQMVOVKCXTCFD-UHFFFAOYSA-N -1 3 339.435 4.045 20 0 EIADHM O=c1nc(COc2ccc(Cl)cc2)[n-]c2sc3c(c21)CCCC3 ZINC000057950096 1054550002 /nfs/dbraw/zinc/55/00/02/1054550002.db2.gz HUBIOJSQZXSVBN-UHFFFAOYSA-N -1 3 346.839 4.096 20 0 EIADHM Cc1occ(C(F)(F)F)c1C(=O)[N-]c1nnc(C(C)(C)C)s1 ZINC000874134471 1054627835 /nfs/dbraw/zinc/62/78/35/1054627835.db2.gz YOPHEBIJJHGFAE-UHFFFAOYSA-N -1 3 333.335 4.008 20 0 EIADHM O=C([O-])c1ccccc1-c1ccc(CN2CCC(C(F)F)CC2)o1 ZINC000859786940 1054728541 /nfs/dbraw/zinc/72/85/41/1054728541.db2.gz BMDMBESFJHUNPQ-UHFFFAOYSA-N -1 3 335.350 4.122 20 0 EIADHM O=C(Nc1ncccc1[O-])c1ccc(CSc2ccccc2)cc1 ZINC000061038933 1054738757 /nfs/dbraw/zinc/73/87/57/1054738757.db2.gz CQUOHPBWSMBTIY-UHFFFAOYSA-N -1 3 336.416 4.332 20 0 EIADHM Cc1c(Nc2cccc([O-])c2Br)cnn1-c1ccccc1 ZINC001201376269 1054779944 /nfs/dbraw/zinc/77/99/44/1054779944.db2.gz LOPQVWNMEDTSOH-UHFFFAOYSA-N -1 3 344.212 4.392 20 0 EIADHM CC(C)c1ccc(C(=O)N2C[C@@H](c3ccccc3)O[C@@H](C)C2)c([O-])c1 ZINC000063109942 1054796517 /nfs/dbraw/zinc/79/65/17/1054796517.db2.gz UIBFNTRWEIAMTO-YWZLYKJASA-N -1 3 339.435 4.118 20 0 EIADHM CCCc1c(C(=O)Nc2cc(Cl)ccc2[O-])[nH]c(C)c1C(C)=O ZINC000063803215 1054836011 /nfs/dbraw/zinc/83/60/11/1054836011.db2.gz OTOGEAYFXNOSLR-UHFFFAOYSA-N -1 3 334.803 4.090 20 0 EIADHM CC(C)Oc1cncc(Nc2cc(Br)cc(F)c2[O-])c1 ZINC001201552839 1054841147 /nfs/dbraw/zinc/84/11/47/1054841147.db2.gz IYJWUQLQNOYBPY-UHFFFAOYSA-N -1 3 341.180 4.220 20 0 EIADHM O=C(OCc1csc(-c2ccc(F)cc2)n1)c1ccc([O-])cc1 ZINC000005694331 1054903892 /nfs/dbraw/zinc/90/38/92/1054903892.db2.gz YJGYDRUOYBJYIU-UHFFFAOYSA-N -1 3 329.352 4.012 20 0 EIADHM Cc1nc(-c2ccc(NC(=O)Nc3ccccc3C)cc2)cc(=O)[n-]1 ZINC000339034453 1055020941 /nfs/dbraw/zinc/02/09/41/1055020941.db2.gz RBEIUKITTSLYHE-UHFFFAOYSA-N -1 3 334.379 4.110 20 0 EIADHM Cc1nn(CC(C)C)c(C)c1CCC(=O)Nc1cc(Cl)ccc1[O-] ZINC000067139109 1055029857 /nfs/dbraw/zinc/02/98/57/1055029857.db2.gz XKJCWGWKZKSMCD-UHFFFAOYSA-N -1 3 349.862 4.086 20 0 EIADHM Cc1ccc([C@@H]2CCCN2C(=O)c2cc(=O)c3ccccc3[n-]2)cc1C ZINC000068221412 1055073844 /nfs/dbraw/zinc/07/38/44/1055073844.db2.gz YINFTESCPMEBRU-FQEVSTJZSA-N -1 3 346.430 4.122 20 0 EIADHM O=C(Nc1cccc(Cl)c1)Nc1ccc(Br)cc1[O-] ZINC001202247536 1055116454 /nfs/dbraw/zinc/11/64/54/1055116454.db2.gz LFUZHHOUGASIOL-UHFFFAOYSA-N -1 3 341.592 4.452 20 0 EIADHM O=C(Nc1cccc(Cl)c1)Nc1ccc([O-])c(Br)c1 ZINC001202247717 1055116586 /nfs/dbraw/zinc/11/65/86/1055116586.db2.gz ZOYASFXTPKNALM-UHFFFAOYSA-N -1 3 341.592 4.452 20 0 EIADHM Cc1cccc(NC(=O)Nc2ccc(C(=O)OC(C)(C)C)cc2[O-])c1 ZINC001202317898 1055138429 /nfs/dbraw/zinc/13/84/29/1055138429.db2.gz PONUIMNWEQVYSC-UHFFFAOYSA-N -1 3 342.395 4.300 20 0 EIADHM Cc1cc([O-])c(NC(=O)Nc2ccc(F)cc2)cc1Br ZINC001202355150 1055147787 /nfs/dbraw/zinc/14/77/87/1055147787.db2.gz XIXAAHUEBCIHBB-UHFFFAOYSA-N -1 3 339.164 4.246 20 0 EIADHM CC(C)c1ccc(CN(C)Cc2nnc(-c3ccccc3[O-])o2)cc1 ZINC000877944369 1055159469 /nfs/dbraw/zinc/15/94/69/1055159469.db2.gz BHEDBFPVDKJWPS-UHFFFAOYSA-N -1 3 337.423 4.198 20 0 EIADHM COc1ccc(NC(=O)Nc2ccc(C(F)(F)F)cc2[O-])cc1 ZINC001202392618 1055168532 /nfs/dbraw/zinc/16/85/32/1055168532.db2.gz IGVJSUPXZIFFNI-UHFFFAOYSA-N -1 3 326.274 4.064 20 0 EIADHM Cc1ccc([C@H](C)N(C)Cc2nnc(-c3ccccc3[O-])o2)c(C)c1 ZINC000877987507 1055168777 /nfs/dbraw/zinc/16/87/77/1055168777.db2.gz JYMPFDQWKYAACZ-HNNXBMFYSA-N -1 3 337.423 4.252 20 0 EIADHM O=C([N-]c1cc(-c2ccccn2)no1)Nc1ccc(C(F)(F)F)cc1 ZINC001202403951 1055173268 /nfs/dbraw/zinc/17/32/68/1055173268.db2.gz OGHSXGGFJNNTBG-UHFFFAOYSA-N -1 3 348.284 4.399 20 0 EIADHM O=C([N-]CC1(C(F)(F)F)CCCC1)C(F)(F)c1ccccc1F ZINC000863507777 1055219083 /nfs/dbraw/zinc/21/90/83/1055219083.db2.gz DTOCGYKMIUJWNT-UHFFFAOYSA-N -1 3 339.279 4.156 20 0 EIADHM Cc1ccc([O-])c(C(=O)Nc2cc(NC(=O)C(C)(C)C)ccc2C)c1 ZINC000112021492 1055229911 /nfs/dbraw/zinc/22/99/11/1055229911.db2.gz CGWXDIGDMFUOMB-UHFFFAOYSA-N -1 3 340.423 4.246 20 0 EIADHM [O-]c1coc2cc(OCc3coc(-c4cccc(Cl)c4)n3)ccc12 ZINC000642608521 1055376797 /nfs/dbraw/zinc/37/67/97/1055376797.db2.gz DVJSUCUZFICHIW-UHFFFAOYSA-N -1 3 341.750 4.149 20 0 EIADHM COc1ccc2c(c1)[C@H](C(=O)Nc1c([O-])cccc1Cl)CCC2 ZINC000655110409 1055477643 /nfs/dbraw/zinc/47/76/43/1055477643.db2.gz QZOSEJAECRQLSU-CYBMUJFWSA-N -1 3 331.799 4.113 20 0 EIADHM CC(C)[C@@H]1CCCCN1Cc1cc(C(=O)[O-])ccc1Br ZINC000903891199 1056578879 /nfs/dbraw/zinc/57/88/79/1056578879.db2.gz LJAGHFYFCWWLAA-HNNXBMFYSA-N -1 3 340.261 4.158 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1csc(-c2cccs2)n1 ZINC000111210261 1056772764 /nfs/dbraw/zinc/77/27/64/1056772764.db2.gz SPKFZOIICQFXLY-UHFFFAOYSA-N -1 3 336.825 4.483 20 0 EIADHM CCCOCc1nc(=O)c2c(-c3ccc(Cl)cc3)csc2[n-]1 ZINC000063579450 1056822849 /nfs/dbraw/zinc/82/28/49/1056822849.db2.gz WRMKZMOYCXVFLE-UHFFFAOYSA-N -1 3 334.828 4.232 20 0 EIADHM CCCCC[C@H](C)CC(=O)Nc1ccc(-c2nc(C)cc(=O)[n-]2)cc1 ZINC000742583322 1058680406 /nfs/dbraw/zinc/68/04/06/1058680406.db2.gz OQOZMKUBWZLPTH-AWEZNQCLSA-N -1 3 341.455 4.290 20 0 EIADHM Cc1ccc(N2CCCC2)c(C(=O)Nc2cc(Cl)ccc2[O-])c1 ZINC000743316834 1058922371 /nfs/dbraw/zinc/92/23/71/1058922371.db2.gz ILBZXURICINOMQ-UHFFFAOYSA-N -1 3 330.815 4.207 20 0 EIADHM COC(=O)Nc1ccc(C(=O)O[C@H](C)c2cccc(Cl)c2)cc1[O-] ZINC000745654684 1059862013 /nfs/dbraw/zinc/86/20/13/1059862013.db2.gz WBFUCSYEFBBCRO-SNVBAGLBSA-N -1 3 349.770 4.142 20 0 EIADHM CC[C@@H]([N-]C(=O)C(F)(F)c1ccccc1)c1ccc(F)cc1F ZINC000737643156 1060304064 /nfs/dbraw/zinc/30/40/64/1060304064.db2.gz AKJWRKDKSWFWPZ-OAHLLOKOSA-N -1 3 325.305 4.324 20 0 EIADHM [O-]c1cc(Nc2cn3cc(Br)ccc3n2)ccc1Cl ZINC001212589382 1060775808 /nfs/dbraw/zinc/77/58/08/1060775808.db2.gz IRXOXKILCGRLML-UHFFFAOYSA-N -1 3 338.592 4.199 20 0 EIADHM COC(=O)c1cccc2c(Nc3ccc(Cl)c([O-])c3)ccnc12 ZINC001212590557 1060831355 /nfs/dbraw/zinc/83/13/55/1060831355.db2.gz ROLVJGVDKDKEEA-UHFFFAOYSA-N -1 3 328.755 4.124 20 0 EIADHM CCOC(=O)c1ncc(Nc2ccc(Cl)c([O-])c2)cc1Cl ZINC001212590504 1060831811 /nfs/dbraw/zinc/83/18/11/1060831811.db2.gz PLMMOFDRDLFGRT-UHFFFAOYSA-N -1 3 327.167 4.014 20 0 EIADHM [O-]c1cc(Nc2ccc(OC[C@@H]3CCCO3)c(F)c2)ccc1Cl ZINC001212592446 1060891379 /nfs/dbraw/zinc/89/13/79/1060891379.db2.gz QCCGXAURCDITFF-ZDUSSCGKSA-N -1 3 337.778 4.486 20 0 EIADHM Cc1c(-c2ccccc2)sc2ncnc(NCc3ncccc3[O-])c12 ZINC001169731363 1060932543 /nfs/dbraw/zinc/93/25/43/1060932543.db2.gz CLPNRFZUDNGPNY-UHFFFAOYSA-N -1 3 348.431 4.379 20 0 EIADHM [O-]c1cccnc1CNc1nc2ccccc2c(Oc2ccccc2)n1 ZINC001169732441 1060934708 /nfs/dbraw/zinc/93/47/08/1060934708.db2.gz XIMUJUIHYCCKSK-UHFFFAOYSA-N -1 3 344.374 4.135 20 0 EIADHM [O-]c1cc(Nc2c(F)cccc2OC2CCOCC2)ccc1Cl ZINC001212594963 1060978048 /nfs/dbraw/zinc/97/80/48/1060978048.db2.gz FJHZGNQNUUXCJJ-UHFFFAOYSA-N -1 3 337.778 4.486 20 0 EIADHM O=C([N-]c1cc(F)c(F)cc1F)c1sccc1Br ZINC000104188517 219358563 /nfs/dbraw/zinc/35/85/63/219358563.db2.gz MXVYVHLTGKASQB-UHFFFAOYSA-N -1 3 336.132 4.180 20 0 EIADHM C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)Nc1ccccc1[O-] ZINC000021866415 212257029 /nfs/dbraw/zinc/25/70/29/212257029.db2.gz XOWIOLRGHMHSGF-VIFPVBQESA-N -1 3 326.179 4.105 20 0 EIADHM CCC(CC)c1nnc([N-]C(=O)c2c(F)cccc2Cl)s1 ZINC000028701384 521636710 /nfs/dbraw/zinc/63/67/10/521636710.db2.gz LMESAKQGDBOBNV-UHFFFAOYSA-N -1 3 327.812 4.487 20 0 EIADHM CN(CCCc1ccccc1)C(F)(F)c1cc(Cl)nc(=S)[n-]1 ZINC001165035601 721880652 /nfs/dbraw/zinc/88/06/52/721880652.db2.gz FZMFHUFBFCBDTG-UHFFFAOYSA-N -1 3 343.830 4.033 20 0 EIADHM Nc1ccc(F)c(Br)c1Nc1cccc([O-])c1Cl ZINC001210859751 1021810372 /nfs/dbraw/zinc/81/03/72/1021810372.db2.gz MUFBQYVJTCVPHX-UHFFFAOYSA-N -1 3 331.572 4.273 20 0 EIADHM Cc1ccc2c(CCC(=O)Nc3ccc(Cl)cc3[O-])c[nH]c2c1 ZINC000533159416 1032514626 /nfs/dbraw/zinc/51/46/26/1032514626.db2.gz ZBULELZSBOIUPY-UHFFFAOYSA-N -1 3 328.799 4.407 20 0 EIADHM Cc1cc(CNCc2cccc(C(=O)[O-])c2)ccc1Oc1cccnc1 ZINC000683176685 1019108199 /nfs/dbraw/zinc/10/81/99/1019108199.db2.gz OBCPDBFIQNGAAT-UHFFFAOYSA-N -1 3 348.402 4.170 20 0 EIADHM CCc1ccc([O-])c(C(=O)Nc2ccc(NC(=O)CC(C)C)cc2)c1 ZINC000500723531 1032836741 /nfs/dbraw/zinc/83/67/41/1032836741.db2.gz WCPWYKQSJLXLSB-UHFFFAOYSA-N -1 3 340.423 4.192 20 0 EIADHM O=C(CCc1ncc(-c2ccccc2)o1)Nc1ccc(Cl)cc1[O-] ZINC000153683570 1020374130 /nfs/dbraw/zinc/37/41/30/1020374130.db2.gz XJKILUHBPNXEPR-UHFFFAOYSA-N -1 3 342.782 4.272 20 0 EIADHM Nc1cccc2c(Br)cn(-c3cccc(Cl)c3[O-])c21 ZINC001210222617 1020960321 /nfs/dbraw/zinc/96/03/21/1020960321.db2.gz QZTYTIIBGJOAEC-UHFFFAOYSA-N -1 3 337.604 4.334 20 0 EIADHM Cc1ccc([N-]S(=O)(=O)c2ccc(OC3CCCC3)cc2)c(C)c1 ZINC000096659189 1032973807 /nfs/dbraw/zinc/97/38/07/1032973807.db2.gz NWDJBTDYRUNZCG-UHFFFAOYSA-N -1 3 345.464 4.426 20 0 EIADHM O=C(N[C@H]1CC[C@@H](Cc2ccccc2)C1)c1cc(=O)c2ccccc2[n-]1 ZINC000275752265 1021503871 /nfs/dbraw/zinc/50/38/71/1021503871.db2.gz CYDXNMMCRNFMFE-IRXDYDNUSA-N -1 3 346.430 4.082 20 0 EIADHM CC(C)c1ccc(-c2nc(CN[C@H](C)[C@H](C)C(=O)[O-])cs2)cc1 ZINC000580085646 1021626180 /nfs/dbraw/zinc/62/61/80/1021626180.db2.gz WUMSVIBBJGYFLG-QWHCGFSZSA-N -1 3 332.469 4.132 20 0 EIADHM O=C(Nc1csc(-c2ccccc2)n1)c1cc([O-])ccc1Cl ZINC000685854916 1021775347 /nfs/dbraw/zinc/77/53/47/1021775347.db2.gz FSKRNKJIFADJJQ-UHFFFAOYSA-N -1 3 330.796 4.421 20 0 EIADHM CCOC(=O)c1cnc(Nc2cccc([O-])c2Cl)c(Cl)c1 ZINC001210851546 1021799244 /nfs/dbraw/zinc/79/92/44/1021799244.db2.gz BPHUWFMTHJWYEY-UHFFFAOYSA-N -1 3 327.167 4.014 20 0 EIADHM O=C(Nc1ccc2[nH]c(C3CCC3)nc2c1)c1cc([O-])ccc1Cl ZINC000431788432 1021846327 /nfs/dbraw/zinc/84/63/27/1021846327.db2.gz ZUTKQMDHAUWXGL-UHFFFAOYSA-N -1 3 341.798 4.442 20 0 EIADHM O=C(Nc1ccc(-c2ccco2)cc1F)c1c[n-]c2ccccc2c1=O ZINC000683887956 1021878459 /nfs/dbraw/zinc/87/84/59/1021878459.db2.gz YFMCOTBDMXKBGZ-UHFFFAOYSA-N -1 3 348.333 4.180 20 0 EIADHM Cc1cccc(CN[C@H](CC(=O)[O-])c2cccc(C(F)(F)F)c2)c1 ZINC000340678973 1021905044 /nfs/dbraw/zinc/90/50/44/1021905044.db2.gz NQTNDIWTUXGYEL-MRXNPFEDSA-N -1 3 337.341 4.319 20 0 EIADHM CCc1ccc([O-])c(C(=O)N(CCCCOC)Cc2ccccc2)c1 ZINC000556950096 1021963032 /nfs/dbraw/zinc/96/30/32/1021963032.db2.gz PMFLMOGXKDMAEZ-UHFFFAOYSA-N -1 3 341.451 4.024 20 0 EIADHM C[C@@H](c1cccc(Br)c1)N1CCC[C@H](CCC(=O)[O-])C1 ZINC000086809322 1021977303 /nfs/dbraw/zinc/97/73/03/1021977303.db2.gz FQYCKDYKDZLPLI-QWHCGFSZSA-N -1 3 340.261 4.087 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)N1CCC[C@@H]1c1cccc(F)c1 ZINC000468641288 1022305754 /nfs/dbraw/zinc/30/57/54/1022305754.db2.gz ZMGBGUNNHHJKFD-GOSISDBHSA-N -1 3 345.389 4.357 20 0 EIADHM CC(=O)c1cccc(NC(=O)C(C)(C)c2ccc(Cl)cc2F)c1[O-] ZINC000565744016 1022326297 /nfs/dbraw/zinc/32/62/97/1022326297.db2.gz QRFIIJPUOKKBSJ-UHFFFAOYSA-N -1 3 349.789 4.304 20 0 EIADHM CCc1ccc([O-])c(C(=O)N2CCC(c3ncccc3Cl)CC2)c1 ZINC000430497973 1022337125 /nfs/dbraw/zinc/33/71/25/1022337125.db2.gz VTUFPIYMQVNILR-UHFFFAOYSA-N -1 3 344.842 4.023 20 0 EIADHM CC(C)c1ccc(C(=O)N2CCC[C@@H]2[C@H]2CCCC[C@]2(C)O)c([O-])c1 ZINC000408409713 1033047529 /nfs/dbraw/zinc/04/75/29/1033047529.db2.gz BXHHVXOUIDWWGN-OPYAIIAOSA-N -1 3 345.483 4.061 20 0 EIADHM O=C(Nc1ccc(Br)cc1[O-])c1csc(Cl)c1 ZINC000526053368 1022664637 /nfs/dbraw/zinc/66/46/37/1022664637.db2.gz QVWCAIKPNFKMLD-UHFFFAOYSA-N -1 3 332.606 4.122 20 0 EIADHM CC(C)[C@H]1CN(C(=O)c2cc([O-])ccc2Cl)c2ccccc2N1 ZINC000431864090 1022760967 /nfs/dbraw/zinc/76/09/67/1022760967.db2.gz VIEWGXOUFYVXFJ-MRXNPFEDSA-N -1 3 330.815 4.143 20 0 EIADHM O=C([N-]c1cc(-c2ccccc2F)on1)c1ncoc1-c1ccccc1 ZINC000684153877 1022858726 /nfs/dbraw/zinc/85/87/26/1022858726.db2.gz NGOIJQGRUBMYOR-UHFFFAOYSA-N -1 3 349.321 4.388 20 0 EIADHM O=C(Nc1cccc([O-])c1F)c1cc(Br)ccc1Cl ZINC000128458970 1022885591 /nfs/dbraw/zinc/88/55/91/1022885591.db2.gz ZIQUDZIMWAXGCQ-UHFFFAOYSA-N -1 3 344.567 4.200 20 0 EIADHM O=C(N[C@@H](c1ccc(F)cc1)C1CCC1)c1cc([O-])ccc1Cl ZINC000581340551 1023036036 /nfs/dbraw/zinc/03/60/36/1023036036.db2.gz DEJQBGRMLVOEGK-QGZVFWFLSA-N -1 3 333.790 4.456 20 0 EIADHM [O-]C(=Cc1nc(-c2ccccc2Cl)no1)c1ccccc1Cl ZINC001211644822 1023116057 /nfs/dbraw/zinc/11/60/57/1023116057.db2.gz FTOXLLUPGZTSGU-UHFFFAOYSA-N -1 3 333.174 4.469 20 0 EIADHM CS[C@@H]1CCCCN([C@@H](C(=O)[O-])c2ccc(Cl)cc2Cl)C1 ZINC000584637764 1023138251 /nfs/dbraw/zinc/13/82/51/1023138251.db2.gz BUZFEGLIFGBYFW-BXUZGUMPSA-N -1 3 348.295 4.337 20 0 EIADHM Cc1noc(C)c1[N-]C(=O)c1cc(Cl)c(Br)cc1F ZINC001125498326 1023161950 /nfs/dbraw/zinc/16/19/50/1023161950.db2.gz IMCBEHKAEOSZFR-UHFFFAOYSA-N -1 3 347.571 4.099 20 0 EIADHM CCc1onc(C)c1NC(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000180009684 1023221829 /nfs/dbraw/zinc/22/18/29/1023221829.db2.gz RAOYNLZFAVOPHT-UHFFFAOYSA-N -1 3 338.363 4.296 20 0 EIADHM CC1(C)[C@H](CCC(=O)[O-])C[C@@H]1NCc1csc(-c2ccccc2)n1 ZINC000656568604 1023239793 /nfs/dbraw/zinc/23/97/93/1023239793.db2.gz HSQSPOCVZGESGI-ZBFHGGJFSA-N -1 3 344.480 4.179 20 0 EIADHM CCC(C)(C)[C@H](NCc1csc(-c2ccc(C)cc2)n1)C(=O)[O-] ZINC000584720432 1023240703 /nfs/dbraw/zinc/24/07/03/1023240703.db2.gz IDPLPOVDIGGYTJ-OAHLLOKOSA-N -1 3 332.469 4.098 20 0 EIADHM O=C(NC[C@H]1CC[C@@H](c2ccccc2)O1)c1cc([O-])c2ccccc2c1 ZINC000460859561 1023246825 /nfs/dbraw/zinc/24/68/25/1023246825.db2.gz DLPPXKVALBLFQP-NQIIRXRSSA-N -1 3 347.414 4.196 20 0 EIADHM CC[C@@H]1CCC[C@H](C)N1Cc1coc(-c2ccc(C(=O)[O-])cc2)n1 ZINC000659804208 1023286810 /nfs/dbraw/zinc/28/68/10/1023286810.db2.gz WDPVANBAQYWVNG-SUMWQHHRSA-N -1 3 328.412 4.193 20 0 EIADHM O=C([O-])c1cccc(CN2CCC[C@H]2Cc2c(F)cccc2Cl)c1 ZINC000414642746 1023309347 /nfs/dbraw/zinc/30/93/47/1023309347.db2.gz WGUZFASOCGHPDO-HNNXBMFYSA-N -1 3 347.817 4.384 20 0 EIADHM CC(C)Cc1ncc(CN[C@@H](CCC(=O)[O-])c2ccccc2)s1 ZINC000417593204 1023368460 /nfs/dbraw/zinc/36/84/60/1023368460.db2.gz FZGUPPYFMNLNAN-INIZCTEOSA-N -1 3 332.469 4.037 20 0 EIADHM CC(C)=CCSC[C@@H](NCc1ccc(Cl)cc1Cl)C(=O)[O-] ZINC000417621852 1023377488 /nfs/dbraw/zinc/37/74/88/1023377488.db2.gz GMZNAKFXZDKPQD-CQSZACIVSA-N -1 3 348.295 4.236 20 0 EIADHM CC(C)(C)c1ccc(CN2C[C@H](C(=O)[O-])C[C@H](C(F)(F)F)C2)cc1 ZINC000656757359 1023499758 /nfs/dbraw/zinc/49/97/58/1023499758.db2.gz OKMAWVQNMKKAMN-HIFRSBDPSA-N -1 3 343.389 4.069 20 0 EIADHM O=C(/C=C\c1ccccc1OC(F)(F)F)Nc1cccc([O-])c1F ZINC000255339279 1023509094 /nfs/dbraw/zinc/50/90/94/1023509094.db2.gz MZMOVBPLHDHASQ-HJWRWDBZSA-N -1 3 341.260 4.082 20 0 EIADHM O=C([O-])c1ccccc1OCCN1CCCC[C@H]1c1ccc(F)cc1 ZINC000364246128 1023523267 /nfs/dbraw/zinc/52/32/67/1023523267.db2.gz RVHCIFLKZXGIHN-SFHVURJKSA-N -1 3 343.398 4.130 20 0 EIADHM CSc1ccsc1C(=O)[N-]c1nnc(-c2ccccc2)s1 ZINC000500132591 1023530009 /nfs/dbraw/zinc/53/00/09/1023530009.db2.gz MYMUINGXNYEQGB-UHFFFAOYSA-N -1 3 333.463 4.241 20 0 EIADHM O=C(Nc1ccc([O-])c(C(F)(F)F)c1)c1coc(C2CCCC2)n1 ZINC000549310522 1023701963 /nfs/dbraw/zinc/70/19/63/1023701963.db2.gz JGRPGFQTBVSGBB-UHFFFAOYSA-N -1 3 340.301 4.309 20 0 EIADHM CC(C)[C@H](c1ccccc1)N(C)C(=O)NCc1ccc([O-])c(F)c1 ZINC000163768502 1023703413 /nfs/dbraw/zinc/70/34/13/1023703413.db2.gz SFVXGYONSDQYBJ-GOSISDBHSA-N -1 3 330.403 4.070 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1ccc(Br)s1 ZINC000008189353 1023741121 /nfs/dbraw/zinc/74/11/21/1023741121.db2.gz XEWVTGCOPFJVLI-UHFFFAOYSA-N -1 3 332.606 4.122 20 0 EIADHM CCc1ccc([O-])c(C(=O)N(C)Cc2ccc3cc(OC)ccc3c2)c1 ZINC000500415512 1023812655 /nfs/dbraw/zinc/81/26/55/1023812655.db2.gz QWGZVXQSOYKEPO-UHFFFAOYSA-N -1 3 349.430 4.389 20 0 EIADHM CC[C@H](C)Oc1ccc([N-]S(=O)(=O)c2ccc(C)c(C)c2)cc1 ZINC000511702928 1023833896 /nfs/dbraw/zinc/83/38/96/1023833896.db2.gz ZSHQVGXNSZSIER-HNNXBMFYSA-N -1 3 333.453 4.282 20 0 EIADHM Cc1ccc(Cl)cc1C(=O)Nc1cc(Br)ccc1[O-] ZINC000511816182 1023902772 /nfs/dbraw/zinc/90/27/72/1023902772.db2.gz BLZQFNYXRMNVEY-UHFFFAOYSA-N -1 3 340.604 4.369 20 0 EIADHM CCc1cccc(C(=O)N2CC=C(c3c(F)cccc3F)CC2)c1[O-] ZINC000548435113 1024477724 /nfs/dbraw/zinc/47/77/24/1024477724.db2.gz GAUTXECCPKOARI-UHFFFAOYSA-N -1 3 343.373 4.162 20 0 EIADHM O=c1cc(C(F)(F)F)nc(CNc2cccc(-c3ccccc3)c2)[n-]1 ZINC000431072094 1024522754 /nfs/dbraw/zinc/52/27/54/1024522754.db2.gz DIAGFRJZFJQPCQ-UHFFFAOYSA-N -1 3 345.324 4.480 20 0 EIADHM O=C([N-]c1cccc(Cl)c1SCC(F)F)c1ccsn1 ZINC001126167183 1024709987 /nfs/dbraw/zinc/70/99/87/1024709987.db2.gz DTQDAXIOJVEHSH-UHFFFAOYSA-N -1 3 334.800 4.406 20 0 EIADHM O=C(N[C@@H]1CC[C@H](c2cccc(F)c2)C1)c1cc([O-])ccc1Cl ZINC000510904885 1024771840 /nfs/dbraw/zinc/77/18/40/1024771840.db2.gz COQSNGXRZQYSQZ-GXTWGEPZSA-N -1 3 333.790 4.251 20 0 EIADHM O=C([O-])c1ccc(-c2nc(CN3CCC[C@@H]4CCCC[C@@H]43)co2)cc1 ZINC000663316382 1025059422 /nfs/dbraw/zinc/05/94/22/1025059422.db2.gz WPMKFDMKGZCMTJ-KSSFIOAISA-N -1 3 340.423 4.194 20 0 EIADHM COc1cc(C(=O)/C=C/c2csc(-c3ccccc3)n2)ccc1[O-] ZINC000023987269 1025062405 /nfs/dbraw/zinc/06/24/05/1025062405.db2.gz MMTAJSMPRVSHJM-CSKARUKUSA-N -1 3 337.400 4.420 20 0 EIADHM CC(C)(N)c1cc(C(=O)[N-]c2ccccc2SC2CCCC2)on1 ZINC000662495645 1025199204 /nfs/dbraw/zinc/19/92/04/1025199204.db2.gz WCNMHFRFIRSLEH-UHFFFAOYSA-N -1 3 345.468 4.155 20 0 EIADHM CCOCCOc1ccc(Cl)cc1NCc1cc([O-])cc(F)c1 ZINC000472072697 1025639933 /nfs/dbraw/zinc/63/99/33/1025639933.db2.gz JHCIBJSZBRNHSQ-UHFFFAOYSA-N -1 3 339.794 4.212 20 0 EIADHM CC[C@H]1CN(Cc2cc(=O)[n-]c(-c3ccccc3)n2)c2ccccc2O1 ZINC001167513930 1025870877 /nfs/dbraw/zinc/87/08/77/1025870877.db2.gz ZXNNPAHOBQOHNV-KRWDZBQOSA-N -1 3 347.418 4.027 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1cnn(-c2cccc(Cl)c2)c1 ZINC000111211067 1026097472 /nfs/dbraw/zinc/09/74/72/1026097472.db2.gz USKWJRZQVITQEL-UHFFFAOYSA-N -1 3 348.189 4.137 20 0 EIADHM C[C@@H](CC(C)(C)c1ccccc1)NC(=O)NCc1ccc([O-])c(F)c1 ZINC000606659583 1026290458 /nfs/dbraw/zinc/29/04/58/1026290458.db2.gz OBCKYXBDOBCDQZ-AWEZNQCLSA-N -1 3 344.430 4.087 20 0 EIADHM Cc1ccc(-c2nc(Cc3ccccc3Br)no2)c([O-])c1 ZINC000111688543 1026318405 /nfs/dbraw/zinc/31/84/05/1026318405.db2.gz YWUZXWAYTMBEBA-UHFFFAOYSA-N -1 3 345.196 4.104 20 0 EIADHM Cc1ccc(-c2nc(-c3ccc(Br)cc3)no2)c([O-])c1 ZINC000111687761 1026319638 /nfs/dbraw/zinc/31/96/38/1026319638.db2.gz CNEUVMSVHOBXQX-UHFFFAOYSA-N -1 3 331.169 4.180 20 0 EIADHM O=C([O-])CCCCCN1CCC[C@@H]1c1ccc(Br)cc1 ZINC000563284811 1026336511 /nfs/dbraw/zinc/33/65/11/1026336511.db2.gz WBOKWVIHWPYDKV-OAHLLOKOSA-N -1 3 340.261 4.231 20 0 EIADHM CC(C)Cc1ccc([C@H]([N-]C(=O)C(F)(F)C(F)F)C2CC2)cc1 ZINC001125588932 1026382579 /nfs/dbraw/zinc/38/25/79/1026382579.db2.gz JYBRVJYHRMHTBX-AWEZNQCLSA-N -1 3 331.353 4.353 20 0 EIADHM COc1ccc([C@@H](CCC(=O)[O-])NCc2cc3ccccc3o2)cc1 ZINC000426717712 1026499588 /nfs/dbraw/zinc/49/95/88/1026499588.db2.gz RGRFKZMVHBKRTH-GOSISDBHSA-N -1 3 339.391 4.137 20 0 EIADHM Cc1cc(CN[C@@H](C(=O)[O-])c2ccc(Cl)c(F)c2)ccc1Cl ZINC000426732716 1026514716 /nfs/dbraw/zinc/51/47/16/1026514716.db2.gz VCKZXWHLNOQQIM-OAHLLOKOSA-N -1 3 342.197 4.356 20 0 EIADHM O=C([O-])[C@@H](NCc1ccc(Cl)cc1)c1ccc(Cl)c(F)c1 ZINC000426762598 1026529603 /nfs/dbraw/zinc/52/96/03/1026529603.db2.gz LQYJUALZRYZGHT-AWEZNQCLSA-N -1 3 328.170 4.048 20 0 EIADHM C[C@H](C(=O)[O-])[C@H](NCc1ccc(-c2ccccc2)o1)c1ccccc1 ZINC000426753072 1026537795 /nfs/dbraw/zinc/53/77/95/1026537795.db2.gz GPADKTJTDMRFGM-YWZLYKJASA-N -1 3 335.403 4.498 20 0 EIADHM CC1(C)CCC[C@@H]([N-]S(=O)(=O)c2cccc(Cl)c2Cl)C1 ZINC001211543805 1026548780 /nfs/dbraw/zinc/54/87/80/1026548780.db2.gz OXNVOJLZVSYZHB-SNVBAGLBSA-N -1 3 336.284 4.241 20 0 EIADHM COc1cccc(CN[C@@H](CC(=O)[O-])c2ccc(C(C)C)cc2)c1 ZINC000426805357 1026560948 /nfs/dbraw/zinc/56/09/48/1026560948.db2.gz ATIPFLXVWCZFPO-IBGZPJMESA-N -1 3 327.424 4.124 20 0 EIADHM COc1cccc([C@H](CC(=O)[O-])NCc2ccc(C(C)(C)C)cc2)c1 ZINC000426767659 1026561370 /nfs/dbraw/zinc/56/13/70/1026561370.db2.gz PECOREGMHNGNCH-IBGZPJMESA-N -1 3 341.451 4.298 20 0 EIADHM Cc1cc([C@H](NCc2cc(F)cc(Cl)c2)C(=O)[O-])ccc1Cl ZINC000426786462 1026563949 /nfs/dbraw/zinc/56/39/49/1026563949.db2.gz VTSYYOMQYGNRDU-HNNXBMFYSA-N -1 3 342.197 4.356 20 0 EIADHM CSc1ccc(CN[C@@H](CC(=O)[O-])c2cccc(Cl)c2)cc1 ZINC000426798810 1026568645 /nfs/dbraw/zinc/56/86/45/1026568645.db2.gz JSWLRNUCVVVPPP-INIZCTEOSA-N -1 3 335.856 4.368 20 0 EIADHM [O-]c1ccc(F)c(CN(Cc2ccco2)Cc2ccccc2)c1F ZINC000506993611 1026578974 /nfs/dbraw/zinc/57/89/74/1026578974.db2.gz WRRDVRPNRSONOE-UHFFFAOYSA-N -1 3 329.346 4.466 20 0 EIADHM N#CC(=C([O-])C=Cc1ccsc1)c1nc2ccccc2n1C(F)F ZINC000051655596 1026592326 /nfs/dbraw/zinc/59/23/26/1026592326.db2.gz WLVGFAKNIOJZSC-FYJFLYSWSA-N -1 3 343.358 4.383 20 0 EIADHM COc1ccc(OC)c([C@H]2CCCN2Cc2cccc([O-])c2Cl)c1 ZINC000507022452 1026600102 /nfs/dbraw/zinc/60/01/02/1026600102.db2.gz OWDACKBLBOKZNH-MRXNPFEDSA-N -1 3 347.842 4.400 20 0 EIADHM CN(Cc1ccccc1C(F)(F)F)Cc1c(F)ccc([O-])c1F ZINC000507097651 1026629048 /nfs/dbraw/zinc/62/90/48/1026629048.db2.gz ISYHDIOKKOQIFZ-UHFFFAOYSA-N -1 3 331.284 4.321 20 0 EIADHM COc1ccc([C@H]2CCCN2Cc2c(F)ccc([O-])c2F)cc1OC ZINC000507081779 1026633581 /nfs/dbraw/zinc/63/35/81/1026633581.db2.gz MYVACEZOSNTMBS-OAHLLOKOSA-N -1 3 349.377 4.025 20 0 EIADHM [O-]c1ccc(F)c(CN(Cc2ccc(F)cc2F)C2CC2)c1F ZINC000507171988 1026684194 /nfs/dbraw/zinc/68/41/94/1026684194.db2.gz YIRRZHFJZPNJJO-UHFFFAOYSA-N -1 3 325.305 4.113 20 0 EIADHM CO[C@@H](C)c1nc(C)c(C(=O)[N-]c2cccc(F)c2SC)s1 ZINC000617275977 1026709706 /nfs/dbraw/zinc/70/97/06/1026709706.db2.gz RIJMBOBSPGFAIC-VIFPVBQESA-N -1 3 340.445 4.272 20 0 EIADHM COCc1cccc(C=C(Cc2ccccc2)c2nccc(=O)[n-]2)c1 ZINC000432701682 1026801960 /nfs/dbraw/zinc/80/19/60/1026801960.db2.gz BPEQFWBOHDDUQY-RGEXLXHISA-N -1 3 332.403 4.112 20 0 EIADHM CC(C)[C@H](C(=O)Nc1ccc([O-])c(C(F)(F)F)c1)c1ccncc1 ZINC000500525304 1026820524 /nfs/dbraw/zinc/82/05/24/1026820524.db2.gz NUDXDTJRSKFXPW-HNNXBMFYSA-N -1 3 338.329 4.184 20 0 EIADHM CC[C@]1(C)CCCN(Cc2ccc(C(=O)[O-])cc2Br)C1 ZINC000519831384 1027009730 /nfs/dbraw/zinc/00/97/30/1027009730.db2.gz YJZMFZGSENUBCX-MRXNPFEDSA-N -1 3 340.261 4.159 20 0 EIADHM O=C(CCCc1cccs1)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000440997423 1027178856 /nfs/dbraw/zinc/17/88/56/1027178856.db2.gz FJNIKTOISTUNLJ-UHFFFAOYSA-N -1 3 329.343 4.434 20 0 EIADHM [O-]c1ccc(CNc2nc(-c3cccnc3)nc3ccccc32)cc1F ZINC000078020002 1027186003 /nfs/dbraw/zinc/18/60/03/1027186003.db2.gz QXQOXVMOSCXNJU-UHFFFAOYSA-N -1 3 346.365 4.149 20 0 EIADHM Cc1ccc(O[C@@H](C)C(=O)Nc2ccc([O-])c(C(F)(F)F)c2)cc1 ZINC000441015461 1027190801 /nfs/dbraw/zinc/19/08/01/1027190801.db2.gz YVESNQQGFVPKBX-NSHDSACASA-N -1 3 339.313 4.125 20 0 EIADHM [O-]c1ccc(CNc2cnc3cc(Cl)c(Cl)cc3n2)cc1F ZINC000302188930 1027251021 /nfs/dbraw/zinc/25/10/21/1027251021.db2.gz QIHBXMYMEFPBBI-UHFFFAOYSA-N -1 3 338.169 4.393 20 0 EIADHM Cc1ccc(-c2noc([N-]Cc3cc(-c4ccccc4)on3)n2)cc1 ZINC000302708987 1027367421 /nfs/dbraw/zinc/36/74/21/1027367421.db2.gz YZNYNMIBWBVAOI-UHFFFAOYSA-N -1 3 332.363 4.312 20 0 EIADHM CC(C)c1ccc(-c2nc([C@H](C)OCC(F)(F)F)no2)c([O-])c1 ZINC000896606106 1027700854 /nfs/dbraw/zinc/70/08/54/1027700854.db2.gz GSSLYVKYLAPHNC-VIFPVBQESA-N -1 3 330.306 4.206 20 0 EIADHM Cc1cccc(C(=O)N2CCOc3c2cccc3C(C)(C)C)c1[O-] ZINC000444484793 1027841020 /nfs/dbraw/zinc/84/10/20/1027841020.db2.gz WHALPYLXCQZNRG-UHFFFAOYSA-N -1 3 325.408 4.037 20 0 EIADHM Cc1c(NC(=O)c2cc3c(cc2[O-])CCCC3)cnn1C1CCCC1 ZINC000444495222 1027849718 /nfs/dbraw/zinc/84/97/18/1027849718.db2.gz LNHQHNCJEZBWNZ-UHFFFAOYSA-N -1 3 339.439 4.143 20 0 EIADHM C[C@@H](c1ccc(Cl)cc1Cl)N(C)C(=O)c1ccc(O)cc1[O-] ZINC000193125437 1027850886 /nfs/dbraw/zinc/85/08/86/1027850886.db2.gz NSJMITNMUHXWKN-VIFPVBQESA-N -1 3 340.206 4.238 20 0 EIADHM O=C([N-]c1nnc(-c2ccccc2Cl)s1)c1ccoc1Cl ZINC000192290366 1027928138 /nfs/dbraw/zinc/92/81/38/1027928138.db2.gz AQRIEZQVHIGJSJ-UHFFFAOYSA-N -1 3 340.191 4.357 20 0 EIADHM CCOc1cccc2[nH]cc(CC(=O)Nc3cc(Cl)ccc3[O-])c21 ZINC000188600913 1028005784 /nfs/dbraw/zinc/00/57/84/1028005784.db2.gz LOKXULAYNKNPJL-UHFFFAOYSA-N -1 3 344.798 4.107 20 0 EIADHM Cc1ccc(C)c([C@@H](C)N(C)Cc2nc(=O)c3sccc3[n-]2)c1 ZINC000346323569 1028370959 /nfs/dbraw/zinc/37/09/59/1028370959.db2.gz PEMPKUKEROMCQJ-CYBMUJFWSA-N -1 3 327.453 4.207 20 0 EIADHM CCOc1cc(-c2noc(-c3ccc(C(C)C)cc3[O-])n2)ccc1O ZINC000445427077 1028526921 /nfs/dbraw/zinc/52/69/21/1028526921.db2.gz NOOMGDKNLSQOQC-UHFFFAOYSA-N -1 3 340.379 4.337 20 0 EIADHM CC(C)c1ccc(-c2nc(-c3ccc(OC(F)F)cn3)no2)c([O-])c1 ZINC000445524249 1028688683 /nfs/dbraw/zinc/68/86/83/1028688683.db2.gz GCIDDWWSLRPSMV-UHFFFAOYSA-N -1 3 347.321 4.229 20 0 EIADHM [O-]c1ccc(-c2noc(-c3ccc4[nH]c(C(F)F)nc4c3)n2)cc1F ZINC000583420355 1028702490 /nfs/dbraw/zinc/70/24/90/1028702490.db2.gz DGGOYCZXIRPZTO-UHFFFAOYSA-N -1 3 346.268 4.062 20 0 EIADHM O=C(Nc1ccc2nc(C3CCC3)[nH]c2c1)c1c(F)ccc([O-])c1F ZINC000343281282 1028858939 /nfs/dbraw/zinc/85/89/39/1028858939.db2.gz ZVEOREHSIZXDQT-UHFFFAOYSA-N -1 3 343.333 4.067 20 0 EIADHM Cc1ccc(C(C)C)c(O[C@@H](C)C(=O)Nc2cccc([O-])c2F)c1 ZINC000128575591 1028896439 /nfs/dbraw/zinc/89/64/39/1028896439.db2.gz CSGOYHBYSGDDDP-ZDUSSCGKSA-N -1 3 331.387 4.369 20 0 EIADHM CCc1ccc([O-])c(C(=O)N2CC[C@@H](CSc3ccccc3)C2)c1 ZINC000524744814 1029199822 /nfs/dbraw/zinc/19/98/22/1029199822.db2.gz KWDLTBHAIKHFOO-MRXNPFEDSA-N -1 3 341.476 4.209 20 0 EIADHM Cc1ccc(C)c([C@H]2CCCN2C(=O)NCc2ccc([O-])c(F)c2)c1 ZINC000475099241 1029246508 /nfs/dbraw/zinc/24/65/08/1029246508.db2.gz FGTCGFUXIMCWJB-GOSISDBHSA-N -1 3 342.414 4.195 20 0 EIADHM C/C(=C(\F)C(=O)[N-][C@@H](c1c(F)cccc1F)C(F)(F)F)C1CC1 ZINC001137750729 1029298109 /nfs/dbraw/zinc/29/81/09/1029298109.db2.gz JRIZRXNOXOBQQL-WHGQRRHOSA-N -1 3 337.263 4.338 20 0 EIADHM Cc1noc(C(C)C)c1[N-]C(=O)c1cc(C(F)(F)F)cc(Cl)n1 ZINC000928784194 1029405941 /nfs/dbraw/zinc/40/59/41/1029405941.db2.gz AQFBRNWBLXZCJC-UHFFFAOYSA-N -1 3 347.724 4.426 20 0 EIADHM C[C@@H](Oc1cccc(Cl)c1)C(=O)Nc1cc(Cl)ccc1[O-] ZINC000104862999 1029481293 /nfs/dbraw/zinc/48/12/93/1029481293.db2.gz LNOABAZSJNUCLO-SECBINFHSA-N -1 3 326.179 4.105 20 0 EIADHM CC(C)(C)[C@H]1CCCN(C(=O)c2cc([O-])cc(Br)c2)C1 ZINC000708437331 1029496657 /nfs/dbraw/zinc/49/66/57/1029496657.db2.gz RHMLMYBYDUOSJT-LBPRGKRZSA-N -1 3 340.261 4.053 20 0 EIADHM CSc1ccc(C(=O)N2CCC(C)=C(c3ccco3)C2)c([O-])c1 ZINC000367344505 1029517141 /nfs/dbraw/zinc/51/71/41/1029517141.db2.gz YNYPSWISRJTXQV-UHFFFAOYSA-N -1 3 329.421 4.027 20 0 EIADHM [O-]c1cc(Cl)c(CN2CCCC(F)(F)[C@H](F)C2)c(Cl)c1 ZINC001142106036 1029674525 /nfs/dbraw/zinc/67/45/25/1029674525.db2.gz XCYRBADUUGGHOH-GFCCVEGCSA-N -1 3 328.161 4.268 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N3CCC(C(C)(C)C)CC3)nc2)n1 ZINC000301325059 1029706792 /nfs/dbraw/zinc/70/67/92/1029706792.db2.gz YECUESCRCQPJMX-UHFFFAOYSA-N -1 3 340.471 4.069 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@H]3C[C@H]3C3CCCCC3)nc2)n1 ZINC000301377126 1029720167 /nfs/dbraw/zinc/72/01/67/1029720167.db2.gz XZKZORNCRAPYBP-IRXDYDNUSA-N -1 3 338.455 4.187 20 0 EIADHM O=C([N-][C@H]1CCCc2ccc(F)cc21)C(F)(F)c1ccc(F)cc1 ZINC001271521291 1029720395 /nfs/dbraw/zinc/72/03/95/1029720395.db2.gz HTNFQYACAONPPW-INIZCTEOSA-N -1 3 337.316 4.250 20 0 EIADHM Cc1cccc2c(NCc3ccc([O-])c(Br)c3)ncnc12 ZINC000301695188 1029791934 /nfs/dbraw/zinc/79/19/34/1029791934.db2.gz ASZUGNTYZXLHPU-UHFFFAOYSA-N -1 3 344.212 4.018 20 0 EIADHM CSc1ccc(O[C@H](C)C(=O)Nc2c([O-])cccc2Cl)cc1 ZINC000584426961 1029848882 /nfs/dbraw/zinc/84/88/82/1029848882.db2.gz ADWWFKIVFDGDDI-SNVBAGLBSA-N -1 3 337.828 4.174 20 0 EIADHM O=C(Nc1ccc(Br)cc1[O-])c1cccc(F)c1Cl ZINC000525753934 1030000379 /nfs/dbraw/zinc/00/03/79/1030000379.db2.gz ABVQJUOBDPZKPT-UHFFFAOYSA-N -1 3 344.567 4.200 20 0 EIADHM O=C([O-])c1ccccc1OCCN1CCC[C@@H]1c1ccccc1Cl ZINC000183914324 1030043562 /nfs/dbraw/zinc/04/35/62/1030043562.db2.gz OQAOYUACJVQPAE-QGZVFWFLSA-N -1 3 345.826 4.254 20 0 EIADHM O=C(Nc1ccccc1Nc1ccc(F)cc1)c1cccc2n[n-]nc21 ZINC000525870416 1030089473 /nfs/dbraw/zinc/08/94/73/1030089473.db2.gz IPVVNNDXYRABOP-UHFFFAOYSA-N -1 3 347.353 4.093 20 0 EIADHM O=C([O-])c1ccccc1CCN1CCc2cccc(C(F)(F)F)c2C1 ZINC000530171947 1030187277 /nfs/dbraw/zinc/18/72/77/1030187277.db2.gz DVKZQNCUWOOWND-UHFFFAOYSA-N -1 3 349.352 4.004 20 0 EIADHM CC(C)Oc1ccc(CN2[C@H](C)C[C@@H](C(=O)[O-])C[C@@H]2C)cc1Cl ZINC000530174303 1030196946 /nfs/dbraw/zinc/19/69/46/1030196946.db2.gz JZMHWLCSOXAIJC-AGGWBTHJSA-N -1 3 339.863 4.201 20 0 EIADHM C[C@H]1CC(C(=O)[O-])C[C@H](C)N1Cc1coc(-c2cccc(Cl)c2)n1 ZINC000530178216 1030200423 /nfs/dbraw/zinc/20/04/23/1030200423.db2.gz HNQVOAZOPULLKO-RYUDHWBXSA-N -1 3 348.830 4.069 20 0 EIADHM CC(C)(C)c1ccc(NC(=O)c2coc3c2C(=O)CCC3)c([O-])c1 ZINC000451478714 1030508905 /nfs/dbraw/zinc/50/89/05/1030508905.db2.gz KTJFKGXGGHGCPA-UHFFFAOYSA-N -1 3 327.380 4.054 20 0 EIADHM O=C(Cc1ccc([O-])c(F)c1)N1[C@@H]2CC[C@H]1C[C@@H](c1ccccc1)C2 ZINC000451520476 1030552050 /nfs/dbraw/zinc/55/20/50/1030552050.db2.gz ZLBKUJYLELNOIL-BCDXTJNWSA-N -1 3 339.410 4.011 20 0 EIADHM C[C@H](NC(=O)c1cc([O-])ccc1Cl)c1ccc2c(c1)CCCC2 ZINC000431617067 1030562235 /nfs/dbraw/zinc/56/22/35/1030562235.db2.gz AAIUFXKNGRFDMJ-LBPRGKRZSA-N -1 3 329.827 4.415 20 0 EIADHM O=C(Nc1cc(F)ccc1[O-])c1cc(-c2cccc(Cl)c2)on1 ZINC000530658448 1030629539 /nfs/dbraw/zinc/62/95/39/1030629539.db2.gz NWEIEZKZZIFZGW-UHFFFAOYSA-N -1 3 332.718 4.092 20 0 EIADHM CSCc1cccc(CNC(=O)c2cc([O-])c3ccccc3c2)c1 ZINC000527469110 1030708243 /nfs/dbraw/zinc/70/82/43/1030708243.db2.gz NDYYBIAIZIWDPM-UHFFFAOYSA-N -1 3 337.444 4.338 20 0 EIADHM CCCN(CC(=O)[O-])Cc1c(Cl)cccc1Oc1ccccc1 ZINC000263396013 1030848451 /nfs/dbraw/zinc/84/84/51/1030848451.db2.gz GOUWLLZIZGKTAV-UHFFFAOYSA-N -1 3 333.815 4.429 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2ccc(C(F)(F)F)cc2)cc1C ZINC000006348487 1030851055 /nfs/dbraw/zinc/85/10/55/1030851055.db2.gz AEGFBQOZVPOYKT-UHFFFAOYSA-N -1 3 329.343 4.123 20 0 EIADHM O=C(Cc1ccc([O-])c(F)c1)N1CCC[C@H]1c1ccc(Cl)cc1 ZINC000448655801 1030903146 /nfs/dbraw/zinc/90/31/46/1030903146.db2.gz LZWUSTKCPJUHDY-INIZCTEOSA-N -1 3 333.790 4.091 20 0 EIADHM O=C(Nc1cc(Br)ccc1[O-])[C@@H]1CCCc2ccccc21 ZINC000531155896 1030905308 /nfs/dbraw/zinc/90/53/08/1030905308.db2.gz TXUMRYRQLLMSQC-CQSZACIVSA-N -1 3 346.224 4.213 20 0 EIADHM Cc1c2cc(F)ccc2oc1C(=O)[N-]c1nnc(-c2ccco2)s1 ZINC000053209497 1030930842 /nfs/dbraw/zinc/93/08/42/1030930842.db2.gz LMCJDOCGXGSLFA-UHFFFAOYSA-N -1 3 343.339 4.244 20 0 EIADHM CC(C)(C)c1nc2cc(NC(=O)Cc3ccc([O-])c(F)c3)ccc2o1 ZINC000448685236 1030971239 /nfs/dbraw/zinc/97/12/39/1030971239.db2.gz VJVURCDNYKOTPS-UHFFFAOYSA-N -1 3 342.370 4.151 20 0 EIADHM Cc1cccc([C@@H](C)C(=O)Nc2cc(Br)ccc2[O-])c1 ZINC000531253744 1031025627 /nfs/dbraw/zinc/02/56/27/1031025627.db2.gz FTGXBEYCBKUMBH-LLVKDONJSA-N -1 3 334.213 4.205 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1c[nH]nc1-c1ccccc1Cl ZINC000531279756 1031035010 /nfs/dbraw/zinc/03/50/10/1031035010.db2.gz XHQICQXAVJVBSW-UHFFFAOYSA-N -1 3 348.189 4.341 20 0 EIADHM CCCN(C(=O)Cc1ccc([O-])c(F)c1)[C@H](C)c1ccccc1OC ZINC000448819395 1031123200 /nfs/dbraw/zinc/12/32/00/1031123200.db2.gz AWTBZQDVOUMQNM-CQSZACIVSA-N -1 3 345.414 4.082 20 0 EIADHM COc1ccc([C@@H](C)Oc2cc(O)cc([O-])c2Br)cc1 ZINC001229098249 1031253531 /nfs/dbraw/zinc/25/35/31/1031253531.db2.gz DERSXSPQQPAOGR-SECBINFHSA-N -1 3 339.185 4.009 20 0 EIADHM O=C([N-]c1nc(-c2ccccn2)cs1)c1cc(-c2ccccc2)no1 ZINC000041760889 1031512791 /nfs/dbraw/zinc/51/27/91/1031512791.db2.gz SMAJNNOQTLZTEX-UHFFFAOYSA-N -1 3 348.387 4.112 20 0 EIADHM C[C@H](c1cccc(Br)c1)[S@@](=O)c1ccc([O-])cc1 ZINC000129808660 1031814276 /nfs/dbraw/zinc/81/42/76/1031814276.db2.gz JADDSIKKSNIGPW-MGNBDDOMSA-N -1 3 325.227 4.024 20 0 EIADHM O=C(CSc1nccc2ccccc21)Nc1cc(Cl)ccc1[O-] ZINC000532011338 1031973006 /nfs/dbraw/zinc/97/30/06/1031973006.db2.gz QHKASCBIXSSENR-UHFFFAOYSA-N -1 3 344.823 4.325 20 0 EIADHM O=C(Nc1ccccc1-c1ccccc1)c1cc(F)cc2n[n-]nc21 ZINC000433217354 1034059038 /nfs/dbraw/zinc/05/90/38/1034059038.db2.gz AEIGFRVMBIBFAC-UHFFFAOYSA-N -1 3 332.338 4.016 20 0 EIADHM Cc1cc(C(F)(F)F)ccc1CNCc1c(F)ccc([O-])c1F ZINC000513099725 1034578514 /nfs/dbraw/zinc/57/85/14/1034578514.db2.gz AHSITHLPGAFSDO-UHFFFAOYSA-N -1 3 331.284 4.287 20 0 EIADHM COc1ccccc1-c1cc(C(=O)[N-]c2cc(F)c(F)cc2F)no1 ZINC000729408422 1034812085 /nfs/dbraw/zinc/81/20/85/1034812085.db2.gz GUHOZRRPAPNNCG-UHFFFAOYSA-N -1 3 348.280 4.020 20 0 EIADHM COc1ccc([C@@H]([N-]c2nc3cc(C)ccc3o2)c2nccn2C)cc1 ZINC000513652686 1035081723 /nfs/dbraw/zinc/08/17/23/1035081723.db2.gz NOTCHCDXJDOPAK-GOSISDBHSA-N -1 3 348.406 4.080 20 0 EIADHM COc1ccc([O-])c(-c2nc(-c3ccsc3C(F)(F)F)no2)c1 ZINC000904923351 1035672516 /nfs/dbraw/zinc/67/25/16/1035672516.db2.gz QRCCPWSMPSGNFU-UHFFFAOYSA-N -1 3 342.298 4.198 20 0 EIADHM Cc1ccc(C)c(C(=O)Nc2nnc(-c3cc4ccccc4o3)[n-]2)c1 ZINC000485127709 1035714069 /nfs/dbraw/zinc/71/40/69/1035714069.db2.gz MHLVQFIPKHAKMP-UHFFFAOYSA-N -1 3 332.363 4.087 20 0 EIADHM Cc1ccc(C)c(C(=O)Nc2n[n-]c(-c3cc4ccccc4o3)n2)c1 ZINC000485127709 1035714095 /nfs/dbraw/zinc/71/40/95/1035714095.db2.gz MHLVQFIPKHAKMP-UHFFFAOYSA-N -1 3 332.363 4.087 20 0 EIADHM COCc1ccc(-c2nc3cc(Cl)c(Cl)cc3c(=O)[n-]2)cc1 ZINC000485349422 1035833870 /nfs/dbraw/zinc/83/38/70/1035833870.db2.gz PBTCOOYJFKWBBJ-UHFFFAOYSA-N -1 3 335.190 4.456 20 0 EIADHM Cc1ccc([N-]S(=O)(=O)c2ccc(Cl)cc2Cl)c(F)c1 ZINC000485387030 1035853975 /nfs/dbraw/zinc/85/39/75/1035853975.db2.gz FQWAKLGWDVUSHN-UHFFFAOYSA-N -1 3 334.199 4.242 20 0 EIADHM CCN(C(=O)c1ccc(OC)cc1[O-])[C@@H](C)c1cc2ccccc2o1 ZINC000195645213 1035875438 /nfs/dbraw/zinc/87/54/38/1035875438.db2.gz OZXXDXGZQJGTBT-ZDUSSCGKSA-N -1 3 339.391 4.370 20 0 EIADHM Cc1cc(Cl)cc(C)c1CN1CCC(C(=O)[O-])(C(F)(F)F)CC1 ZINC000905738965 1035879463 /nfs/dbraw/zinc/87/94/63/1035879463.db2.gz PYYMUMOBEBCBEP-UHFFFAOYSA-N -1 3 349.780 4.186 20 0 EIADHM Cc1cccc(C(=O)Nc2ccc3oc(C(F)(F)F)nc3c2)c1[O-] ZINC000195748826 1035884997 /nfs/dbraw/zinc/88/49/97/1035884997.db2.gz LLZYVIANBSWMBZ-UHFFFAOYSA-N -1 3 336.269 4.113 20 0 EIADHM Cc1ccc(C)c(C2CCN(Cc3ccc(/C=C/C(=O)[O-])o3)CC2)c1 ZINC000905811557 1035901405 /nfs/dbraw/zinc/90/14/05/1035901405.db2.gz XEAOFGHSKVIHNY-BQYQJAHWSA-N -1 3 339.435 4.374 20 0 EIADHM CCc1ccc(C(C)(C)C(=O)Nc2cccc(C(C)=O)c2[O-])cc1 ZINC000571006644 1035915620 /nfs/dbraw/zinc/91/56/20/1035915620.db2.gz YAPBSKXVOIPCFZ-UHFFFAOYSA-N -1 3 325.408 4.074 20 0 EIADHM O=c1cc(C=Cc2ccc(Cl)c(Cl)c2)nc(-c2ccncc2)[n-]1 ZINC000485999326 1036414672 /nfs/dbraw/zinc/41/46/72/1036414672.db2.gz KNNBBHKFOUUFHM-IWQZZHSRSA-N -1 3 344.201 4.309 20 0 EIADHM O=c1cc(C=Cc2ccc(C(F)(F)F)cc2)nc(-c2ccncc2)[n-]1 ZINC000486008650 1036426503 /nfs/dbraw/zinc/42/65/03/1036426503.db2.gz SGYXQTYUTKDLPZ-UTCJRWHESA-N -1 3 343.308 4.021 20 0 EIADHM CCC(CC)N(CC)C(=O)c1c[n-]c(=NC(=O)OC(C)(C)C)s1 ZINC000908236890 1036819454 /nfs/dbraw/zinc/81/94/54/1036819454.db2.gz IPGHCCJBLIHQJZ-UHFFFAOYSA-N -1 3 341.477 4.141 20 0 EIADHM CC(C)[C@@H]1CCCN(Cc2coc(-c3ccc(C(=O)[O-])cc3)n2)CC1 ZINC000569818172 1037099215 /nfs/dbraw/zinc/09/92/15/1037099215.db2.gz MTTNKHHBWMBXDW-OAHLLOKOSA-N -1 3 342.439 4.298 20 0 EIADHM Cc1ccccc1[C@@H](C(C)C)N(C)C(=O)c1cc(=O)c2ccccc2[n-]1 ZINC000487818548 1037245131 /nfs/dbraw/zinc/24/51/31/1037245131.db2.gz ODLPZPKTVZJIKY-OAQYLSRUSA-N -1 3 348.446 4.306 20 0 EIADHM C[C@@H](c1cccs1)N(C)CCOc1ccc(C(=O)[O-])cc1Cl ZINC000573126327 1037342625 /nfs/dbraw/zinc/34/26/25/1037342625.db2.gz OQZKQVHBSWIABX-NSHDSACASA-N -1 3 339.844 4.172 20 0 EIADHM O=C(NC1(Cc2ccccc2)CCCC1)c1cc(=O)c2ccccc2[n-]1 ZINC000273602742 1037523854 /nfs/dbraw/zinc/52/38/54/1037523854.db2.gz SIBLMUOUJXKPEJ-UHFFFAOYSA-N -1 3 346.430 4.226 20 0 EIADHM O=c1[n-]c(CN2CCCC[C@H]2c2ccco2)nc2c3ccccc3oc21 ZINC000604760277 1037527823 /nfs/dbraw/zinc/52/78/23/1037527823.db2.gz ACQQYWXIMJEOHF-AWEZNQCLSA-N -1 3 349.390 4.402 20 0 EIADHM C[C@H]1CCN([C@H](C(=O)[O-])c2ccc(Cl)c(Cl)c2)CC1(C)C ZINC000573616228 1037602129 /nfs/dbraw/zinc/60/21/29/1037602129.db2.gz ICXAPEKQDKFABR-HZMBPMFUSA-N -1 3 330.255 4.487 20 0 EIADHM Cc1cc(F)ccc1-c1ccc(C(=O)Nc2ncccc2[O-])cc1F ZINC000605021625 1037624643 /nfs/dbraw/zinc/62/46/43/1037624643.db2.gz GDTYQPMIKWOXSE-UHFFFAOYSA-N -1 3 340.329 4.293 20 0 EIADHM CCCCSc1nnc(S[C@@H](C)c2nc(C)cc(=O)[n-]2)s1 ZINC000488755608 1037741317 /nfs/dbraw/zinc/74/13/17/1037741317.db2.gz YCBFCCZVUIMOFL-VIFPVBQESA-N -1 3 342.515 4.088 20 0 EIADHM CSc1ccc([O-])c(C(=O)N2CCS[C@@H](c3ccccc3)C2)c1 ZINC000668878332 1037785741 /nfs/dbraw/zinc/78/57/41/1037785741.db2.gz BZGIUACDDAZEET-QGZVFWFLSA-N -1 3 345.489 4.044 20 0 EIADHM Cc1nc(C(=O)Nc2cc(F)ccc2[O-])c(-c2ccccc2)s1 ZINC000489165588 1037889233 /nfs/dbraw/zinc/88/92/33/1037889233.db2.gz WZQYQTSOCPSIJA-UHFFFAOYSA-N -1 3 328.368 4.216 20 0 EIADHM CC(C)c1ccc([C@@H](C)CC(=O)Nc2cccc(-c3nnn[n-]3)c2)cc1 ZINC000606347561 1038011124 /nfs/dbraw/zinc/01/11/24/1038011124.db2.gz BXSFLGURUODFHW-AWEZNQCLSA-N -1 3 349.438 4.122 20 0 EIADHM CC(C)c1ccc([C@@H](C)CC(=O)Nc2cccc(-c3nn[n-]n3)c2)cc1 ZINC000606347561 1038011141 /nfs/dbraw/zinc/01/11/41/1038011141.db2.gz BXSFLGURUODFHW-AWEZNQCLSA-N -1 3 349.438 4.122 20 0 EIADHM CSc1ccc([O-])c(C(=O)N(C)[C@H](C)Cc2ccc(C)cc2)c1 ZINC000668983340 1038079670 /nfs/dbraw/zinc/07/96/70/1038079670.db2.gz WFBRZCDCMBJTBB-CQSZACIVSA-N -1 3 329.465 4.126 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)NC1(c2ccccc2)CCCCC1 ZINC000606689728 1038223172 /nfs/dbraw/zinc/22/31/72/1038223172.db2.gz VNZQCPHEHXZWOZ-UHFFFAOYSA-N -1 3 342.414 4.190 20 0 EIADHM COc1ccc([O-])c(C(=O)Nc2ccc(COC3CCCC3)cc2)c1 ZINC000606826264 1038265387 /nfs/dbraw/zinc/26/53/87/1038265387.db2.gz LVDSAGVCSBVGQU-UHFFFAOYSA-N -1 3 341.407 4.112 20 0 EIADHM O=C([O-])c1coc(CN2CCCCC[C@@H]2/C=C\c2cccs2)c1 ZINC000574578236 1038296731 /nfs/dbraw/zinc/29/67/31/1038296731.db2.gz NQHSXMMNOQOKDE-ZPIQOJFGSA-N -1 3 331.437 4.497 20 0 EIADHM Cc1[n-]c(S(=O)(=O)Cc2cccc(Cl)c2)nc1-c1ccccc1 ZINC000490422574 1038623145 /nfs/dbraw/zinc/62/31/45/1038623145.db2.gz KYJMBEFJKFHADJ-UHFFFAOYSA-N -1 3 346.839 4.012 20 0 EIADHM Cc1nc(S(=O)(=O)Cc2cccc(Cl)c2)[n-]c1-c1ccccc1 ZINC000490422574 1038623154 /nfs/dbraw/zinc/62/31/54/1038623154.db2.gz KYJMBEFJKFHADJ-UHFFFAOYSA-N -1 3 346.839 4.012 20 0 EIADHM COc1c(C)cc(S(=O)(=O)[N-]c2c(C)cc(C)cc2C)cc1C ZINC000539105823 1038842780 /nfs/dbraw/zinc/84/27/80/1038842780.db2.gz UTTKKUHNNOVEEX-UHFFFAOYSA-N -1 3 333.453 4.038 20 0 EIADHM COc1c(C)ccc([N-]S(=O)(=O)c2c(C)c(C)cc(C)c2C)c1C ZINC000031722693 1038854999 /nfs/dbraw/zinc/85/49/99/1038854999.db2.gz VKQYYOSGIKHRQL-UHFFFAOYSA-N -1 3 347.480 4.347 20 0 EIADHM CSCCc1ccc([N-]S(=O)(=O)c2c(C)cc(C)cc2C)cc1 ZINC000609015980 1038992216 /nfs/dbraw/zinc/99/22/16/1038992216.db2.gz QCLFCBYYJKBTIE-UHFFFAOYSA-N -1 3 349.521 4.318 20 0 EIADHM CC(=O)c1cccc(NC(=O)[C@@H](C)Sc2ccc(Cl)cc2)c1[O-] ZINC000552069352 1039096534 /nfs/dbraw/zinc/09/65/34/1039096534.db2.gz OWELXQBLXBPLIV-LLVKDONJSA-N -1 3 349.839 4.368 20 0 EIADHM CC(=O)c1ccc(-c2ccc(C(=O)Nc3cccc([O-])c3F)o2)cc1 ZINC000534208486 1039203925 /nfs/dbraw/zinc/20/39/25/1039203925.db2.gz BHMSBQAIIXZNNV-UHFFFAOYSA-N -1 3 339.322 4.246 20 0 EIADHM CCc1noc(C)c1[N-]C(=O)c1cc2cc(Br)ccc2o1 ZINC000120934523 1039239079 /nfs/dbraw/zinc/23/90/79/1039239079.db2.gz JAUATMGYHMQPAN-UHFFFAOYSA-N -1 3 349.184 4.306 20 0 EIADHM COC(=O)c1cc(F)cc([N-]C(=O)c2scc(C)c2Cl)c1F ZINC000478057121 1039361939 /nfs/dbraw/zinc/36/19/39/1039361939.db2.gz AQAKESTUUXXICL-UHFFFAOYSA-N -1 3 345.754 4.027 20 0 EIADHM O=C(Nc1c([O-])cccc1Cl)c1ccccc1Br ZINC000552435526 1039517615 /nfs/dbraw/zinc/51/76/15/1039517615.db2.gz LIFYEUVMOMWDPQ-UHFFFAOYSA-N -1 3 326.577 4.060 20 0 EIADHM Cc1cnc(=S)[n-]c1O[C@@H](C)c1ccc(F)c(Br)c1 ZINC001225741242 1039715710 /nfs/dbraw/zinc/71/57/10/1039715710.db2.gz SXSHLNFFQFGWDP-QMMMGPOBSA-N -1 3 343.221 4.115 20 0 EIADHM Cc1cccc(CN(C)C(=O)CCCc2ccc([O-])c(F)c2)c1C ZINC000552651753 1039733012 /nfs/dbraw/zinc/73/30/12/1039733012.db2.gz FUZCYMUFGJPKAP-UHFFFAOYSA-N -1 3 329.415 4.129 20 0 EIADHM Cc1c(Cl)cc(F)c([N-]C(=O)c2noc3c2CCCC3)c1F ZINC000534928964 1039859091 /nfs/dbraw/zinc/85/90/91/1039859091.db2.gz YHJIFCHJHIKRPA-UHFFFAOYSA-N -1 3 326.730 4.046 20 0 EIADHM CCC(CC)c1nnc([N-]C(=O)c2oc(SC)cc2C)s1 ZINC000666969487 1040055335 /nfs/dbraw/zinc/05/53/35/1040055335.db2.gz SOCIDUJNDQFEIV-UHFFFAOYSA-N -1 3 325.459 4.317 20 0 EIADHM CCCc1cc(=O)[n-]c(C(=Cc2c[nH]c(-c3ccccc3)n2)CC)n1 ZINC000435337430 1040290197 /nfs/dbraw/zinc/29/01/97/1040290197.db2.gz VZQPNOGWBLBOHW-KAMYIIQDSA-N -1 3 334.423 4.475 20 0 EIADHM CCCc1cc(=O)[n-]c(C(=Cc2ccc(OC)c(Cl)c2)CC)n1 ZINC000435337486 1040291292 /nfs/dbraw/zinc/29/12/92/1040291292.db2.gz WRRNHUAMWNNNGK-UKTHLTGXSA-N -1 3 332.831 4.335 20 0 EIADHM CCCc1cc(=O)[n-]c(C(=Cc2ccc(OCC)c(OC)c2)CC)n1 ZINC000435340755 1040295048 /nfs/dbraw/zinc/29/50/48/1040295048.db2.gz MSMKLHZYQLXRCP-RVDMUPIBSA-N -1 3 342.439 4.080 20 0 EIADHM CCc1noc(C)c1[N-]C(=O)c1cnc(-c2ccc(F)c(F)c2)s1 ZINC000503609048 1040300189 /nfs/dbraw/zinc/30/01/89/1040300189.db2.gz DEMPOZCXWJNXRF-UHFFFAOYSA-N -1 3 349.362 4.199 20 0 EIADHM CCN(Cc1c[nH]c2ccccc12)[C@@H](C)c1cc(C)c(C(=O)[O-])o1 ZINC000568064712 1040483468 /nfs/dbraw/zinc/48/34/68/1040483468.db2.gz NMCWFNCEDRJMHL-ZDUSSCGKSA-N -1 3 326.396 4.351 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@@H](C)c3ccsc3)nc2)n1 ZINC000669827136 1040489518 /nfs/dbraw/zinc/48/95/18/1040489518.db2.gz RKZKWOQEQMLHQW-NSHDSACASA-N -1 3 326.425 4.041 20 0 EIADHM COc1cc(C)c([N-]S(=O)(=O)c2cc(Cl)ccc2C)cc1C ZINC000435723170 1040577649 /nfs/dbraw/zinc/57/76/49/1040577649.db2.gz NRBNNEMELCZEBM-UHFFFAOYSA-N -1 3 339.844 4.075 20 0 EIADHM CSc1ccccc1CC(=O)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000539704988 1040712726 /nfs/dbraw/zinc/71/27/26/1040712726.db2.gz IQHZLLUDOWDIOH-UHFFFAOYSA-N -1 3 341.354 4.314 20 0 EIADHM Cc1c(C)c(C)c(CNC(=O)c2cc(=O)c3ccccc3[n-]2)c(C)c1C ZINC000436009387 1040801983 /nfs/dbraw/zinc/80/19/83/1040801983.db2.gz CWTDHVASFFOVSG-UHFFFAOYSA-N -1 3 348.446 4.000 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)N1CCC[C@H](c2ccccc2)C1 ZINC000554156499 1040846480 /nfs/dbraw/zinc/84/64/80/1040846480.db2.gz WOGXRZOBAAGRGU-SFHVURJKSA-N -1 3 341.426 4.260 20 0 EIADHM CC(C)[C@@H](C(=O)Nc1ccc([O-])c(C(F)(F)F)c1)c1cccnc1 ZINC000436147562 1040905734 /nfs/dbraw/zinc/90/57/34/1040905734.db2.gz NJSMODNPZDHRNC-OAHLLOKOSA-N -1 3 338.329 4.184 20 0 EIADHM O=C(c1ccccc1[O-])N(Cc1cccc(-c2cccnc2)c1)C1CC1 ZINC000163616962 1041224301 /nfs/dbraw/zinc/22/43/01/1041224301.db2.gz GQWOKXNEDXNVAV-UHFFFAOYSA-N -1 3 344.414 4.259 20 0 EIADHM Cc1cccc([C@H](CC(=O)[O-])NCc2cnc(C3CCC3)s2)c1 ZINC000904045821 1041301903 /nfs/dbraw/zinc/30/19/03/1041301903.db2.gz PIRLDWBJDDDPLW-INIZCTEOSA-N -1 3 330.453 4.025 20 0 EIADHM O=C([O-])Cc1ccc(CCNCc2csc(Cl)c2Cl)cc1 ZINC000904057113 1041311131 /nfs/dbraw/zinc/31/11/31/1041311131.db2.gz FAFCTCGXKHEQCC-UHFFFAOYSA-N -1 3 344.263 4.014 20 0 EIADHM CSc1ccc(N(C)C(=O)c2cc3c(cc2[O-])CCCC3)cc1 ZINC000436545047 1041322062 /nfs/dbraw/zinc/32/20/62/1041322062.db2.gz FSSILHMBJNOJCQ-UHFFFAOYSA-N -1 3 327.449 4.270 20 0 EIADHM O=C(c1cc(Cc2ccccc2)ccc1[O-])N(CC1CC1)CC1CC1 ZINC000436544155 1041339320 /nfs/dbraw/zinc/33/93/20/1041339320.db2.gz BPCYIRQNSUSVBD-UHFFFAOYSA-N -1 3 335.447 4.245 20 0 EIADHM Cc1c[nH]c(-c2ccccc2NC(=O)c2ccc(C(C)C)cc2[O-])n1 ZINC000436593007 1041352391 /nfs/dbraw/zinc/35/23/91/1041352391.db2.gz BILWCGJGRSZSBW-UHFFFAOYSA-N -1 3 335.407 4.466 20 0 EIADHM O=C(C[C@H]1CCCCCN1C(=O)c1ccccc1[O-])c1ccccc1 ZINC000436581125 1041361117 /nfs/dbraw/zinc/36/11/17/1041361117.db2.gz YSKNWBMLWCAYMU-QGZVFWFLSA-N -1 3 337.419 4.050 20 0 EIADHM Cn1ncc2c1nc(SCc1ccc(C3CCCC3)cc1)[n-]c2=O ZINC000629221239 1041377116 /nfs/dbraw/zinc/37/71/16/1041377116.db2.gz SYDCZSATHWVZEG-UHFFFAOYSA-N -1 3 340.452 4.019 20 0 EIADHM CC(C)c1ccc(C(=O)N(C)CCOc2ccccc2Cl)c([O-])c1 ZINC000436636471 1041386477 /nfs/dbraw/zinc/38/64/77/1041386477.db2.gz REGVGPNBXXOBPE-UHFFFAOYSA-N -1 3 347.842 4.320 20 0 EIADHM CC(=O)c1ccc(C(=O)N2CCC[C@H]2CC2CCCCC2)cc1[O-] ZINC000436621766 1041389640 /nfs/dbraw/zinc/38/96/40/1041389640.db2.gz DROROXZWGVOSPX-KRWDZBQOSA-N -1 3 329.440 4.170 20 0 EIADHM CC(=O)c1ccc(C(=O)N2CCC[C@@H]2CC2CCCCC2)cc1[O-] ZINC000436621767 1041390517 /nfs/dbraw/zinc/39/05/17/1041390517.db2.gz DROROXZWGVOSPX-QGZVFWFLSA-N -1 3 329.440 4.170 20 0 EIADHM CO[C@H](C)c1cccc(NC(=O)c2ccc3c(c2[O-])OC(C)(C)C3)c1 ZINC000436679375 1041419726 /nfs/dbraw/zinc/41/97/26/1041419726.db2.gz GBJDJWQLRAJBTL-GFCCVEGCSA-N -1 3 341.407 4.065 20 0 EIADHM Cc1ccc(C(=O)N2CCC[C@@H]2Cc2ccccc2Cl)c([O-])c1 ZINC000436710358 1041438863 /nfs/dbraw/zinc/43/88/63/1041438863.db2.gz SMJVHRRSIOFSHO-OAHLLOKOSA-N -1 3 329.827 4.201 20 0 EIADHM O=C(c1ccccc1[O-])N(Cc1c(F)cccc1F)C1CCCC1 ZINC000436718738 1041442734 /nfs/dbraw/zinc/44/27/34/1041442734.db2.gz LQADNQRRCOONNJ-UHFFFAOYSA-N -1 3 331.362 4.255 20 0 EIADHM CCc1ccc(C(=O)N(C)[C@@H](CC)c2ccccc2OC)c([O-])c1 ZINC000436742964 1041450657 /nfs/dbraw/zinc/45/06/57/1041450657.db2.gz WLNGSBKTCYPREG-KRWDZBQOSA-N -1 3 327.424 4.187 20 0 EIADHM CCOc1ccc([C@H]2CCCN2C(=O)c2ccc(C)cc2[O-])cc1 ZINC000436758406 1041458125 /nfs/dbraw/zinc/45/81/25/1041458125.db2.gz XXRPBAJTZMKBKZ-GOSISDBHSA-N -1 3 325.408 4.077 20 0 EIADHM CC(C)(C)c1ccccc1OCCNC(=O)c1cc([O-])ccc1Cl ZINC000567478930 1041471527 /nfs/dbraw/zinc/47/15/27/1041471527.db2.gz GGOOXJUEKKLVJH-UHFFFAOYSA-N -1 3 347.842 4.152 20 0 EIADHM CC[C@H](c1ccccc1)N(CC)C(=O)c1cc(OC)c([O-])c(OC)c1 ZINC000436782225 1041474400 /nfs/dbraw/zinc/47/44/00/1041474400.db2.gz MTEPVFBZSZWOHO-MRXNPFEDSA-N -1 3 343.423 4.023 20 0 EIADHM CCN(Cc1cccc(-c2ccncc2)c1)C(=O)c1ccc(C)cc1[O-] ZINC000436794729 1041485814 /nfs/dbraw/zinc/48/58/14/1041485814.db2.gz WIWSEGUBDWOTOS-UHFFFAOYSA-N -1 3 346.430 4.425 20 0 EIADHM CCc1ccc(C(=O)N2CCC(=Cc3ccccc3F)CC2)c([O-])c1 ZINC000436831429 1041495574 /nfs/dbraw/zinc/49/55/74/1041495574.db2.gz PJFHWJGHZJHRAP-UHFFFAOYSA-N -1 3 339.410 4.413 20 0 EIADHM CCc1ccc(C(=O)N2C[C@H](c3ccc(F)cc3)C[C@@H]2C)c([O-])c1 ZINC000436834708 1041499040 /nfs/dbraw/zinc/49/90/40/1041499040.db2.gz QVTLHQGRHVFVJN-XJKSGUPXSA-N -1 3 327.399 4.112 20 0 EIADHM CCc1ccc(C(=O)N2CC[C@H](c3ccc(Cl)cc3)C2)c([O-])c1 ZINC000436824193 1041500782 /nfs/dbraw/zinc/50/07/82/1041500782.db2.gz FWEFVQWFFLSWAL-HNNXBMFYSA-N -1 3 329.827 4.238 20 0 EIADHM COc1ccc([O-])c(C(=O)N2CC3(CCCC3)c3c2cccc3F)c1 ZINC000538741635 1041516760 /nfs/dbraw/zinc/51/67/60/1041516760.db2.gz UVIXVNOCHJTBLZ-UHFFFAOYSA-N -1 3 341.382 4.012 20 0 EIADHM CCc1cccc(C(=O)N2CCn3cccc3[C@@H]2c2ccccc2)c1[O-] ZINC000538744173 1041519416 /nfs/dbraw/zinc/51/94/16/1041519416.db2.gz REPCBAMAVCQIPQ-FQEVSTJZSA-N -1 3 346.430 4.002 20 0 EIADHM CCSc1cccc(F)c1[N-]C(=O)c1cc(OC)ccc1OC ZINC000484939176 1041529700 /nfs/dbraw/zinc/52/97/00/1041529700.db2.gz PKLXCLITXQGNJU-UHFFFAOYSA-N -1 3 335.400 4.207 20 0 EIADHM CCc1cccc(C(=O)N(CC)[C@@H](C)c2cccc(OC)c2)c1[O-] ZINC000538756869 1041530897 /nfs/dbraw/zinc/53/08/97/1041530897.db2.gz FKDWHUZUYQIXMZ-AWEZNQCLSA-N -1 3 327.424 4.187 20 0 EIADHM CCc1ccc(-c2nc(C(C)(C)c3ccccc3OC)no2)c([O-])c1 ZINC000436878620 1041537831 /nfs/dbraw/zinc/53/78/31/1041537831.db2.gz GDXDLZUWDQNMRX-UHFFFAOYSA-N -1 3 338.407 4.339 20 0 EIADHM CCN(C(=O)c1ccc2c(c1[O-])CCCC2)c1ccc2[nH]ccc2c1 ZINC000436887506 1041541990 /nfs/dbraw/zinc/54/19/90/1041541990.db2.gz QAKUTCJTCJGGQM-UHFFFAOYSA-N -1 3 334.419 4.419 20 0 EIADHM Cc1ccc(-c2nc(COc3ccc4ccccc4c3)no2)c([O-])c1 ZINC000436913334 1041550062 /nfs/dbraw/zinc/55/00/62/1041550062.db2.gz VCLABSZNPXKNBB-UHFFFAOYSA-N -1 3 332.359 4.483 20 0 EIADHM COc1cccc(C(=O)Nc2ccc(-c3ccccc3)c(C)n2)c1[O-] ZINC000436926593 1041562444 /nfs/dbraw/zinc/56/24/44/1041562444.db2.gz KUZZGJDCRLJEGH-UHFFFAOYSA-N -1 3 334.375 4.024 20 0 EIADHM CC[C@H](C)Oc1ccc(-c2noc(-c3cc(OC)ccc3[O-])n2)cc1 ZINC000436934548 1041564937 /nfs/dbraw/zinc/56/49/37/1041564937.db2.gz HAQXZPULWRLAEQ-LBPRGKRZSA-N -1 3 340.379 4.295 20 0 EIADHM CO[C@@H](c1noc(-c2ccc(C)cc2[O-])n1)c1ccccc1Cl ZINC000436951579 1041573377 /nfs/dbraw/zinc/57/33/77/1041573377.db2.gz GHYLCRXYHNXXRO-OAHLLOKOSA-N -1 3 330.771 4.140 20 0 EIADHM Cc1ccc(C(=O)N(CC(C)C)[C@@H]2CCCc3cccnc32)c([O-])c1 ZINC000436957443 1041575516 /nfs/dbraw/zinc/57/55/16/1041575516.db2.gz UTSASWJLPXRENW-GOSISDBHSA-N -1 3 338.451 4.271 20 0 EIADHM Cc1cc([C@H](C)N(C)CCOc2cccc(Cl)c2)oc1C(=O)[O-] ZINC000516657283 1041693564 /nfs/dbraw/zinc/69/35/64/1041693564.db2.gz WKSDOFFGFVAQMO-LBPRGKRZSA-N -1 3 337.803 4.011 20 0 EIADHM CC[C@H](Sc1ccccc1)C(=O)Nc1cccc(C(C)=O)c1[O-] ZINC000516888870 1041798245 /nfs/dbraw/zinc/79/82/45/1041798245.db2.gz KVPXRKCBAOHXBW-INIZCTEOSA-N -1 3 329.421 4.104 20 0 EIADHM CCc1cc(=O)[n-]c(CSCc2sccc2Br)n1 ZINC000464090149 1041864901 /nfs/dbraw/zinc/86/49/01/1041864901.db2.gz ZFVVJUSAXMGDPA-UHFFFAOYSA-N -1 3 345.287 4.002 20 0 EIADHM CCCOc1ccc([N-]S(=O)(=O)c2ccc(F)c(C)c2)c(C)c1 ZINC000517173719 1041891080 /nfs/dbraw/zinc/89/10/80/1041891080.db2.gz BXZFQXGTEBBWRC-UHFFFAOYSA-N -1 3 337.416 4.032 20 0 EIADHM CCC(CC)[C@H](NC(=O)c1cc(=O)c2ccccc2[n-]1)c1ccccc1 ZINC000464304363 1041943372 /nfs/dbraw/zinc/94/33/72/1041943372.db2.gz DZMWXZWCNOPOHC-NRFANRHFSA-N -1 3 348.446 4.435 20 0 EIADHM O=c1[n-]c(CN2CCCc3cc(F)ccc32)nc2c3ccccc3oc21 ZINC000506162063 1041966291 /nfs/dbraw/zinc/96/62/91/1041966291.db2.gz IFVUBTPBQHYSSN-UHFFFAOYSA-N -1 3 349.365 4.174 20 0 EIADHM Cc1c2cccc(F)c2oc1C(=O)[N-]c1nnc(-c2ccco2)s1 ZINC000053210330 1042317095 /nfs/dbraw/zinc/31/70/95/1042317095.db2.gz SNQJEQWTXQRKKY-UHFFFAOYSA-N -1 3 343.339 4.244 20 0 EIADHM Cc1cc([C@H](NC(=O)c2cc([O-])ccc2Cl)C2CC2)ccc1F ZINC000491420563 1042448837 /nfs/dbraw/zinc/44/88/37/1042448837.db2.gz CZZJOLBTDSCDHW-QGZVFWFLSA-N -1 3 333.790 4.374 20 0 EIADHM CSc1nc(NC(=O)c2cc(-c3ccccc3)ccc2Cl)n[n-]1 ZINC000518399753 1042499960 /nfs/dbraw/zinc/49/99/60/1042499960.db2.gz JQCLTBFCOOUPDS-UHFFFAOYSA-N -1 3 344.827 4.099 20 0 EIADHM CCCOc1ccc(CCC(=O)Nc2cc(Cl)ccc2[O-])cc1 ZINC000439102039 1042502861 /nfs/dbraw/zinc/50/28/61/1042502861.db2.gz ZENNRNXZMDQJSZ-UHFFFAOYSA-N -1 3 333.815 4.406 20 0 EIADHM Cc1cc(C)cc(-c2cc(=NC(=O)c3cccc(F)c3Cl)[nH][n-]2)c1 ZINC000439153063 1042527817 /nfs/dbraw/zinc/52/78/17/1042527817.db2.gz CWNPEJQTYTUYPJ-UHFFFAOYSA-N -1 3 343.789 4.160 20 0 EIADHM O=C([O-])c1cccc(CN2CCC(c3ccccc3)CC2)c1Cl ZINC000518782585 1042683435 /nfs/dbraw/zinc/68/34/35/1042683435.db2.gz CTTCHGJCQSOHAV-UHFFFAOYSA-N -1 3 329.827 4.418 20 0 EIADHM Cc1ccc2nc([N-]C(=O)c3c(F)c(F)cc(F)c3F)sc2c1 ZINC000177817287 1042851128 /nfs/dbraw/zinc/85/11/28/1042851128.db2.gz ZFJXPZGTZZRSCQ-UHFFFAOYSA-N -1 3 340.301 4.413 20 0 EIADHM O=C(/C=C/c1nc2ccccc2s1)Nc1c([O-])cccc1Cl ZINC000493355814 1042897441 /nfs/dbraw/zinc/89/74/41/1042897441.db2.gz QPISAVFVNGTLCU-CMDGGOBGSA-N -1 3 330.796 4.307 20 0 EIADHM O=C([N-]c1cc(Cl)cc(F)c1F)c1ccc(Br)o1 ZINC000441586865 1042898923 /nfs/dbraw/zinc/89/89/23/1042898923.db2.gz GQWUKWAHXSHVRM-UHFFFAOYSA-N -1 3 336.519 4.226 20 0 EIADHM FC(F)(F)Oc1ccc(-c2cc(C(F)(F)F)[n-]c(=S)n2)cc1 ZINC000379153052 1043093645 /nfs/dbraw/zinc/09/36/45/1043093645.db2.gz JJAZGXLVCGDUAE-UHFFFAOYSA-N -1 3 340.248 4.350 20 0 EIADHM CCn1ncc(C(=O)Nc2ccc(Cl)cc2[O-])c1-c1ccccc1 ZINC000427692498 1043162075 /nfs/dbraw/zinc/16/20/75/1043162075.db2.gz CLHRNSKPUXLTJA-UHFFFAOYSA-N -1 3 341.798 4.181 20 0 EIADHM O=C([N-]c1cc(-c2ccccc2)on1)c1ncoc1-c1ccccc1 ZINC000673939002 1043180799 /nfs/dbraw/zinc/18/07/99/1043180799.db2.gz XLCFJOHJDBYVOD-UHFFFAOYSA-N -1 3 331.331 4.249 20 0 EIADHM CC(C)[C@H](CNC(=O)c1cc([O-])c2ccccc2c1)c1cccnc1 ZINC000525925550 1043235440 /nfs/dbraw/zinc/23/54/40/1043235440.db2.gz ACMYEBRKJNPHKV-IBGZPJMESA-N -1 3 334.419 4.110 20 0 EIADHM O=C(N[C@H]1C[C@H]1c1c(F)cccc1F)c1cc([O-])c2ccccc2c1 ZINC000526893949 1043243962 /nfs/dbraw/zinc/24/39/62/1043243962.db2.gz NSTPYEGRLQJECL-PBHICJAKSA-N -1 3 339.341 4.110 20 0 EIADHM C[C@H](CNC(=O)c1cc([O-])c2ccccc2c1)COCc1ccccc1 ZINC000527450928 1043261001 /nfs/dbraw/zinc/26/10/01/1043261001.db2.gz VCAAJNXTASGEDD-MRXNPFEDSA-N -1 3 349.430 4.128 20 0 EIADHM [O-]c1cccc(CN2CCC[C@@H]2c2ccc3c(c2)OCO3)c1Cl ZINC000508194432 1043307403 /nfs/dbraw/zinc/30/74/03/1043307403.db2.gz LNOQKTNLDBWCQQ-CQSZACIVSA-N -1 3 331.799 4.111 20 0 EIADHM CCN(CC)C(=O)c1ccc(Nc2cccc([O-])c2Cl)c(OC)c1 ZINC001212471583 1043360994 /nfs/dbraw/zinc/36/09/94/1043360994.db2.gz XUJRPVVYCUFPDG-UHFFFAOYSA-N -1 3 348.830 4.280 20 0 EIADHM CCOc1ccc(-c2cc(Nc3cc(F)cc(F)c3[O-])on2)cc1 ZINC001212477818 1043406579 /nfs/dbraw/zinc/40/65/79/1043406579.db2.gz NCHSTAKPEYDKSV-UHFFFAOYSA-N -1 3 332.306 4.468 20 0 EIADHM CC(C)(C)C(=O)c1ccc(NC(=O)c2cnc3ccccc3c2[O-])cc1 ZINC000674122098 1043432099 /nfs/dbraw/zinc/43/20/99/1043432099.db2.gz XPLGENRLELKSBF-UHFFFAOYSA-N -1 3 348.402 4.009 20 0 EIADHM CC[C@H](C)Sc1nc2c(cnn2-c2cccc(Cl)c2)c(=O)[n-]1 ZINC000009521188 1043441998 /nfs/dbraw/zinc/44/19/98/1043441998.db2.gz OTXWBASQERBVHH-VIFPVBQESA-N -1 3 334.832 4.065 20 0 EIADHM Cc1cc(Nc2cc(F)cc(F)c2[O-])n(Cc2ccc(F)cc2)n1 ZINC001212484144 1043483152 /nfs/dbraw/zinc/48/31/52/1043483152.db2.gz MIVXOFLLSFXJTQ-UHFFFAOYSA-N -1 3 333.313 4.106 20 0 EIADHM Cc1ncc(C(=O)[N-]c2cc(F)ccc2SCC(F)F)s1 ZINC000078189228 1043516113 /nfs/dbraw/zinc/51/61/13/1043516113.db2.gz UPFJFMIPYKNNPB-UHFFFAOYSA-N -1 3 332.372 4.200 20 0 EIADHM O=C([N-]c1cc(C(F)(F)F)ccc1F)c1cc(-c2ccco2)on1 ZINC000171272759 1043521834 /nfs/dbraw/zinc/52/18/34/1043521834.db2.gz CJPWSTCRVKGSAI-UHFFFAOYSA-N -1 3 340.232 4.345 20 0 EIADHM Cc1c([O-])ccc2c(CN(C)c3ccc(F)c(Cl)c3)cc(=O)oc12 ZINC001168702293 1043571658 /nfs/dbraw/zinc/57/16/58/1043571658.db2.gz ZNSKCLCHXLKMHL-UHFFFAOYSA-N -1 3 347.773 4.236 20 0 EIADHM [O-]c1c(F)cc(F)cc1Nc1c(F)ccc(Br)c1F ZINC001212492711 1043636656 /nfs/dbraw/zinc/63/66/56/1043636656.db2.gz HYCIGIUIOVQCAX-UHFFFAOYSA-N -1 3 336.082 4.455 20 0 EIADHM CC(C)[C@]1(C(=O)[O-])CCN(Cc2nc(C3CCCCC3)cs2)C1 ZINC000521257059 1043671954 /nfs/dbraw/zinc/67/19/54/1043671954.db2.gz CMNAVRKWGOMCKT-SFHVURJKSA-N -1 3 336.501 4.124 20 0 EIADHM CCc1ccc([O-])c(C(=O)N2CC[C@@H](C(F)(F)F)C(C)(C)C2)c1 ZINC000190708545 1043731450 /nfs/dbraw/zinc/73/14/50/1043731450.db2.gz BZHJDNMKDZUOHL-CQSZACIVSA-N -1 3 329.362 4.005 20 0 EIADHM O=c1[n-]c(Sc2ncc(-c3ccc(F)cc3)o2)nc2ccccc12 ZINC000731921608 1043845243 /nfs/dbraw/zinc/84/52/43/1043845243.db2.gz IIASKVAUENFPIW-UHFFFAOYSA-N -1 3 339.351 4.281 20 0 EIADHM Cc1cc(N(C)C)ccc1[N-]S(=O)(=O)c1ccc2ccccc2c1 ZINC000079268895 1043878638 /nfs/dbraw/zinc/87/86/38/1043878638.db2.gz VCHATRLPDIJCMS-UHFFFAOYSA-N -1 3 340.448 4.015 20 0 EIADHM CC(C)(C(=O)Nc1ccc(Br)cc1[O-])c1cccs1 ZINC000115332343 1043890023 /nfs/dbraw/zinc/89/00/23/1043890023.db2.gz DVJFBTHKSWQHDY-UHFFFAOYSA-N -1 3 340.242 4.133 20 0 EIADHM O=c1[n-]c(Oc2ccc(Br)c(F)c2)nc2ccccc12 ZINC000732805193 1044008797 /nfs/dbraw/zinc/00/87/97/1044008797.db2.gz QHDQEMREOOBJFT-UHFFFAOYSA-N -1 3 335.132 4.029 20 0 EIADHM CCCCc1nc(COC(=O)c2cc(Cl)c(Cl)[n-]2)cs1 ZINC000733430998 1044223123 /nfs/dbraw/zinc/22/31/23/1044223123.db2.gz WNQULRMFUSLJMQ-UHFFFAOYSA-N -1 3 333.240 4.478 20 0 EIADHM O=C(/C=C(/c1ccc(Cl)cc1)C(F)(F)F)Nc1ncccc1[O-] ZINC000761713618 1044301499 /nfs/dbraw/zinc/30/14/99/1044301499.db2.gz UFJPURSPVHVSES-FLIBITNWSA-N -1 3 342.704 4.025 20 0 EIADHM CC(=O)c1ccc(C(=O)Nc2ccc(COC(C)(C)C)cc2)cc1[O-] ZINC000665350687 1044489339 /nfs/dbraw/zinc/48/93/39/1044489339.db2.gz SRMNVFJKHAEXJX-UHFFFAOYSA-N -1 3 341.407 4.162 20 0 EIADHM COc1ccc(NC(=O)c2cccc(C)c2[O-])cc1OC1CCCC1 ZINC000914574122 1044519809 /nfs/dbraw/zinc/51/98/09/1044519809.db2.gz CNXKJTSXPZJHOJ-UHFFFAOYSA-N -1 3 341.407 4.283 20 0 EIADHM COCc1nc(=O)c2c(-c3ccc(-c4ccccc4)cc3)csc2[n-]1 ZINC000113459269 1044605452 /nfs/dbraw/zinc/60/54/52/1044605452.db2.gz DSUQBVGSSLNZRZ-UHFFFAOYSA-N -1 3 348.427 4.465 20 0 EIADHM Cc1cc(=O)[n-]c(-c2ccc(NC(=O)[C@H](C)CCC(C)(C)C)cc2)n1 ZINC000543468384 1044660059 /nfs/dbraw/zinc/66/00/59/1044660059.db2.gz BCRMKLXIEJEJKC-CYBMUJFWSA-N -1 3 341.455 4.146 20 0 EIADHM CC(C)c1cc(Cl)nc([N-][C@@H](c2ccccn2)C(F)(F)F)n1 ZINC001168478289 1044721441 /nfs/dbraw/zinc/72/14/41/1044721441.db2.gz AQRWSUOPGQFUOL-LBPRGKRZSA-N -1 3 330.741 4.364 20 0 EIADHM CCSc1ccccc1OC(=O)c1cc(-c2ccc(C)o2)[n-]n1 ZINC000734975527 1044726037 /nfs/dbraw/zinc/72/60/37/1044726037.db2.gz LOBPOIHRHWREJA-UHFFFAOYSA-N -1 3 328.393 4.309 20 0 EIADHM CCSc1ccccc1OC(=O)c1cc(-c2ccc(C)o2)n[n-]1 ZINC000734975527 1044726054 /nfs/dbraw/zinc/72/60/54/1044726054.db2.gz LOBPOIHRHWREJA-UHFFFAOYSA-N -1 3 328.393 4.309 20 0 EIADHM CC(C)(C[N-]S(=O)(=O)c1cc(Cl)ccc1Cl)C1CCC1 ZINC001211884601 1044807307 /nfs/dbraw/zinc/80/73/07/1044807307.db2.gz VEYABEWULYQZOU-UHFFFAOYSA-N -1 3 336.284 4.098 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2ccc(Oc3nccs3)cc2)cc1 ZINC000914864358 1044836317 /nfs/dbraw/zinc/83/63/17/1044836317.db2.gz ODYGCVLEHZWVLM-UHFFFAOYSA-N -1 3 346.433 4.045 20 0 EIADHM [O-]c1cccc(CN2CC[C@H](OCCCc3ccccc3)C2)c1Cl ZINC000508968165 1044851697 /nfs/dbraw/zinc/85/16/97/1044851697.db2.gz VHOHAHFGYSIMQV-SFHVURJKSA-N -1 3 345.870 4.269 20 0 EIADHM Cc1ccc(Cl)c([N-]S(=O)(=O)c2ccc(F)cc2Cl)c1 ZINC000474319806 1044854817 /nfs/dbraw/zinc/85/48/17/1044854817.db2.gz YLJYOPPWOYWDPM-UHFFFAOYSA-N -1 3 334.199 4.242 20 0 EIADHM Cc1cccc([O-])c1C(=O)N1CC(Cc2ccc(C(F)(F)F)cc2)C1 ZINC000626046564 1045156708 /nfs/dbraw/zinc/15/67/08/1045156708.db2.gz JBOJEMAAOZGYJG-UHFFFAOYSA-N -1 3 349.352 4.034 20 0 EIADHM O=C([N-]C1(c2cccc(Cl)c2)CC1)C(F)(F)c1ccc(F)cc1 ZINC000740809522 1045226200 /nfs/dbraw/zinc/22/62/00/1045226200.db2.gz PZJDCQIBKDBIJT-UHFFFAOYSA-N -1 3 339.744 4.376 20 0 EIADHM Cc1ccc(/C=C/S(=O)(=O)[N-]c2ccccc2OCC2CC2)cc1 ZINC000740813109 1045228262 /nfs/dbraw/zinc/22/82/62/1045228262.db2.gz SQOGVWGVDLMVLO-OUKQBFOZSA-N -1 3 343.448 4.196 20 0 EIADHM CC(C)(C)[C@@H](NC(=O)NCc1ccc([O-])c(F)c1)c1cccc(F)c1 ZINC000489614393 1045288109 /nfs/dbraw/zinc/28/81/09/1045288109.db2.gz BLUJYBFIHDFYJV-KRWDZBQOSA-N -1 3 348.393 4.257 20 0 EIADHM O=C(Nc1ccc(Br)cc1F)c1cc([O-])ccc1Cl ZINC000236557680 1045359647 /nfs/dbraw/zinc/35/96/47/1045359647.db2.gz MVZCPXPTVDMRQD-UHFFFAOYSA-N -1 3 344.567 4.200 20 0 EIADHM O=C(CCCOc1cccc2ccccc21)[N-]OCc1ccccc1 ZINC000915597102 1045431836 /nfs/dbraw/zinc/43/18/36/1045431836.db2.gz ZAJORDFBEZDINK-UHFFFAOYSA-N -1 3 335.403 4.247 20 0 EIADHM CCc1cc2c(CSc3ccc(C)cn3)cc(=O)oc2cc1[O-] ZINC000915795945 1045466560 /nfs/dbraw/zinc/46/65/60/1045466560.db2.gz OAOZVQLBIHXYEN-UHFFFAOYSA-N -1 3 327.405 4.057 20 0 EIADHM [O-]c1ccc(Nc2ncc(Br)cc2Cl)c(F)c1F ZINC001211997831 1045697568 /nfs/dbraw/zinc/69/75/68/1045697568.db2.gz ODAZKQZZQNAPIR-UHFFFAOYSA-N -1 3 335.535 4.225 20 0 EIADHM CCS[C@@H]1CCCC[C@@H]1NC(=O)c1cc2sccc2c([O-])c1 ZINC000791382381 1045729893 /nfs/dbraw/zinc/72/98/93/1045729893.db2.gz YOMWXYLUJTZICV-DZGCQCFKSA-N -1 3 335.494 4.401 20 0 EIADHM Cc1nc(-c2c[nH]c(C(=O)Nc3cc(Cl)ccc3[O-])c2)cs1 ZINC000067145594 1045738820 /nfs/dbraw/zinc/73/88/20/1045738820.db2.gz UPDHPZLFWGWNLZ-UHFFFAOYSA-N -1 3 333.800 4.058 20 0 EIADHM CCCCC[C@H](C)NC(=O)Nc1ccc(-c2cc(=O)[n-]c(C)n2)cc1 ZINC000915885289 1045822215 /nfs/dbraw/zinc/82/22/15/1045822215.db2.gz BNTDFPCEDHGZRM-ZDUSSCGKSA-N -1 3 342.443 4.248 20 0 EIADHM O=C(Nc1cccnc1)c1ccccc1Nc1ccc([O-])c(F)c1F ZINC001212009828 1045832283 /nfs/dbraw/zinc/83/22/83/1045832283.db2.gz VLXHVVIMVHIKKW-UHFFFAOYSA-N -1 3 341.317 4.061 20 0 EIADHM CCOC(=O)c1cc(Nc2ccc([O-])c(F)c2F)ccc1Cl ZINC001212011209 1045833745 /nfs/dbraw/zinc/83/37/45/1045833745.db2.gz XZXBOBQKARALNG-UHFFFAOYSA-N -1 3 327.714 4.244 20 0 EIADHM CCOC(=O)c1cc(Cl)cc(Nc2ccc([O-])c(F)c2F)c1 ZINC001212014020 1045835527 /nfs/dbraw/zinc/83/55/27/1045835527.db2.gz VQFDKKMQQUDUMF-UHFFFAOYSA-N -1 3 327.714 4.244 20 0 EIADHM [O-]c1ccc(Nc2cccc(-c3nc(CO)cs3)c2)c(F)c1F ZINC001212016169 1045839083 /nfs/dbraw/zinc/83/90/83/1045839083.db2.gz BCXGAMPQXJWMTD-UHFFFAOYSA-N -1 3 334.347 4.030 20 0 EIADHM [O-]c1ccc(Nc2ccccc2-c2nc(CO)cs2)c(F)c1F ZINC001212016350 1045839969 /nfs/dbraw/zinc/83/99/69/1045839969.db2.gz LWOKVXVVCKDSSO-UHFFFAOYSA-N -1 3 334.347 4.030 20 0 EIADHM Cc1ccc(-c2ccc(/C=C3/C(=O)[N-]C(=O)c4ccccc43)o2)cc1 ZINC000915987501 1045860195 /nfs/dbraw/zinc/86/01/95/1045860195.db2.gz FVZLFJBIZQEBNV-LDADJPATSA-N -1 3 329.355 4.066 20 0 EIADHM CC1(C[N-]S(=O)(=O)c2cccc(Cl)c2Cl)CCCCC1 ZINC001212046179 1045866043 /nfs/dbraw/zinc/86/60/43/1045866043.db2.gz XBMHEAGXMCFXCC-UHFFFAOYSA-N -1 3 336.284 4.242 20 0 EIADHM CCc1c(NC(=O)c2cc([O-])c3ccccc3c2)cnn1CC(C)C ZINC000792275592 1045887702 /nfs/dbraw/zinc/88/77/02/1045887702.db2.gz MZQFFBOKZAABEP-UHFFFAOYSA-N -1 3 337.423 4.213 20 0 EIADHM Cc1sc2[n-]c([C@H](C)OC(=O)C[C@@H]3CCC[C@@H]3C)nc(=O)c2c1C ZINC000769187054 1045891949 /nfs/dbraw/zinc/89/19/49/1045891949.db2.gz USZBYXZMYQEABX-GAFUQQFSSA-N -1 3 348.468 4.444 20 0 EIADHM Cc1coc(C)c1C(=O)O[C@H](C)c1nc(=O)c2c(C)c(C)sc2[n-]1 ZINC000792759175 1046061989 /nfs/dbraw/zinc/06/19/89/1046061989.db2.gz XSYINODNBVSLKY-SNVBAGLBSA-N -1 3 346.408 4.142 20 0 EIADHM Cc1ccc([C@@H]2CCN(C(=O)CCCc3ccc([O-])c(F)c3)C2)cc1 ZINC000530336073 1046166537 /nfs/dbraw/zinc/16/65/37/1046166537.db2.gz OUPULDHOMHNGQC-GOSISDBHSA-N -1 3 341.426 4.179 20 0 EIADHM CC(C)Oc1ccc(CN2CCC[C@@H](CCC(=O)[O-])C2)cc1Cl ZINC000263168745 1046257384 /nfs/dbraw/zinc/25/73/84/1046257384.db2.gz RPWQWDCDQYLDGA-AWEZNQCLSA-N -1 3 339.863 4.204 20 0 EIADHM CCCC(=CC(=O)NCc1ccc([O-])c(Br)c1)CCC ZINC000770802269 1046272560 /nfs/dbraw/zinc/27/25/60/1046272560.db2.gz QOAHBJRTHPHNHA-UHFFFAOYSA-N -1 3 340.261 4.298 20 0 EIADHM O=C([O-])C1CN(Cc2ccc(-c3ccc(Cl)c(Cl)c3)s2)C1 ZINC000263472527 1046294579 /nfs/dbraw/zinc/29/45/79/1046294579.db2.gz DSQKHRXZVGZYOQ-UHFFFAOYSA-N -1 3 342.247 4.238 20 0 EIADHM [O-]c1cccc(CN[C@@H]2CCc3c2cccc3F)c1Br ZINC000459402703 1046600418 /nfs/dbraw/zinc/60/04/18/1046600418.db2.gz ZULOOGXMWMFEAY-CQSZACIVSA-N -1 3 336.204 4.071 20 0 EIADHM O=C(Cc1csc(-c2ccccc2)n1)Nc1cc(Cl)ccc1[O-] ZINC000067139017 1046714324 /nfs/dbraw/zinc/71/43/24/1046714324.db2.gz UMTMLCJXWHHRMH-UHFFFAOYSA-N -1 3 344.823 4.350 20 0 EIADHM CCOc1cc(CNc2cnn([C@H](C)C3CC3)c2)cc(Cl)c1[O-] ZINC000459495130 1046724267 /nfs/dbraw/zinc/72/42/67/1046724267.db2.gz CXGPTCCEDAICJA-LLVKDONJSA-N -1 3 335.835 4.224 20 0 EIADHM CC(C)(C)c1ncc(C(=O)[N-]c2nc(-c3ccccc3)ns2)s1 ZINC000067492712 1046739526 /nfs/dbraw/zinc/73/95/26/1046739526.db2.gz JNLOIYIQLXOHLW-UHFFFAOYSA-N -1 3 344.465 4.211 20 0 EIADHM [O-]c1cccc(CNCc2ccc(C3CC3)cc2)c1Br ZINC000459519384 1046742879 /nfs/dbraw/zinc/74/28/79/1046742879.db2.gz JSZSJDGGZCYGTO-UHFFFAOYSA-N -1 3 332.241 4.322 20 0 EIADHM CCN(Cc1cccc([O-])c1Br)[C@H](C)c1cccnc1 ZINC000459550103 1046770832 /nfs/dbraw/zinc/77/08/32/1046770832.db2.gz HDDOUFOGNLYIGN-GFCCVEGCSA-N -1 3 335.245 4.133 20 0 EIADHM O=C(OCc1c(Cl)ccc2cccnc21)c1cc2occc2[n-]1 ZINC000786027383 1046798590 /nfs/dbraw/zinc/79/85/90/1046798590.db2.gz CTKDAUWVEHCIEZ-UHFFFAOYSA-N -1 3 326.739 4.320 20 0 EIADHM CC1(C)CN(Cc2cccc([O-])c2Br)[C@@H]1c1ccncc1 ZINC000459600196 1046804672 /nfs/dbraw/zinc/80/46/72/1046804672.db2.gz ZKFRQMAJWBLAIA-MRXNPFEDSA-N -1 3 347.256 4.133 20 0 EIADHM CC(C)(C)c1csc([N-]C(=O)c2scnc2C(F)(F)F)n1 ZINC000459857764 1046908643 /nfs/dbraw/zinc/90/86/43/1046908643.db2.gz DDFRNAFTTWPABF-UHFFFAOYSA-N -1 3 335.376 4.168 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)OCc1ccc2ncccc2c1 ZINC000787846518 1047058884 /nfs/dbraw/zinc/05/88/84/1047058884.db2.gz SZOSUBLKLCGBCT-UHFFFAOYSA-N -1 3 339.366 4.146 20 0 EIADHM CC(C)Oc1ccccc1[N-]S(=O)(=O)C1=Cc2ccccc2CC1 ZINC000917740418 1047084547 /nfs/dbraw/zinc/08/45/47/1047084547.db2.gz RENKOWRYKOLLTB-UHFFFAOYSA-N -1 3 343.448 4.203 20 0 EIADHM O=C(O[C@@H]1CCOc2c(F)cc(F)cc21)c1cc2ccsc2[n-]1 ZINC000806007986 1047087567 /nfs/dbraw/zinc/08/75/67/1047087567.db2.gz NCCKMJAOYWHYKI-CYBMUJFWSA-N -1 3 335.331 4.188 20 0 EIADHM C[C@H](Cc1cccc(C(F)(F)F)c1)C(=O)Nc1cccc([O-])c1F ZINC000128854652 1047124644 /nfs/dbraw/zinc/12/46/44/1047124644.db2.gz QWAXXUMFEVXNCC-SNVBAGLBSA-N -1 3 341.304 4.367 20 0 EIADHM O=C(c1cc2sccc2c([O-])c1)N1CCC[C@H]1Cc1ccccc1 ZINC000788272016 1047153399 /nfs/dbraw/zinc/15/33/99/1047153399.db2.gz QKOVDEHVUFPYBQ-INIZCTEOSA-N -1 3 337.444 4.454 20 0 EIADHM Fc1ccccc1[N-]c1nnc(Sc2cncc(Cl)n2)s1 ZINC000788531680 1047228215 /nfs/dbraw/zinc/22/82/15/1047228215.db2.gz CLNFPWQZPGBAIY-UHFFFAOYSA-N -1 3 339.808 4.015 20 0 EIADHM Cc1cc(=O)[n-]c(C=Cc2nc3ccc(Br)cc3s2)n1 ZINC000806574616 1047312810 /nfs/dbraw/zinc/31/28/10/1047312810.db2.gz SYZDPXPJQTXGAP-SNAWJCMRSA-N -1 3 348.225 4.033 20 0 EIADHM O=C(Nc1ccc([O-])c(C(F)(F)F)c1)C1(Cc2ccccc2)CC1 ZINC000476143033 1047372397 /nfs/dbraw/zinc/37/23/97/1047372397.db2.gz HHYFSXNSAJLJDO-UHFFFAOYSA-N -1 3 335.325 4.372 20 0 EIADHM CC(C)c1nc(C(=O)Nc2ccc([O-])c(C(F)(F)F)c2)cs1 ZINC000476170647 1047398757 /nfs/dbraw/zinc/39/87/57/1047398757.db2.gz QZBVYFAVYQBYQX-UHFFFAOYSA-N -1 3 330.331 4.243 20 0 EIADHM O=C(Nc1cccc([O-])c1F)c1cc(C2CC2)nc2ccc(F)cc21 ZINC000129586941 1047437628 /nfs/dbraw/zinc/43/76/28/1047437628.db2.gz KMJINFGBLOBLSL-UHFFFAOYSA-N -1 3 340.329 4.348 20 0 EIADHM CC(C)c1cccc(S(=O)(=O)[N-]c2ccc(F)c(F)c2F)c1 ZINC000460412096 1047778573 /nfs/dbraw/zinc/77/85/73/1047778573.db2.gz LFTQRSBHQTWZLF-UHFFFAOYSA-N -1 3 329.343 4.028 20 0 EIADHM COc1ccc([O-])c(C(=O)Nc2ccc(OC3CCCC3)c(F)c2)c1 ZINC000460423410 1047788349 /nfs/dbraw/zinc/78/83/49/1047788349.db2.gz HDJLVYIDZBBZBR-UHFFFAOYSA-N -1 3 345.370 4.114 20 0 EIADHM Cc1cc(N2CCCC2)ccc1NC(=O)c1cc([O-])ccc1Cl ZINC000550649681 1047802748 /nfs/dbraw/zinc/80/27/48/1047802748.db2.gz RAKPISCRVUHGLM-UHFFFAOYSA-N -1 3 330.815 4.207 20 0 EIADHM Cc1sc2[n-]c([C@H](C)OC(=O)CCC(C)(F)F)nc(=O)c2c1C ZINC000919293458 1047811259 /nfs/dbraw/zinc/81/12/59/1047811259.db2.gz WYRPJJMFYITVPU-QMMMGPOBSA-N -1 3 344.383 4.053 20 0 EIADHM O=C(CCCc1ccccc1)Nc1ccc(Br)cc1[O-] ZINC000071956663 1047818801 /nfs/dbraw/zinc/81/88/01/1047818801.db2.gz QBUAZHRJTLULKC-UHFFFAOYSA-N -1 3 334.213 4.116 20 0 EIADHM O=C(c1cc([O-])ccc1Cl)N1CCC[C@H]1/C=C/c1ccccc1 ZINC000498709839 1047818989 /nfs/dbraw/zinc/81/89/89/1047818989.db2.gz CJSJUPLEMRTMIV-HVHJFMEUSA-N -1 3 327.811 4.364 20 0 EIADHM COc1ccc(C(=O)NCc2ccc(-c3cccc(C)c3)cc2)c([O-])c1 ZINC001136917734 1047897378 /nfs/dbraw/zinc/89/73/78/1047897378.db2.gz SMZKTWHVERFZSN-UHFFFAOYSA-N -1 3 347.414 4.306 20 0 EIADHM C[C@H](Nc1ccccc1-c1nnn[n-]1)c1ccccc1C(F)(F)F ZINC001170742448 1047975942 /nfs/dbraw/zinc/97/59/42/1047975942.db2.gz KHOVATQDKFYSGI-JTQLQIEISA-N -1 3 333.317 4.059 20 0 EIADHM C[C@H](Nc1ccccc1-c1nn[n-]n1)c1ccccc1C(F)(F)F ZINC001170742448 1047975977 /nfs/dbraw/zinc/97/59/77/1047975977.db2.gz KHOVATQDKFYSGI-JTQLQIEISA-N -1 3 333.317 4.059 20 0 EIADHM Cc1ccc(O[C@H](C)CNC(=O)c2ccc(C(C)C)cc2[O-])cc1 ZINC001137011220 1048061063 /nfs/dbraw/zinc/06/10/63/1048061063.db2.gz PIVBWWIKLVNACF-OAHLLOKOSA-N -1 3 327.424 4.021 20 0 EIADHM CCc1ccc([C@H]2C[C@@H](C)CCN2C(=O)c2ccc(OC)cc2[O-])o1 ZINC001137026847 1048080966 /nfs/dbraw/zinc/08/09/66/1048080966.db2.gz UWRJMUZVNKWSNP-SUMWQHHRSA-N -1 3 343.423 4.170 20 0 EIADHM Cc1ccc(CN(CC2CC2)C(=O)c2cc([O-])c3ccccc3c2)cn1 ZINC000844007312 1048175486 /nfs/dbraw/zinc/17/54/86/1048175486.db2.gz HJUVGCDNJVDQLY-UHFFFAOYSA-N -1 3 346.430 4.301 20 0 EIADHM Cc1ccc(C(=O)N(Cc2cccc(F)c2)C2CCCC2)c([O-])c1 ZINC001144156761 1048467319 /nfs/dbraw/zinc/46/73/19/1048467319.db2.gz QXUUZAQMFKDHIJ-UHFFFAOYSA-N -1 3 327.399 4.425 20 0 EIADHM Cc1ccc(-c2csc(NC(=O)c3cccc(C)c3[O-])n2)s1 ZINC001144369208 1048620228 /nfs/dbraw/zinc/62/02/28/1048620228.db2.gz SZTUYEFNUKRENE-UHFFFAOYSA-N -1 3 330.434 4.446 20 0 EIADHM CCc1nc(SCc2noc(-c3ccccc3[O-])n2)sc1C ZINC000845325423 1048639821 /nfs/dbraw/zinc/63/98/21/1048639821.db2.gz QKOYQXFHWTWJFM-UHFFFAOYSA-N -1 3 333.438 4.062 20 0 EIADHM O=C(Nc1ccc(-c2ccccc2)cc1)c1cc2c(cc1[O-])OCO2 ZINC001135405267 1048702977 /nfs/dbraw/zinc/70/29/77/1048702977.db2.gz JBCJWCSNCWVERZ-UHFFFAOYSA-N -1 3 333.343 4.040 20 0 EIADHM [O-]c1cc(F)c(CN2CCC(n3ccc4ccccc43)CC2)c(F)c1 ZINC001144559919 1048728418 /nfs/dbraw/zinc/72/84/18/1048728418.db2.gz RRIIQEOFFPCNBW-UHFFFAOYSA-N -1 3 342.389 4.462 20 0 EIADHM O=C(Cc1ccc([O-])c(F)c1)Nc1cccc(-c2cccs2)c1 ZINC001144631420 1048765078 /nfs/dbraw/zinc/76/50/78/1048765078.db2.gz PZKUSTWPBAHIJX-UHFFFAOYSA-N -1 3 327.380 4.441 20 0 EIADHM [O-]c1cc(F)c(CN2CCC3(CCc4ccccc43)CC2)cc1F ZINC001144647592 1048769513 /nfs/dbraw/zinc/76/95/13/1048769513.db2.gz HUGAHHMBUOFJIN-UHFFFAOYSA-N -1 3 329.390 4.150 20 0 EIADHM COC(=O)c1cc(Cl)c(Cl)c([N-]C(=O)c2sccc2F)c1 ZINC001132262853 1048783765 /nfs/dbraw/zinc/78/37/65/1048783765.db2.gz HKUBNYIKLBJRKY-UHFFFAOYSA-N -1 3 348.182 4.233 20 0 EIADHM Cc1nc(C)c(COC(=O)c2cc3cc(Cl)sc3[n-]2)s1 ZINC000810567793 1048814371 /nfs/dbraw/zinc/81/43/71/1048814371.db2.gz PDDABNVDWSRECA-UHFFFAOYSA-N -1 3 326.830 4.313 20 0 EIADHM C[C@@H]1C[C@H]1c1ccc(C[N-]C(=O)C(F)(F)c2cccc(Cl)c2)o1 ZINC000921004286 1048835907 /nfs/dbraw/zinc/83/59/07/1048835907.db2.gz CNIMXMYTHOGUOW-QMTHXVAHSA-N -1 3 339.769 4.465 20 0 EIADHM Cc1ccc(CCC(=O)[N-]OCc2ccc(C(F)(F)F)cc2)s1 ZINC000810647320 1048839016 /nfs/dbraw/zinc/83/90/16/1048839016.db2.gz GQXKTMFFHSDFST-UHFFFAOYSA-N -1 3 343.370 4.256 20 0 EIADHM CCc1cnc(COC(=O)c2cc3cc(Cl)sc3[n-]2)s1 ZINC000810669113 1048842924 /nfs/dbraw/zinc/84/29/24/1048842924.db2.gz LWKRZLVEJROXHV-UHFFFAOYSA-N -1 3 326.830 4.259 20 0 EIADHM C/C(=C\CN(C)[C@@H](C)c1sc(-c2ccccc2)nc1C)C(=O)[O-] ZINC000846250681 1048850449 /nfs/dbraw/zinc/85/04/49/1048850449.db2.gz QFXQYNIZUFTJKB-WONIAPNHSA-N -1 3 330.453 4.142 20 0 EIADHM C/C(=C/CN(C)[C@H](C)c1sc(-c2ccccc2)nc1C)C(=O)[O-] ZINC000846250678 1048850622 /nfs/dbraw/zinc/85/06/22/1048850622.db2.gz QFXQYNIZUFTJKB-GAJOTYCWSA-N -1 3 330.453 4.142 20 0 EIADHM CC(=O)c1ccc(C(=O)Nc2ccccc2SC(F)F)cc1[O-] ZINC001135679612 1048854383 /nfs/dbraw/zinc/85/43/83/1048854383.db2.gz XAKMLLLWFUOEFF-UHFFFAOYSA-N -1 3 337.347 4.162 20 0 EIADHM Cc1ccc(N(CC(C)C)C(=O)c2nnc3ccccc3c2[O-])c(C)c1 ZINC000846299195 1048855203 /nfs/dbraw/zinc/85/52/03/1048855203.db2.gz NGTMBLZUMUETOF-UHFFFAOYSA-N -1 3 349.434 4.255 20 0 EIADHM O=C(Nc1c([O-])cccc1Cl)c1ccn(-c2ccccc2Cl)n1 ZINC000816769249 1048856802 /nfs/dbraw/zinc/85/68/02/1048856802.db2.gz ZZTLYDVFKLJVOY-UHFFFAOYSA-N -1 3 348.189 4.137 20 0 EIADHM COc1ccc(/C=C(\C)C(=O)Nc2c([O-])cccc2Cl)cc1F ZINC000816769100 1048857022 /nfs/dbraw/zinc/85/70/22/1048857022.db2.gz UDRUTZXDYFQKLV-CSKARUKUSA-N -1 3 335.762 4.235 20 0 EIADHM Cc1cc(Cl)ncc1NC(=O)c1cc([O-])cc(C(F)(F)F)c1 ZINC000816949011 1048881744 /nfs/dbraw/zinc/88/17/44/1048881744.db2.gz MKFJNTUMYQCTJF-UHFFFAOYSA-N -1 3 330.693 4.020 20 0 EIADHM CC[C@H](C)CO[N-]C(=O)[C@H]1CC=CC[C@@H]1c1nc2ccccc2s1 ZINC000816976800 1048884583 /nfs/dbraw/zinc/88/45/83/1048884583.db2.gz KFQDPQMXXURSSI-KKUMJFAQSA-N -1 3 344.480 4.440 20 0 EIADHM Cc1cccc(C(=O)Nc2cc(Br)ccc2[O-])c1Cl ZINC000134140666 1048886961 /nfs/dbraw/zinc/88/69/61/1048886961.db2.gz HTWWAHOZPJRCOL-UHFFFAOYSA-N -1 3 340.604 4.369 20 0 EIADHM C[C@@H](C(=O)Nc1ccc([O-])c(C(F)(F)F)c1)c1cccc(F)c1 ZINC000134175635 1048892111 /nfs/dbraw/zinc/89/21/11/1048892111.db2.gz FRUZMWZDMBMQQX-SECBINFHSA-N -1 3 327.277 4.292 20 0 EIADHM COc1ccc([C@@H](C)C(=O)Nc2ccc([O-])c(C(F)(F)F)c2)cc1 ZINC000134218604 1048899500 /nfs/dbraw/zinc/89/95/00/1048899500.db2.gz RYEMDUBZWZWFBP-SNVBAGLBSA-N -1 3 339.313 4.162 20 0 EIADHM CC(=O)c1ccc(C(=O)Nc2ccc3oc(C(C)C)nc3c2)cc1[O-] ZINC001135870890 1048929107 /nfs/dbraw/zinc/92/91/07/1048929107.db2.gz VQYPYRCRYHSYIV-UHFFFAOYSA-N -1 3 338.363 4.112 20 0 EIADHM CCc1cccc(C(=O)Nc2ccc(N3CCC(C)CC3)cc2)c1[O-] ZINC001146581062 1049038966 /nfs/dbraw/zinc/03/89/66/1049038966.db2.gz WHBCIHWWKKACAX-UHFFFAOYSA-N -1 3 338.451 4.443 20 0 EIADHM CCc1ccc(C(=O)Nc2ccc(Cl)c3cccnc23)c([O-])c1 ZINC001136061216 1049062376 /nfs/dbraw/zinc/06/23/76/1049062376.db2.gz WQKOIJIGJPDSKC-UHFFFAOYSA-N -1 3 326.783 4.409 20 0 EIADHM Cc1cc(SC(C)(C)C)ccc1NC(=O)c1ccc(N)cc1[O-] ZINC000817931785 1049070629 /nfs/dbraw/zinc/07/06/29/1049070629.db2.gz MQDPAXGBBMVVFQ-UHFFFAOYSA-N -1 3 330.453 4.426 20 0 EIADHM O=C([O-])CC[C@H]1CCCCN1Cc1cc2ccccc2nc1Cl ZINC000818329239 1049128738 /nfs/dbraw/zinc/12/87/38/1049128738.db2.gz RUJHDMVVTWFNNP-OAHLLOKOSA-N -1 3 332.831 4.108 20 0 EIADHM COc1ccc(C(=O)N2CCCCC[C@@H]2c2cccc(C)c2)c([O-])c1 ZINC001147371919 1049137889 /nfs/dbraw/zinc/13/78/89/1049137889.db2.gz ALRQKBDGMFEUDU-LJQANCHMSA-N -1 3 339.435 4.467 20 0 EIADHM CCC[C@@H](CCc1ccccc1)NC(=O)c1ccc(C(C)=O)c([O-])c1 ZINC001147814648 1049215247 /nfs/dbraw/zinc/21/52/47/1049215247.db2.gz IPWJEDRGNXYNBP-SFHVURJKSA-N -1 3 339.435 4.126 20 0 EIADHM CC[C@H](C)C[C@@H](C)NC(=O)c1c[n-]c(=NC(=O)OC(C)(C)C)s1 ZINC001147860982 1049229820 /nfs/dbraw/zinc/22/98/20/1049229820.db2.gz MSWVAGHJFXUBHK-WDEREUQCSA-N -1 3 341.477 4.045 20 0 EIADHM CC[C@H](C)C[C@H](C)NC(=O)c1c[n-]c(=NC(=O)OC(C)(C)C)s1 ZINC001147860981 1049230371 /nfs/dbraw/zinc/23/03/71/1049230371.db2.gz MSWVAGHJFXUBHK-QWRGUYRKSA-N -1 3 341.477 4.045 20 0 EIADHM CSc1ccc([O-])c(C(=O)N(Cc2ccc(F)cc2F)C2CC2)c1 ZINC001136180684 1049241319 /nfs/dbraw/zinc/24/13/19/1049241319.db2.gz JYNJHTXHBLEGGE-UHFFFAOYSA-N -1 3 349.402 4.197 20 0 EIADHM CN(C(=O)Cc1ccc([O-])c(F)c1)C1c2ccccc2-c2ccccc21 ZINC001148903778 1049396086 /nfs/dbraw/zinc/39/60/86/1049396086.db2.gz FXIDXJWKTURQCQ-UHFFFAOYSA-N -1 3 347.389 4.302 20 0 EIADHM CCO[C@H]1C[C@H](N(C)C(=O)c2cc([O-])ccc2Cl)C1(CC)CC ZINC001148987492 1049408191 /nfs/dbraw/zinc/40/81/91/1049408191.db2.gz FJZVNOLOBHJYRS-HOTGVXAUSA-N -1 3 339.863 4.101 20 0 EIADHM Cc1cccc([O-])c1C(=O)N[C@H](C)CCc1ccc(OC(C)C)cc1 ZINC001136324957 1049467886 /nfs/dbraw/zinc/46/78/86/1049467886.db2.gz DCMGSETXAZWRPR-MRXNPFEDSA-N -1 3 341.451 4.239 20 0 EIADHM O=C(CCC(=O)c1ccc(-c2ccccc2)cc1)[N-]OC/C=C\Cl ZINC000812406114 1049468205 /nfs/dbraw/zinc/46/82/05/1049468205.db2.gz NAZAXUXGKJLZGZ-PQMHYQBVSA-N -1 3 343.810 4.117 20 0 EIADHM CC(C)[C@@H](SCc1ccccc1)C(=O)NCc1ccc([O-])c(F)c1 ZINC000610011825 1049490529 /nfs/dbraw/zinc/49/05/29/1049490529.db2.gz TYGANSQASINAEE-GOSISDBHSA-N -1 3 347.455 4.106 20 0 EIADHM CCC[C@@H]1C[C@H]1C(=O)O[C@H](C)c1nc(=O)c2c(C)c(C)sc2[n-]1 ZINC000812637320 1049534268 /nfs/dbraw/zinc/53/42/68/1049534268.db2.gz BQXZAQLCXLYLIG-YUSALJHKSA-N -1 3 334.441 4.054 20 0 EIADHM C[C@H](CC(=O)Nc1cc(Cl)ccc1[O-])C(=O)c1cccc(F)c1 ZINC000080655150 1049594324 /nfs/dbraw/zinc/59/43/24/1049594324.db2.gz GYNFPNQPHJRNDB-SNVBAGLBSA-N -1 3 335.762 4.032 20 0 EIADHM Cc1cc(-n2c(C)cc(C(=O)Nc3ccc(Cl)cc3[O-])c2C)no1 ZINC000179639043 1049701929 /nfs/dbraw/zinc/70/19/29/1049701929.db2.gz GEZUZORKLKBXIS-UHFFFAOYSA-N -1 3 345.786 4.002 20 0 EIADHM CC(=O)c1cc(Cl)cc(CNC2(c3ccccc3F)CC2)c1[O-] ZINC000179651170 1049705186 /nfs/dbraw/zinc/70/51/86/1049705186.db2.gz QHCKAFZXWIPPKA-UHFFFAOYSA-N -1 3 333.790 4.166 20 0 EIADHM COc1ccc([O-])c(C(=O)Nc2cccc(C3SCCS3)c2)c1 ZINC000822048036 1049726696 /nfs/dbraw/zinc/72/66/96/1049726696.db2.gz OQSFDKOLTDOOIC-UHFFFAOYSA-N -1 3 347.461 4.132 20 0 EIADHM Cc1ccc(C(=O)Nc2nnc(-c3cccc(Cl)c3)s2)c([O-])c1 ZINC001136578829 1049757271 /nfs/dbraw/zinc/75/72/71/1049757271.db2.gz ZDGNFAPVKBFQOX-UHFFFAOYSA-N -1 3 345.811 4.125 20 0 EIADHM CSc1ccc([O-])c(C(=O)N2CC3(CCC3)[C@@H]2c2ccco2)c1 ZINC000615995647 1049829616 /nfs/dbraw/zinc/82/96/16/1049829616.db2.gz YXPOFIDWVGWCPV-INIZCTEOSA-N -1 3 329.421 4.075 20 0 EIADHM O=C(Nc1cc(Br)ccc1[O-])c1cccc(F)c1Cl ZINC000085590929 1050036950 /nfs/dbraw/zinc/03/69/50/1050036950.db2.gz CJNMIIWMQNAVRN-UHFFFAOYSA-N -1 3 344.567 4.200 20 0 EIADHM O=C([N-]c1c2nsnc2ccc1Cl)c1cc2cc(F)ccc2o1 ZINC000181237624 1050063851 /nfs/dbraw/zinc/06/38/51/1050063851.db2.gz KBPNZWBJELFCAB-UHFFFAOYSA-N -1 3 347.758 4.482 20 0 EIADHM CCOc1cc(/C=C(\C#N)C(=O)c2ccc(Cl)s2)ccc1[O-] ZINC000181303546 1050095268 /nfs/dbraw/zinc/09/52/68/1050095268.db2.gz PUGIWSINOQRJGU-YRNVUSSQSA-N -1 3 333.796 4.296 20 0 EIADHM CCc1onc(C)c1[N-]C(=O)c1csc(-c2ccccc2C)n1 ZINC000089408672 1050117020 /nfs/dbraw/zinc/11/70/20/1050117020.db2.gz ZUXCPDMKLWWMMY-UHFFFAOYSA-N -1 3 327.409 4.230 20 0 EIADHM COc1ccc([C@H](C)NC(=O)c2cc([O-])c3ccccc3c2)cc1C ZINC001177325995 1050192352 /nfs/dbraw/zinc/19/23/52/1050192352.db2.gz ATEBIDDVGIFCSO-AWEZNQCLSA-N -1 3 335.403 4.353 20 0 EIADHM Cc1ccc(NC(=O)Nc2c(F)cc(F)cc2F)c(Cl)c1[O-] ZINC001186060141 1050231114 /nfs/dbraw/zinc/23/11/14/1050231114.db2.gz VSYBWRPQMICVNI-UHFFFAOYSA-N -1 3 330.693 4.415 20 0 EIADHM Cc1c2cc(F)ccc2oc1S(=O)(=O)[N-]C(C)(C)c1ccccc1 ZINC001186141867 1050245495 /nfs/dbraw/zinc/24/54/95/1050245495.db2.gz UWKQKYYMJLBMAK-UHFFFAOYSA-N -1 3 347.411 4.094 20 0 EIADHM CCc1nc(C)c([C@H](C)N(C)C(=O)c2cc(CC)ccc2[O-])s1 ZINC000091735877 1050278178 /nfs/dbraw/zinc/27/81/78/1050278178.db2.gz DHILRSYHUJEITF-LBPRGKRZSA-N -1 3 332.469 4.115 20 0 EIADHM C[C@@H](NC(=O)Nc1c([O-])cccc1Br)C1CCCCC1 ZINC001186343896 1050304424 /nfs/dbraw/zinc/30/44/24/1050304424.db2.gz ZLZRAWUGWPGNGY-SNVBAGLBSA-N -1 3 341.249 4.245 20 0 EIADHM Cc1sc2[n-]c([C@H](C)OC(=O)[C@H]3C[C@@]3(C)C(C)C)nc(=O)c2c1C ZINC000775071706 1050463712 /nfs/dbraw/zinc/46/37/12/1050463712.db2.gz KDUHINWYHXEKLD-NMOXLHADSA-N -1 3 348.468 4.300 20 0 EIADHM CCOC(=O)c1ccc(NC(=O)Nc2ccc(C)c([O-])c2Cl)cc1 ZINC001187282559 1050515488 /nfs/dbraw/zinc/51/54/88/1050515488.db2.gz KDPOEJXLLUAADA-UHFFFAOYSA-N -1 3 348.786 4.175 20 0 EIADHM O=C(Nc1ccc([O-])c(Br)c1)Nc1cc(F)cc(F)c1 ZINC001187570274 1050576044 /nfs/dbraw/zinc/57/60/44/1050576044.db2.gz MAMHMIIIDXKHBV-UHFFFAOYSA-N -1 3 343.127 4.077 20 0 EIADHM COc1cccc(OC)c1Nc1cc(Br)cc(F)c1[O-] ZINC001173922593 1050632478 /nfs/dbraw/zinc/63/24/78/1050632478.db2.gz DHALKZVPFBRPBD-UHFFFAOYSA-N -1 3 342.164 4.055 20 0 EIADHM COc1ccc(F)cc1Nc1cc(Br)cc(F)c1[O-] ZINC001173957516 1050644955 /nfs/dbraw/zinc/64/49/55/1050644955.db2.gz MZIWFNRDQPPDRP-UHFFFAOYSA-N -1 3 330.128 4.185 20 0 EIADHM Cc1ccc(NC(=O)Nc2ccc(Br)cc2[O-])cc1F ZINC001187986257 1050663578 /nfs/dbraw/zinc/66/35/78/1050663578.db2.gz YZWWREPJPGXVAI-UHFFFAOYSA-N -1 3 339.164 4.246 20 0 EIADHM Cc1cccc(S(=O)(=O)[N-]c2ccc(N3CCCCCC3)cc2)c1 ZINC000243386142 1050679079 /nfs/dbraw/zinc/67/90/79/1050679079.db2.gz MJLWLWMEMVSSIC-UHFFFAOYSA-N -1 3 344.480 4.176 20 0 EIADHM O=C(/C=C\c1ccc(Br)s1)Nc1cccc([O-])c1F ZINC000254957912 1050799458 /nfs/dbraw/zinc/79/94/58/1050799458.db2.gz WAQAAKSWQWNNEF-ALCCZGGFSA-N -1 3 342.189 4.007 20 0 EIADHM Cc1cccc([O-])c1C(=O)Nc1cccc2c(Br)c[nH]c21 ZINC001188654681 1050814273 /nfs/dbraw/zinc/81/42/73/1050814273.db2.gz FPPAOWRBEBTJPV-UHFFFAOYSA-N -1 3 345.196 4.197 20 0 EIADHM O=C(c1cccc(Nc2ccc([O-])c(F)c2F)c1)N1CCCCC1 ZINC001174173687 1050815307 /nfs/dbraw/zinc/81/53/07/1050815307.db2.gz MGBXZZZSOFACJT-UHFFFAOYSA-N -1 3 332.350 4.040 20 0 EIADHM O=c1cc(Nc2cccc(N3CCCCC3)c2)[n-]n1-c1ccccc1 ZINC001174301761 1050869422 /nfs/dbraw/zinc/86/94/22/1050869422.db2.gz IJOIFXWCWJDBHE-UHFFFAOYSA-N -1 3 334.423 4.312 20 0 EIADHM Cc1ccc([O-])c(NC(=O)Nc2c(Cl)cccc2C(F)(F)F)n1 ZINC001189446868 1050994164 /nfs/dbraw/zinc/99/41/64/1050994164.db2.gz DDDXTDTWIKSXNF-UHFFFAOYSA-N -1 3 345.708 4.412 20 0 EIADHM CC(=O)c1cccc([O-])c1NC(=O)COc1cc(C)ccc1C(C)C ZINC001180511509 1051011277 /nfs/dbraw/zinc/01/12/77/1051011277.db2.gz CELNIYUUHCTGPG-UHFFFAOYSA-N -1 3 341.407 4.044 20 0 EIADHM CC(C)(C)c1cccc([N-]S(=O)(=O)/C=C\c2ccc(F)cc2)c1O ZINC000775295670 1051041389 /nfs/dbraw/zinc/04/13/89/1051041389.db2.gz OSEPYRYRKQMJRT-QXMHVHEDSA-N -1 3 349.427 4.241 20 0 EIADHM Cc1n[nH]c(C)c1-c1ccccc1C(=O)Nc1cc([O-])cc(Cl)c1 ZINC001190165100 1051129738 /nfs/dbraw/zinc/12/97/38/1051129738.db2.gz CAXNGCJFVXVQKT-UHFFFAOYSA-N -1 3 341.798 4.305 20 0 EIADHM COc1c(F)ccc(F)c1Nc1cccc([O-])c1Br ZINC001174664284 1051132578 /nfs/dbraw/zinc/13/25/78/1051132578.db2.gz GOLLAJGIXSXLMS-UHFFFAOYSA-N -1 3 330.128 4.185 20 0 EIADHM Cc1noc(-c2ccccc2)c1NC(=O)Nc1ncc([O-])cc1Cl ZINC001190343105 1051158452 /nfs/dbraw/zinc/15/84/52/1051158452.db2.gz LZFQSNPHUOHXGT-UHFFFAOYSA-N -1 3 344.758 4.048 20 0 EIADHM CCCCCc1ccc([N-]S(=O)(=O)c2cc(N)ccc2C)cc1 ZINC001175012985 1051294835 /nfs/dbraw/zinc/29/48/35/1051294835.db2.gz GTJSWGBRAKZQDI-UHFFFAOYSA-N -1 3 332.469 4.111 20 0 EIADHM [O-]C(=NO[C@@H]1CCCCO1)Nc1ccc2oc3ccccc3c2c1 ZINC000775423050 1051309564 /nfs/dbraw/zinc/30/95/64/1051309564.db2.gz RWWFHCVZKOCASC-QGZVFWFLSA-N -1 3 326.352 4.166 20 0 EIADHM O=C([N-]O[C@@H]1CCCCO1)Nc1ccc2oc3ccccc3c2c1 ZINC000775423050 1051309576 /nfs/dbraw/zinc/30/95/76/1051309576.db2.gz RWWFHCVZKOCASC-QGZVFWFLSA-N -1 3 326.352 4.166 20 0 EIADHM O=C(Nc1ccc(F)c([O-])c1)[C@H](Cc1ccccc1)c1ccccc1 ZINC001181830517 1051325108 /nfs/dbraw/zinc/32/51/08/1051325108.db2.gz RCTDDSPESBLOLD-GOSISDBHSA-N -1 3 335.378 4.496 20 0 EIADHM Cc1cc(S(=O)(=O)[N-]CC(C)(C)C2=CCCC2)sc1Cl ZINC001191065667 1051337819 /nfs/dbraw/zinc/33/78/19/1051337819.db2.gz TXUSZRWRMFBJKN-UHFFFAOYSA-N -1 3 333.906 4.125 20 0 EIADHM CC(=O)Nc1ccc(Nc2c(F)cc([O-])cc2F)cc1C(F)(F)F ZINC001175099688 1051345365 /nfs/dbraw/zinc/34/53/65/1051345365.db2.gz FFGMFABDOWJLRP-UHFFFAOYSA-N -1 3 346.255 4.391 20 0 EIADHM [O-]c1cc(F)c(Nc2cccc(F)c2OC[C@@H]2CCCO2)c(F)c1 ZINC001175102110 1051349673 /nfs/dbraw/zinc/34/96/73/1051349673.db2.gz FBOUGPRMNQPSED-NSHDSACASA-N -1 3 339.313 4.111 20 0 EIADHM CCOC(=O)c1cc(Nc2c(F)cc([O-])cc2F)ccc1Cl ZINC001175096892 1051380897 /nfs/dbraw/zinc/38/08/97/1051380897.db2.gz LDHVJMCOHKEDTP-UHFFFAOYSA-N -1 3 327.714 4.244 20 0 EIADHM C[C@@H](NC(=O)NCc1ccc([O-])c(F)c1)c1cccc2ccccc21 ZINC000155354835 1051410266 /nfs/dbraw/zinc/41/02/66/1051410266.db2.gz HUSJDVHHIPYWMM-CYBMUJFWSA-N -1 3 338.382 4.245 20 0 EIADHM CCOc1cccc(Nc2cccc([O-])c2Br)c1F ZINC001175240733 1051467231 /nfs/dbraw/zinc/46/72/31/1051467231.db2.gz MGKVRRDVYKYJRC-UHFFFAOYSA-N -1 3 326.165 4.436 20 0 EIADHM CCc1ncc(Br)cc1Nc1c(F)ccc([O-])c1F ZINC001175266341 1051504441 /nfs/dbraw/zinc/50/44/41/1051504441.db2.gz UUSSSSBUWPUMFQ-UHFFFAOYSA-N -1 3 329.144 4.134 20 0 EIADHM CC(C)(C)OC(=O)Nc1ccc(Nc2c(F)ccc([O-])c2F)cn1 ZINC001175263642 1051501866 /nfs/dbraw/zinc/50/18/66/1051501866.db2.gz OCXMIPSEDHVBKM-UHFFFAOYSA-N -1 3 337.326 4.156 20 0 EIADHM COc1cccc(Br)c1Nc1c(F)ccc([O-])c1F ZINC001175269492 1051506251 /nfs/dbraw/zinc/50/62/51/1051506251.db2.gz GRFASSDFBVVGIA-UHFFFAOYSA-N -1 3 330.128 4.185 20 0 EIADHM [O-]c1ccc(F)c(Nc2ccc(OC3CCOCC3)c(F)c2)c1F ZINC001175269732 1051507652 /nfs/dbraw/zinc/50/76/52/1051507652.db2.gz JZXPKZNNYWPYLG-UHFFFAOYSA-N -1 3 339.313 4.111 20 0 EIADHM Cc1ccc(-c2ccsc2C(=O)[N-]N2Cc3ccccc3C2=O)cc1 ZINC000183868626 1051572397 /nfs/dbraw/zinc/57/23/97/1051572397.db2.gz XAXXUHYXNYHJKB-UHFFFAOYSA-N -1 3 348.427 4.024 20 0 EIADHM Cc1c(F)cc([N-]S(=O)(=O)Cc2ccc(Cl)cc2F)cc1F ZINC001191904087 1051582891 /nfs/dbraw/zinc/58/28/91/1051582891.db2.gz OJELHJVZPZVDFR-UHFFFAOYSA-N -1 3 349.761 4.008 20 0 EIADHM O=C(Nc1ccc(F)c([O-])c1)Nc1ccc(OC(F)F)c(Cl)c1 ZINC001192320039 1051689116 /nfs/dbraw/zinc/68/91/16/1051689116.db2.gz IWFXCZXDINLBKH-UHFFFAOYSA-N -1 3 346.692 4.430 20 0 EIADHM CC(C)c1ccc(C(=O)N2CC3(CCC3)[C@@H]2c2ccncc2)c([O-])c1 ZINC000621170819 1051725280 /nfs/dbraw/zinc/72/52/80/1051725280.db2.gz BPHCACPANJWPRU-IBGZPJMESA-N -1 3 336.435 4.278 20 0 EIADHM COC(=O)c1cccc([O-])c1NC(=O)Nc1ccc2sccc2c1 ZINC001192455263 1051739361 /nfs/dbraw/zinc/73/93/61/1051739361.db2.gz PDOMKJSOQSQKEN-UHFFFAOYSA-N -1 3 342.376 4.038 20 0 EIADHM CCN(Cc1ccc(C)cc1)Cc1nc2c3ccccc3oc2c(=O)[n-]1 ZINC000621285502 1051820812 /nfs/dbraw/zinc/82/08/12/1051820812.db2.gz YVBHYXOPTKHPTP-UHFFFAOYSA-N -1 3 347.418 4.412 20 0 EIADHM CCN(CC)C(=O)c1ccc(F)c(Nc2cccc(Cl)c2[O-])c1 ZINC001176069271 1051905331 /nfs/dbraw/zinc/90/53/31/1051905331.db2.gz NSGNQZHMHDFVPO-UHFFFAOYSA-N -1 3 336.794 4.410 20 0 EIADHM CCOc1cc(CNc2ccc(OC)nc2CC)cc(Cl)c1[O-] ZINC001184116220 1051956079 /nfs/dbraw/zinc/95/60/79/1051956079.db2.gz UFNOFKXERAFKQK-UHFFFAOYSA-N -1 3 336.819 4.022 20 0 EIADHM COc1ccc([O-])c(-c2nc(C3(c4ccc(F)cc4)CCC3)no2)c1 ZINC000621810096 1051969969 /nfs/dbraw/zinc/96/99/69/1051969969.db2.gz WLMHDPSCWHLGID-UHFFFAOYSA-N -1 3 340.354 4.060 20 0 EIADHM O=C(Nc1ccc(-n2cccc2)cc1)c1ccc([O-])cc1C(F)(F)F ZINC001193733692 1051977787 /nfs/dbraw/zinc/97/77/87/1051977787.db2.gz MDHQYKNXGAKJQM-UHFFFAOYSA-N -1 3 346.308 4.454 20 0 EIADHM CCN(C(=O)c1cc([O-])cc(C(F)(F)F)c1)[C@@H](C)c1cccnc1 ZINC000621871026 1051987213 /nfs/dbraw/zinc/98/72/13/1051987213.db2.gz ZJKIYUNZDXRPIJ-NSHDSACASA-N -1 3 338.329 4.029 20 0 EIADHM C[C@@H]1C[C@@H](NC(=O)c2ccc([O-])cc2C(F)(F)F)CC(C)(C)C1 ZINC001193757982 1051990684 /nfs/dbraw/zinc/99/06/84/1051990684.db2.gz IXOYMCTULRMJMU-GHMZBOCLSA-N -1 3 329.362 4.356 20 0 EIADHM C[C@H]1C[C@@H](NC(=O)c2ccc([O-])cc2C(F)(F)F)CC(C)(C)C1 ZINC001193758022 1051991406 /nfs/dbraw/zinc/99/14/06/1051991406.db2.gz IXOYMCTULRMJMU-WDEREUQCSA-N -1 3 329.362 4.356 20 0 EIADHM CC(=O)OCc1cccc(Cl)c1[N-]c1nc2ccc(F)cc2o1 ZINC001212774275 1051991969 /nfs/dbraw/zinc/99/19/69/1051991969.db2.gz KRNWPEQBNCXVAL-UHFFFAOYSA-N -1 3 334.734 4.427 20 0 EIADHM C[C@H](CCCC(F)(F)F)NC(=O)c1cc([O-])cc(C(F)(F)F)c1 ZINC000621973091 1052058529 /nfs/dbraw/zinc/05/85/29/1052058529.db2.gz BHKSZFQJQIHOCO-MRVPVSSYSA-N -1 3 343.267 4.262 20 0 EIADHM Cc1noc(C)c1NC(=O)[N-]c1cc(-c2ccccc2Cl)no1 ZINC001185136594 1052183361 /nfs/dbraw/zinc/18/33/61/1052183361.db2.gz WOXNRXGKJASLMO-UHFFFAOYSA-N -1 3 332.747 4.244 20 0 EIADHM O=C(Nc1ccccc1OC(F)F)c1cc([O-])cc(C(F)(F)F)c1 ZINC000622289774 1052184961 /nfs/dbraw/zinc/18/49/61/1052184961.db2.gz FIHIMDJXMQCELN-UHFFFAOYSA-N -1 3 347.239 4.265 20 0 EIADHM CCc1cccc(C(=O)N2CCC(Cc3cccc(F)c3)CC2)c1[O-] ZINC000622313453 1052202307 /nfs/dbraw/zinc/20/23/07/1052202307.db2.gz NVNIVYWJNWLGLY-UHFFFAOYSA-N -1 3 341.426 4.189 20 0 EIADHM CC(C)(C)[C@@H]1CCCC[C@H]1[N-]S(=O)(=O)c1cc(F)ccc1Cl ZINC001185319354 1052208469 /nfs/dbraw/zinc/20/84/69/1052208469.db2.gz XRMBTNFIEQJBNF-TZMCWYRMSA-N -1 3 347.883 4.362 20 0 EIADHM CCc1cccc(C(=O)N2CCC(Cc3ccc(F)cc3)CC2)c1[O-] ZINC000622343190 1052208547 /nfs/dbraw/zinc/20/85/47/1052208547.db2.gz UBVSKXGDHIAWCB-UHFFFAOYSA-N -1 3 341.426 4.189 20 0 EIADHM C[C@@H](CN(C)C(=O)c1cc([O-])cc(C(F)(F)F)c1)c1ccccc1 ZINC000622349043 1052221631 /nfs/dbraw/zinc/22/16/31/1052221631.db2.gz JJJKODSIWOOVBP-LBPRGKRZSA-N -1 3 337.341 4.287 20 0 EIADHM CCc1ccc(C(=O)N(C)[C@@H](Cc2ccc(F)cc2)C(C)C)c([O-])c1 ZINC000622402426 1052246465 /nfs/dbraw/zinc/24/64/65/1052246465.db2.gz WOUKUQBGKBHXHU-IBGZPJMESA-N -1 3 343.442 4.433 20 0 EIADHM O=S(=O)([N-]C[C@H]1CCCC(F)(F)C1)c1cc2ccccc2s1 ZINC001185486243 1052251084 /nfs/dbraw/zinc/25/10/84/1052251084.db2.gz NPZGCQKBTBLESP-NSHDSACASA-N -1 3 345.436 4.005 20 0 EIADHM CCOc1ccccc1N(C)C(=O)c1cc([O-])cc(C(F)(F)F)c1 ZINC000622463818 1052290985 /nfs/dbraw/zinc/29/09/85/1052290985.db2.gz OWQUOLHCINSZOX-UHFFFAOYSA-N -1 3 339.313 4.086 20 0 EIADHM COc1cc(NC(=O)c2cc([O-])cc(C(F)(F)F)c2)c(C)cc1C ZINC000622576102 1052341345 /nfs/dbraw/zinc/34/13/45/1052341345.db2.gz OOYJBPBXQJAQFV-UHFFFAOYSA-N -1 3 339.313 4.289 20 0 EIADHM O=C(Nc1cc(F)ccc1[O-])c1ccc(COc2ccc(F)cc2)o1 ZINC000174890851 1052576768 /nfs/dbraw/zinc/57/67/68/1052576768.db2.gz WMLVLKRQOYYGOZ-UHFFFAOYSA-N -1 3 345.301 4.095 20 0 EIADHM O=C(Nc1cc(F)ccc1[O-])c1cnc(-c2ccccc2F)s1 ZINC000174878003 1052577052 /nfs/dbraw/zinc/57/70/52/1052577052.db2.gz PEPSYXAHWMNNLL-UHFFFAOYSA-N -1 3 332.331 4.046 20 0 EIADHM O=C(Nc1ccc(Nc2ccccc2)cc1)c1cc(F)cc2n[n-]nc21 ZINC000764101425 1053029794 /nfs/dbraw/zinc/02/97/94/1053029794.db2.gz ODHLVESXFVIGCT-UHFFFAOYSA-N -1 3 347.353 4.093 20 0 EIADHM CCCCC[C@@H](NC(=O)c1cc(OC)c([O-])c(OC)c1)C(C)(C)C ZINC000764276594 1053050757 /nfs/dbraw/zinc/05/07/57/1053050757.db2.gz STRQXSWTOZPXEY-MRXNPFEDSA-N -1 3 337.460 4.134 20 0 EIADHM Cc1sc2[n-]c([C@H](C)OC(=O)[C@H]3CCC3(C)C)nc(=O)c2c1C ZINC000850070677 1053066527 /nfs/dbraw/zinc/06/65/27/1053066527.db2.gz ULQFRVMPGDXJMB-GXSJLCMTSA-N -1 3 334.441 4.054 20 0 EIADHM CC(C)N(C)c1ccc(NC(=O)c2cc([O-])ccc2Cl)cc1F ZINC000764402569 1053092159 /nfs/dbraw/zinc/09/21/59/1053092159.db2.gz PAMIQIGDDPKHTN-UHFFFAOYSA-N -1 3 336.794 4.282 20 0 EIADHM Cc1c([O-])ccc2c(CN(c3ccccc3)[C@H]3C[C@H]3C)cc(=O)oc12 ZINC001195045415 1053240478 /nfs/dbraw/zinc/24/04/78/1053240478.db2.gz IZVCKGQAAZNPIO-ACJLOTCBSA-N -1 3 335.403 4.222 20 0 EIADHM CC(C)N(CCc1nccs1)C(=O)c1cc([O-])c2ccccc2c1 ZINC000350668733 1053425471 /nfs/dbraw/zinc/42/54/71/1053425471.db2.gz JDIXGCULYPRVPB-UHFFFAOYSA-N -1 3 340.448 4.095 20 0 EIADHM Cc1coc(C(=O)[N-]c2sc(C)c(C)c2C(=O)c2ccccc2)n1 ZINC001195751208 1053481987 /nfs/dbraw/zinc/48/19/87/1053481987.db2.gz CNUYUORDKPFXBX-UHFFFAOYSA-N -1 3 340.404 4.145 20 0 EIADHM O=C([N-]c1csc(-c2ccncc2)n1)c1ocnc1-c1ccccc1 ZINC001127856437 1053531668 /nfs/dbraw/zinc/53/16/68/1053531668.db2.gz KJHGYRKOVLEUBJ-UHFFFAOYSA-N -1 3 348.387 4.112 20 0 EIADHM CC(=O)c1c(F)cccc1[N-]C(=O)c1snc(Cl)c1Cl ZINC001196341351 1053645163 /nfs/dbraw/zinc/64/51/63/1053645163.db2.gz DHRDEMQUJXBYMO-UHFFFAOYSA-N -1 3 333.171 4.044 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N1CCC[C@@H]1Cc1ccccc1 ZINC000471618469 1053670211 /nfs/dbraw/zinc/67/02/11/1053670211.db2.gz BBDJCRRRYNPPCF-LJQANCHMSA-N -1 3 331.415 4.393 20 0 EIADHM CN(Cc1nc2ccccc2s1)C(=O)c1cc([O-])c2ccccc2c1 ZINC000471641728 1053677533 /nfs/dbraw/zinc/67/75/33/1053677533.db2.gz IASYKKVKCKWJKH-UHFFFAOYSA-N -1 3 348.427 4.427 20 0 EIADHM O=C(Nc1ccc(-c2csnn2)cc1)c1cc([O-])c2ccccc2c1 ZINC000471782549 1053721550 /nfs/dbraw/zinc/72/15/50/1053721550.db2.gz ULQJXSOIIFXIML-UHFFFAOYSA-N -1 3 347.399 4.316 20 0 EIADHM CCOc1cc(F)ccc1NC(=O)c1cc([O-])c2ccccc2c1 ZINC000471779004 1053723307 /nfs/dbraw/zinc/72/33/07/1053723307.db2.gz HPWBNFMTUMLJHV-UHFFFAOYSA-N -1 3 325.339 4.336 20 0 EIADHM Cc1c2cc(F)ccc2oc1C(=O)[N-]c1nnc(CC(C)C)s1 ZINC000020675784 1053726056 /nfs/dbraw/zinc/72/60/56/1053726056.db2.gz UOOXVVFZTYGFKG-UHFFFAOYSA-N -1 3 333.388 4.183 20 0 EIADHM O=C(Nc1cc([O-])cc(Cl)c1)c1ccc(-c2cccs2)nc1 ZINC001196786292 1053755172 /nfs/dbraw/zinc/75/51/72/1053755172.db2.gz NBXAQKSVQFAHHA-UHFFFAOYSA-N -1 3 330.796 4.421 20 0 EIADHM COc1ccc2cc(CN(C)C(=O)c3ccc(C)cc3[O-])ccc2c1 ZINC000023954922 1053789354 /nfs/dbraw/zinc/78/93/54/1053789354.db2.gz WYZXRZDFDDSQRO-UHFFFAOYSA-N -1 3 335.403 4.135 20 0 EIADHM CCOc1ccc(F)c([N-]C(=O)c2c(F)ccc(C)c2F)c1F ZINC000499363705 1053890349 /nfs/dbraw/zinc/89/03/49/1053890349.db2.gz OYJKIKRYGXGJAS-UHFFFAOYSA-N -1 3 327.277 4.202 20 0 EIADHM C[C@@H](CN(C)Cc1ccc(C(=O)[O-])cc1Br)C(C)(C)C ZINC000399375055 1053895324 /nfs/dbraw/zinc/89/53/24/1053895324.db2.gz GLNFCLFJVVXGNS-NSHDSACASA-N -1 3 342.277 4.261 20 0 EIADHM Cc1ccc(F)c([N-]S(=O)(=O)Cc2cc(Cl)ccc2Cl)c1 ZINC001197529437 1053924011 /nfs/dbraw/zinc/92/40/11/1053924011.db2.gz LYDCASORWKGKSX-UHFFFAOYSA-N -1 3 348.226 4.383 20 0 EIADHM Cc1ccc2cccc([N-]S(=O)(=O)Cc3c(F)cccc3F)c2c1 ZINC001197603526 1053954125 /nfs/dbraw/zinc/95/41/25/1053954125.db2.gz SRWNIYRBFFINCY-UHFFFAOYSA-N -1 3 347.386 4.368 20 0 EIADHM O=S(=O)(Cc1c(F)cccc1F)[N-]c1ccc2sccc2c1 ZINC001197603535 1053954289 /nfs/dbraw/zinc/95/42/89/1053954289.db2.gz SWSFIAFMAQTIIT-UHFFFAOYSA-N -1 3 339.388 4.121 20 0 EIADHM [O-]c1ccc(NC(=S)Nc2ccccc2Br)cc1F ZINC001197784544 1053995066 /nfs/dbraw/zinc/99/50/66/1053995066.db2.gz XVADWQPJMNATMQ-UHFFFAOYSA-N -1 3 341.205 4.103 20 0 EIADHM O=C(N[C@@H]1CCCOc2ccccc21)c1cc([O-])c2ccccc2c1 ZINC000471959298 1054203608 /nfs/dbraw/zinc/20/36/08/1054203608.db2.gz TZTUKEDFWSFWLU-GOSISDBHSA-N -1 3 333.387 4.189 20 0 EIADHM Cn1cccc1[C@H]1CCCCN1C(=O)c1cc([O-])c2ccccc2c1 ZINC000472248114 1054251609 /nfs/dbraw/zinc/25/16/09/1054251609.db2.gz AKOHBMRKERDTDD-LJQANCHMSA-N -1 3 334.419 4.251 20 0 EIADHM CON(CC(C)(C)C)C(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000857503363 1054284334 /nfs/dbraw/zinc/28/43/34/1054284334.db2.gz DTYYMHBDTNRFBG-UHFFFAOYSA-N -1 3 327.424 4.033 20 0 EIADHM O=C(N[C@@H]1[C@H]2CCc3ccccc3[C@@H]12)c1cc([O-])c2ccccc2c1 ZINC000472345806 1054287637 /nfs/dbraw/zinc/28/76/37/1054287637.db2.gz FTBYJRFVEVAOOJ-CEWLAPEOSA-N -1 3 329.399 4.004 20 0 EIADHM Cc1cc(C[N-]C(=O)C(F)(F)c2cccc(Cl)c2Cl)ccn1 ZINC000857518639 1054295079 /nfs/dbraw/zinc/29/50/79/1054295079.db2.gz KMBNJGLCVFDFMJ-UHFFFAOYSA-N -1 3 345.176 4.105 20 0 EIADHM COc1ccc(S(=O)(=O)[N-]c2ccccc2CC(C)C)c(C)c1 ZINC001198943580 1054306484 /nfs/dbraw/zinc/30/64/84/1054306484.db2.gz KSSXCGSDWVCTKG-UHFFFAOYSA-N -1 3 333.453 4.003 20 0 EIADHM C[C@@H](NCc1ccc(OCC(F)(F)F)cc1)c1cccc([O-])c1F ZINC000872018912 1054335794 /nfs/dbraw/zinc/33/57/94/1054335794.db2.gz QYWHTQODAFYRTQ-LLVKDONJSA-N -1 3 343.320 4.323 20 0 EIADHM O=C(OCc1csc(-c2ccoc2)n1)c1cccc(Cl)c1[O-] ZINC000775929136 1054337265 /nfs/dbraw/zinc/33/72/65/1054337265.db2.gz JDVYVKKGGWRKPP-UHFFFAOYSA-N -1 3 335.768 4.119 20 0 EIADHM CCCOc1ccc(CN[C@H](C)c2cccc([O-])c2F)cc1OC ZINC000872022440 1054338151 /nfs/dbraw/zinc/33/81/51/1054338151.db2.gz WVCWEGAFLBCHHR-CYBMUJFWSA-N -1 3 333.403 4.180 20 0 EIADHM C[C@@H](N[C@@H]1CCc2ccccc2-n2ccnc21)c1cccc([O-])c1F ZINC000872089008 1054384330 /nfs/dbraw/zinc/38/43/30/1054384330.db2.gz XRKKZVRAUFYCKV-CZUORRHYSA-N -1 3 337.398 4.055 20 0 EIADHM CC(C)c1ccc(C(=O)NC[C@@H]2SCCc3ccccc32)c([O-])c1 ZINC001137057024 1054388039 /nfs/dbraw/zinc/38/80/39/1054388039.db2.gz NRIFCCSUVWXJCW-IBGZPJMESA-N -1 3 341.476 4.276 20 0 EIADHM [O-]c1cccc(C(F)(F)F)c1NC(=S)NC1CCCCCC1 ZINC001199972342 1054509126 /nfs/dbraw/zinc/50/91/26/1054509126.db2.gz ZSUWXQGWIDPMCH-UHFFFAOYSA-N -1 3 332.391 4.420 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1ccc(F)cc1Br ZINC000060372602 1054679095 /nfs/dbraw/zinc/67/90/95/1054679095.db2.gz GWRLTLRFAGGGLH-UHFFFAOYSA-N -1 3 344.567 4.200 20 0 EIADHM CCC(CC)c1nnc([N-]C(=O)c2csc(CC(C)C)n2)s1 ZINC000063570508 1054816885 /nfs/dbraw/zinc/81/68/85/1054816885.db2.gz SQDPXDUYVCNMIH-UHFFFAOYSA-N -1 3 338.502 4.349 20 0 EIADHM CC1(C)CC[C@@H](NC(=O)c2cc(=O)c3ccccc3[n-]2)c2ccccc21 ZINC000063712797 1054827181 /nfs/dbraw/zinc/82/71/81/1054827181.db2.gz IAFIHLCOJIUUGE-GOSISDBHSA-N -1 3 346.430 4.071 20 0 EIADHM Cc1c(C)c(C)c(S(=O)(=O)[N-]c2ccc([C@@H](C)O)cc2)c(C)c1C ZINC001201799923 1054910068 /nfs/dbraw/zinc/91/00/68/1054910068.db2.gz UXFUHFPWOJMCPO-MRXNPFEDSA-N -1 3 347.480 4.083 20 0 EIADHM C[C@@H](OC(=O)c1cc(Cl)c(Cl)[n-]1)C(=O)c1ccc(Cl)cc1 ZINC000021730686 1054935342 /nfs/dbraw/zinc/93/53/42/1054935342.db2.gz WTTQUYNPVXTFIR-SSDOTTSWSA-N -1 3 346.597 4.403 20 0 EIADHM Cc1oc(-c2cccs2)nc1CC(=O)Nc1cc(Cl)ccc1[O-] ZINC000067139050 1055027845 /nfs/dbraw/zinc/02/78/45/1055027845.db2.gz NKDSQIPBZVFHKE-UHFFFAOYSA-N -1 3 348.811 4.252 20 0 EIADHM CC(=O)c1cccc(NC(=O)Nc2ccccc2C(F)(F)F)c1[O-] ZINC001202164286 1055064491 /nfs/dbraw/zinc/06/44/91/1055064491.db2.gz IBNLREVQNBUZPW-UHFFFAOYSA-N -1 3 338.285 4.258 20 0 EIADHM Cc1cc([O-])c(NC(=O)Nc2cccc(F)c2)cc1Br ZINC001202230465 1055107009 /nfs/dbraw/zinc/10/70/09/1055107009.db2.gz YPQFQFFYRNTWDN-UHFFFAOYSA-N -1 3 339.164 4.246 20 0 EIADHM O=C([N-]c1cc(C(F)(F)F)no1)Nc1cccc(C(F)(F)F)c1 ZINC001202290753 1055126123 /nfs/dbraw/zinc/12/61/23/1055126123.db2.gz YFNLOSNHJHATKC-UHFFFAOYSA-N -1 3 339.195 4.356 20 0 EIADHM Cc1cc(Br)oc1C(=O)[N-]c1c(F)cc(F)cc1F ZINC000072506866 1055134720 /nfs/dbraw/zinc/13/47/20/1055134720.db2.gz CBDMISAVZANYTB-UHFFFAOYSA-N -1 3 334.091 4.020 20 0 EIADHM Cc1ccc(NC(=O)Nc2ccc(C(=O)OC(C)(C)C)cc2[O-])cc1 ZINC001202434467 1055173385 /nfs/dbraw/zinc/17/33/85/1055173385.db2.gz NSMCNRIAIVXHAD-UHFFFAOYSA-N -1 3 342.395 4.300 20 0 EIADHM C[C@H]1CCN(Cc2nnc(-c3ccccc3[O-])o2)[C@H](c2ccco2)C1 ZINC000878151861 1055195314 /nfs/dbraw/zinc/19/53/14/1055195314.db2.gz DOFZQVCPRYDKIA-ZFWWWQNUSA-N -1 3 339.395 4.008 20 0 EIADHM O=C(CCC1CCCCC1)[N-]OCc1cccnc1C(F)(F)F ZINC000863456973 1055207468 /nfs/dbraw/zinc/20/74/68/1055207468.db2.gz OYARMRGRURKRAI-UHFFFAOYSA-N -1 3 330.350 4.009 20 0 EIADHM CC(C)c1ccc(CN2CCC(c3ncc(C(=O)[O-])s3)CC2)cc1 ZINC000863473490 1055210574 /nfs/dbraw/zinc/21/05/74/1055210574.db2.gz PFBWOAAGOZQQDO-UHFFFAOYSA-N -1 3 344.480 4.344 20 0 EIADHM [O-]c1ccccc1-c1nnc(CN(CC2CCC2)c2ccccc2)o1 ZINC000878265476 1055225032 /nfs/dbraw/zinc/22/50/32/1055225032.db2.gz QVGMWAKQHDUECT-UHFFFAOYSA-N -1 3 335.407 4.249 20 0 EIADHM Cc1noc(C(F)(F)F)c1C(=O)[N-]c1nc(CC(C)(C)C)cs1 ZINC000776405614 1055268987 /nfs/dbraw/zinc/26/89/87/1055268987.db2.gz SULPUZFIUBPQSL-UHFFFAOYSA-N -1 3 347.362 4.299 20 0 EIADHM COCCOc1ccc(N[C@H](C)c2ccc(F)cc2[O-])cc1Cl ZINC000186286086 1055322543 /nfs/dbraw/zinc/32/25/43/1055322543.db2.gz ABXALSUDIIRDON-LLVKDONJSA-N -1 3 339.794 4.383 20 0 EIADHM Cc1ccc2c(c1)CN(Cc1nnc(-c3ccccc3[O-])o1)C(C)(C)C2 ZINC000878654574 1055367577 /nfs/dbraw/zinc/36/75/77/1055367577.db2.gz VWBDLXOITUVPNW-UHFFFAOYSA-N -1 3 349.434 4.088 20 0 EIADHM [O-]c1coc2cc(OCc3csc(-c4cccs4)n3)ccc12 ZINC000642608879 1055379621 /nfs/dbraw/zinc/37/96/21/1055379621.db2.gz RWHBTJFKEDHTGU-UHFFFAOYSA-N -1 3 329.402 4.026 20 0 EIADHM CC[C@H](NC(=O)c1cc([O-])c2ccccc2c1)c1nc(C)cs1 ZINC000354304368 1056415252 /nfs/dbraw/zinc/41/52/52/1056415252.db2.gz PYYJLGHZBFBVDY-HNNXBMFYSA-N -1 3 326.421 4.191 20 0 EIADHM CCOCCOc1c(Cl)cccc1NC(=O)c1c(C)cccc1[O-] ZINC000624775985 1056506366 /nfs/dbraw/zinc/50/63/66/1056506366.db2.gz VBQMSLXAJLQVJG-UHFFFAOYSA-N -1 3 349.814 4.022 20 0 EIADHM CCC(CC)c1cc(C[N-]c2nc(-c3cccc(OC)c3)no2)on1 ZINC000742414663 1058612510 /nfs/dbraw/zinc/61/25/10/1058612510.db2.gz AOYWMJCORKKNHY-UHFFFAOYSA-N -1 3 342.399 4.249 20 0 EIADHM Cc1cc(=O)[n-]c(-c2cccc(OC(=O)c3ccccc3Cl)c2)n1 ZINC000744217266 1059333870 /nfs/dbraw/zinc/33/38/70/1059333870.db2.gz PWIWCVYVEXOALA-UHFFFAOYSA-N -1 3 340.766 4.030 20 0 EIADHM CC(=CC(=O)Oc1cccc(-c2nc(C)cc(=O)[n-]2)c1)c1ccccc1 ZINC000744218197 1059335449 /nfs/dbraw/zinc/33/54/49/1059335449.db2.gz KHPLUPZPQLBONR-SDNWHVSQSA-N -1 3 346.386 4.167 20 0 EIADHM Cc1cc(=O)[n-]c(-c2cccc(OC(=O)/C=C\C3CCCCC3)c2)n1 ZINC000744218129 1059337386 /nfs/dbraw/zinc/33/73/86/1059337386.db2.gz VNDICUQZMAMFPU-KHPPLWFESA-N -1 3 338.407 4.200 20 0 EIADHM Cc1cc(Nc2c(Cl)ccc([O-])c2F)cnc1Br ZINC001214556340 1059429097 /nfs/dbraw/zinc/42/90/97/1059429097.db2.gz PVUWLZHRLYSQEJ-UHFFFAOYSA-N -1 3 331.572 4.394 20 0 EIADHM COc1ccc2ccccc2c1CN[C@@H](CC(=O)[O-])c1cccs1 ZINC000392159527 1060306621 /nfs/dbraw/zinc/30/66/21/1060306621.db2.gz RATRCDNHGVARRY-INIZCTEOSA-N -1 3 341.432 4.216 20 0 EIADHM COC(=O)[C@H](CC1CCCCC1)Nc1[n-]c(=O)c(Cl)cc1Cl ZINC001169157195 1060672796 /nfs/dbraw/zinc/67/27/96/1060672796.db2.gz KRPAOSMRXFHTDD-LBPRGKRZSA-N -1 3 347.242 4.018 20 0 EIADHM [O-]c1cc(Nc2cccc(I)c2)ccc1Cl ZINC001212592363 1060888892 /nfs/dbraw/zinc/88/88/92/1060888892.db2.gz MJPNSVCVYLISOJ-UHFFFAOYSA-N -1 3 345.567 4.394 20 0 EIADHM [O-]c1cccnc1CNc1ccc(OCc2ccccc2)c(F)c1F ZINC001169731690 1060934054 /nfs/dbraw/zinc/93/40/54/1060934054.db2.gz DRZJXKIHZCYBFG-UHFFFAOYSA-N -1 3 342.345 4.257 20 0 EIADHM [O-]c1cccnc1CNc1ccc(F)c(C(F)(F)C(F)(F)F)c1 ZINC001169731085 1060934567 /nfs/dbraw/zinc/93/45/67/1060934567.db2.gz BJVIWXATNCEVBB-UHFFFAOYSA-N -1 3 336.235 4.193 20 0 EIADHM O=C([N-][C@@H]1CCCc2sccc21)C(F)(F)c1c(F)cccc1F ZINC000767143155 1061114557 /nfs/dbraw/zinc/11/45/57/1061114557.db2.gz ZUBAJFPKDGQZCV-GFCCVEGCSA-N -1 3 343.345 4.312 20 0 EIADHM CC(C)Oc1ccc(CN[C@@H](C(=O)[O-])c2cccc(Cl)c2)cc1 ZINC000426744279 1032061798 /nfs/dbraw/zinc/06/17/98/1032061798.db2.gz WMZIWFYBBUZGPI-QGZVFWFLSA-N -1 3 333.815 4.043 20 0 EIADHM CC[C@H](NC(=O)Cc1ccc([O-])c(F)c1)c1ccc(Cl)s1 ZINC000449864638 1032072955 /nfs/dbraw/zinc/07/29/55/1032072955.db2.gz PRXVBZPKSYALLG-NSHDSACASA-N -1 3 327.808 4.056 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2ccc(OC(C)C)cc2C)cc1C ZINC000614863555 1032101572 /nfs/dbraw/zinc/10/15/72/1032101572.db2.gz AVSDAVYMMQEXFW-UHFFFAOYSA-N -1 3 333.453 4.200 20 0 EIADHM O=c1nc(CSCc2ccco2)[n-]c2scc(-c3ccco3)c21 ZINC000060969446 1032132803 /nfs/dbraw/zinc/13/28/03/1032132803.db2.gz MMOUNXQRBGCMHR-UHFFFAOYSA-N -1 3 344.417 4.271 20 0 EIADHM [O-]c1ccc(F)c(CNCCc2csc(-c3ccccc3)n2)c1F ZINC000509681631 1032266999 /nfs/dbraw/zinc/26/69/99/1032266999.db2.gz MZDYCMKXZRKHND-UHFFFAOYSA-N -1 3 346.402 4.126 20 0 EIADHM O=C(Nc1ccc([O-])c(C(F)(F)F)c1)C1(C(F)(F)F)CCC1 ZINC000450091897 1032279527 /nfs/dbraw/zinc/27/95/27/1032279527.db2.gz VUHWLQHCHSVPBI-UHFFFAOYSA-N -1 3 327.224 4.082 20 0 EIADHM Cc1ccc(C(=O)N2CCC[C@@H](c3nc(C(C)C)cs3)C2)c([O-])c1 ZINC000172807160 1032334413 /nfs/dbraw/zinc/33/44/13/1032334413.db2.gz NZMGGCNZAIWWEP-CQSZACIVSA-N -1 3 344.480 4.300 20 0 EIADHM C[C@H]1CN(C(=O)c2cc([O-])cc(C(F)(F)F)c2)[C@H]1c1ccccc1 ZINC000646878386 1018861676 /nfs/dbraw/zinc/86/16/76/1018861676.db2.gz OEIXJNRTCWCDIT-MEDUHNTESA-N -1 3 335.325 4.244 20 0 EIADHM CCCCc1nnc([N-]C(=O)c2cc3c(cccc3F)s2)s1 ZINC000021353862 1019308912 /nfs/dbraw/zinc/30/89/12/1019308912.db2.gz LDBPLQCSJWPXRE-UHFFFAOYSA-N -1 3 335.429 4.487 20 0 EIADHM C[C@@H](c1ccc(OC(F)(F)F)cc1)[S@@](=O)c1ccc([O-])cc1 ZINC000108086544 1019338624 /nfs/dbraw/zinc/33/86/24/1019338624.db2.gz GGGXMFACHFINRG-MGUXCZDKSA-N -1 3 330.327 4.160 20 0 EIADHM CCN(c1ccc(C([O-])=C(C#N)c2nc(C)cs2)cc1)C(C)C ZINC000093242841 1020385053 /nfs/dbraw/zinc/38/50/53/1020385053.db2.gz ISDOJQUEHVKPRZ-MRXNPFEDSA-N -1 3 327.453 4.176 20 0 EIADHM O=C(c1cc([O-])ccc1Cl)N(Cc1ccccc1F)CC1CC1 ZINC001167245767 1020660594 /nfs/dbraw/zinc/66/05/94/1020660594.db2.gz HHYHXZKZNYLRER-UHFFFAOYSA-N -1 3 333.790 4.237 20 0 EIADHM O=C(Cc1ccc(OC(F)(F)F)cc1)Nc1ccc(Cl)cc1[O-] ZINC000533618599 1020747802 /nfs/dbraw/zinc/74/78/02/1020747802.db2.gz WFQGXFSMARSHSA-UHFFFAOYSA-N -1 3 345.704 4.125 20 0 EIADHM CC(=O)c1ccc(C(=O)[N-]c2ccccc2SCC(F)(F)F)o1 ZINC000683578811 1020923066 /nfs/dbraw/zinc/92/30/66/1020923066.db2.gz MBVXENUFANAGSL-UHFFFAOYSA-N -1 3 343.326 4.389 20 0 EIADHM [O-]c1c(Cl)cccc1Nc1ccc2nc(-c3ccccc3)nn2c1 ZINC001210219485 1020956906 /nfs/dbraw/zinc/95/69/06/1020956906.db2.gz JMGARNFSKUMJSY-UHFFFAOYSA-N -1 3 336.782 4.499 20 0 EIADHM [O-]c1cc(F)cc(-c2nc3ccccc3n2CCc2ccccn2)c1 ZINC000471424981 1020957762 /nfs/dbraw/zinc/95/77/62/1020957762.db2.gz FOPFCYSUPHLDPP-UHFFFAOYSA-N -1 3 333.366 4.186 20 0 EIADHM CN(C)c1cccc([C@H]2CCCN2C(=O)c2cc([O-])ccc2Cl)c1 ZINC000340473847 1021084792 /nfs/dbraw/zinc/08/47/92/1021084792.db2.gz HLGZHAXYCCOICW-GOSISDBHSA-N -1 3 344.842 4.089 20 0 EIADHM O=C(Nc1cc(Br)ccc1[O-])c1cccc(Cl)c1F ZINC000159879812 1021190863 /nfs/dbraw/zinc/19/08/63/1021190863.db2.gz IGANICMBNVRBGJ-UHFFFAOYSA-N -1 3 344.567 4.200 20 0 EIADHM COc1ccsc1C(=O)[N-]c1nnc(-c2cc(C)cc(C)c2)s1 ZINC000115150282 1021298900 /nfs/dbraw/zinc/29/89/00/1021298900.db2.gz XKPUDWROVIHOGW-UHFFFAOYSA-N -1 3 345.449 4.144 20 0 EIADHM CC[C@H](c1cccc(OC)c1)N(C)C(=O)c1cc([O-])ccc1Cl ZINC000685855437 1021781917 /nfs/dbraw/zinc/78/19/17/1021781917.db2.gz VEFCMAMLYBQVPN-QGZVFWFLSA-N -1 3 333.815 4.278 20 0 EIADHM CCc1ccc([O-])c(C(=O)N2CCC(Cc3ccc(F)cc3)CC2)c1 ZINC000512525668 1033007952 /nfs/dbraw/zinc/00/79/52/1033007952.db2.gz QIKRELYCTPIOIR-UHFFFAOYSA-N -1 3 341.426 4.189 20 0 EIADHM CC(C)(CNC(=O)c1cc([O-])ccc1Cl)c1cccc(Cl)c1 ZINC000431776992 1021830253 /nfs/dbraw/zinc/83/02/53/1021830253.db2.gz VPVYTCPDAJSZTH-UHFFFAOYSA-N -1 3 338.234 4.407 20 0 EIADHM O=C(Nc1nc(-c2ccc(O)cc2)cs1)c1cc([O-])ccc1Cl ZINC000431781125 1021834673 /nfs/dbraw/zinc/83/46/73/1021834673.db2.gz JBXVZSJRPNRYQY-UHFFFAOYSA-N -1 3 346.795 4.127 20 0 EIADHM O=C(N[C@H]1CCC[C@H]1Cc1ccccc1)c1cc([O-])ccc1Cl ZINC000431793640 1021862511 /nfs/dbraw/zinc/86/25/11/1021862511.db2.gz ZUZPKTJVOYUPAN-KSSFIOAISA-N -1 3 329.827 4.187 20 0 EIADHM C[C@H](c1ccc(Br)cc1)N1CCC[C@H](CCC(=O)[O-])C1 ZINC000086809217 1021976950 /nfs/dbraw/zinc/97/69/50/1021976950.db2.gz WOKPHXNLUKKFIN-CHWSQXEVSA-N -1 3 340.261 4.087 20 0 EIADHM Cc1ccc2ncc(C(=O)[O-])c(N3CCC(c4ccncc4)CC3)c2c1 ZINC000580451512 1022035868 /nfs/dbraw/zinc/03/58/68/1022035868.db2.gz DTNQPXQADCJXDK-UHFFFAOYSA-N -1 3 347.418 4.020 20 0 EIADHM CSc1ccc([O-])c(C(=O)N2CC[C@@H](c3ccc(C)cc3)C2)c1 ZINC000613458604 1022059749 /nfs/dbraw/zinc/05/97/49/1022059749.db2.gz MZRWLOJFTSQAJO-OAHLLOKOSA-N -1 3 327.449 4.052 20 0 EIADHM O=C([N-]c1nc(-c2cccs2)ns1)c1cc(Cl)ccc1F ZINC000182156715 1022321675 /nfs/dbraw/zinc/32/16/75/1022321675.db2.gz XQEQMVCGBMJYFW-UHFFFAOYSA-N -1 3 339.804 4.311 20 0 EIADHM CCCc1cc(=O)[n-]c(C(=Cc2cnc(-c3ccccc3)nc2)CC)n1 ZINC000684034044 1022397911 /nfs/dbraw/zinc/39/79/11/1022397911.db2.gz VPBKPTFYFRAQFX-LFIBNONCSA-N -1 3 346.434 4.130 20 0 EIADHM Cc1sc2[n-]c([C@@H](C)OC(=O)[C@@H]3CCC(C)(C)C3)nc(=O)c2c1C ZINC000781698553 1022423847 /nfs/dbraw/zinc/42/38/47/1022423847.db2.gz PUDADLIJUGLBHQ-ZYHUDNBSSA-N -1 3 348.468 4.444 20 0 EIADHM O=C(CCCc1ccc(Cl)c(Cl)c1)[N-]OCCC(F)(F)F ZINC000162905397 1022782745 /nfs/dbraw/zinc/78/27/45/1022782745.db2.gz ZHUBHOCFKOOZSM-UHFFFAOYSA-N -1 3 344.160 4.316 20 0 EIADHM O=c1nc(CN2CC3CCC2CC3)[n-]c2scc(-c3ccco3)c21 ZINC000378386325 1022788937 /nfs/dbraw/zinc/78/89/37/1022788937.db2.gz VAEKFGPRBJVKNK-UHFFFAOYSA-N -1 3 341.436 4.031 20 0 EIADHM COc1cccc(SC)c1NC(=O)CCCc1ccc([O-])c(F)c1 ZINC000416358813 1022804039 /nfs/dbraw/zinc/80/40/39/1022804039.db2.gz KHCOBQHQFLFLKC-UHFFFAOYSA-N -1 3 349.427 4.223 20 0 EIADHM CC[C@@H]1CN(Cc2c(C(=O)[O-])sc3cccc(F)c32)CCS1 ZINC000387830807 1022822360 /nfs/dbraw/zinc/82/23/60/1022822360.db2.gz YZJNILRYJVQKRS-SNVBAGLBSA-N -1 3 339.457 4.066 20 0 EIADHM Cc1ccccc1-c1nc(C(=O)Nc2cccc([O-])c2F)cs1 ZINC000128624991 1022948210 /nfs/dbraw/zinc/94/82/10/1022948210.db2.gz AEWWXVHCYGSNML-UHFFFAOYSA-N -1 3 328.368 4.216 20 0 EIADHM Cc1ccccc1S(=O)(=O)[N-]c1ccc(OC(C)C)c(Cl)c1 ZINC000388136799 1023053163 /nfs/dbraw/zinc/05/31/63/1023053163.db2.gz FKJPWDBHDDHQFS-UHFFFAOYSA-N -1 3 339.844 4.236 20 0 EIADHM CC(C)c1ccc(C(=O)N(C)Cc2nc3ccccc3s2)c([O-])c1 ZINC000048398303 1023082775 /nfs/dbraw/zinc/08/27/75/1023082775.db2.gz PZYXEQQLOWQVEO-UHFFFAOYSA-N -1 3 340.448 4.398 20 0 EIADHM CC(C)c1ccc(C(=O)N2CCCC[C@@H]2[C@@H]2CCCC[C@H]2O)c([O-])c1 ZINC000647648036 1023097123 /nfs/dbraw/zinc/09/71/23/1023097123.db2.gz PFOLYHMZXMSXKA-QXAKKESOSA-N -1 3 345.483 4.061 20 0 EIADHM Cc1ccc(-c2noc(C=C([O-])c3ccccc3Cl)n2)c(F)c1 ZINC001211645029 1023114076 /nfs/dbraw/zinc/11/40/76/1023114076.db2.gz KOWLMUJWQNNOQO-UHFFFAOYSA-N -1 3 330.746 4.263 20 0 EIADHM C[C@H]1C[C@@H]1c1ccc(CN2CCC(C(=O)c3ccc([O-])cc3)CC2)o1 ZINC000124038798 1023193501 /nfs/dbraw/zinc/19/35/01/1023193501.db2.gz ZQGNLVIWDMHNHY-LIRRHRJNSA-N -1 3 339.435 4.204 20 0 EIADHM [O-]C(=Cc1nc(-c2ccc(F)c(F)c2)no1)c1ccccc1Cl ZINC001211647362 1023223258 /nfs/dbraw/zinc/22/32/58/1023223258.db2.gz LVJOEEOBCBTXLI-UHFFFAOYSA-N -1 3 334.709 4.094 20 0 EIADHM CSc1cccc(Nc2ncc(Br)cc2[O-])c1F ZINC001215866322 1023339372 /nfs/dbraw/zinc/33/93/72/1023339372.db2.gz AAXBTVVQTQMGND-UHFFFAOYSA-N -1 3 329.194 4.154 20 0 EIADHM O=C([O-])[C@@H]1C[C@@H](NCc2cnc(C3CCCC3)s2)c2ccccc21 ZINC000417630003 1023381818 /nfs/dbraw/zinc/38/18/18/1023381818.db2.gz QQZBKWIAPZFZMA-IAGOWNOFSA-N -1 3 342.464 4.204 20 0 EIADHM Cc1cc2cc(CN[C@H]3C[C@@H](C(=O)[O-])c4ccccc43)oc2cc1C ZINC000417631273 1023382946 /nfs/dbraw/zinc/38/29/46/1023382946.db2.gz RYURYVBQMXINDT-MOPGFXCFSA-N -1 3 335.403 4.452 20 0 EIADHM O=C(Cc1cccc(Cl)c1F)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000581579307 1023383395 /nfs/dbraw/zinc/38/33/95/1023383395.db2.gz QHCUWMJERWQCTE-UHFFFAOYSA-N -1 3 347.695 4.385 20 0 EIADHM CC(C)COc1ccccc1CN[C@@H]1C[C@@H](C(=O)[O-])c2ccccc21 ZINC000417634315 1023384968 /nfs/dbraw/zinc/38/49/68/1023384968.db2.gz VKHQSGXIYRIRMV-RTBURBONSA-N -1 3 339.435 4.124 20 0 EIADHM Cc1cc(CNCc2cscc2C(F)(F)F)ccc1C(=O)[O-] ZINC000417644941 1023394698 /nfs/dbraw/zinc/39/46/98/1023394698.db2.gz BHOVXIKVPRRZGB-UHFFFAOYSA-N -1 3 329.343 4.063 20 0 EIADHM [O-]c1cc(F)cc(CN[C@@H](c2ccncc2)c2cc(F)ccc2F)c1 ZINC000364212840 1023488868 /nfs/dbraw/zinc/48/88/68/1023488868.db2.gz CVMFANXFDYOVAQ-IBGZPJMESA-N -1 3 344.336 4.084 20 0 EIADHM CC(C)O[C@H](CN1CC[C@H](C(=O)[O-])[C@H]2CCCC[C@@H]21)c1ccccc1 ZINC000656767159 1023508424 /nfs/dbraw/zinc/50/84/24/1023508424.db2.gz RRLLQTNHKAQFJW-FUMNGEBKSA-N -1 3 345.483 4.118 20 0 EIADHM Cc1ccc2ncc(CN3CC[C@H](C(=O)[O-])[C@H]4CCCC[C@@H]43)cc2c1 ZINC000656765116 1023510113 /nfs/dbraw/zinc/51/01/13/1023510113.db2.gz IXYCBNNYUIMPQN-HBFSDRIKSA-N -1 3 338.451 4.009 20 0 EIADHM CCc1nc(C(C)C)ccc1CN1CC[C@H](C(=O)[O-])[C@H]2CCCC[C@@H]21 ZINC000656769391 1023511978 /nfs/dbraw/zinc/51/19/78/1023511978.db2.gz ZBBNIKDAPSTWEQ-UWVAXJGDSA-N -1 3 344.499 4.233 20 0 EIADHM Brc1ccc2oc(C[N-]c3nc(C4CC4)no3)cc2c1 ZINC000656771976 1023516796 /nfs/dbraw/zinc/51/67/96/1023516796.db2.gz NOMJFFYUHPCMFA-UHFFFAOYSA-N -1 3 334.173 4.068 20 0 EIADHM Cc1ccc([N-]S(=O)(=O)c2ccc(C)c(C(F)(F)F)c2)c(C)c1 ZINC000500299951 1023672539 /nfs/dbraw/zinc/67/25/39/1023672539.db2.gz UVRGHJDMEICFAS-UHFFFAOYSA-N -1 3 343.370 4.431 20 0 EIADHM O=C([N-]c1c(F)cc(F)cc1F)c1ccc(Br)s1 ZINC000088722525 1024152799 /nfs/dbraw/zinc/15/27/99/1024152799.db2.gz UXUUFQLYKDZXAN-UHFFFAOYSA-N -1 3 336.132 4.180 20 0 EIADHM C[C@@H]1CO[C@H](c2ccccc2Cl)CN1Cc1cc([O-])cc(F)c1 ZINC000473142206 1024457089 /nfs/dbraw/zinc/45/70/89/1024457089.db2.gz PSQLKEQAGVBEHU-XIKOKIGWSA-N -1 3 335.806 4.147 20 0 EIADHM Cc1ccccc1S(=O)(=O)[N-]c1ccc(N2CCC(C)CC2)cc1 ZINC000243762682 1024525698 /nfs/dbraw/zinc/52/56/98/1024525698.db2.gz QCSGHRFBZKWLAJ-UHFFFAOYSA-N -1 3 344.480 4.032 20 0 EIADHM CC1CCC(N(C)Cc2c(Br)cccc2C(=O)[O-])CC1 ZINC000652379529 1024786188 /nfs/dbraw/zinc/78/61/88/1024786188.db2.gz SMQIMBVHNIGMHS-UHFFFAOYSA-N -1 3 340.261 4.158 20 0 EIADHM C[C@@H]1CN(Cc2cccc(C(=O)[O-])c2Cl)CCc2ccc(F)cc21 ZINC000652510720 1024863057 /nfs/dbraw/zinc/86/30/57/1024863057.db2.gz IRPVGPMKFQLUQK-GFCCVEGCSA-N -1 3 347.817 4.339 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)NCC(C1CCC1)C1CCC1 ZINC001167787943 1024880636 /nfs/dbraw/zinc/88/06/36/1024880636.db2.gz UPOYHGNIJXXHFA-UHFFFAOYSA-N -1 3 333.447 4.187 20 0 EIADHM O=C([O-])CC[C@@H](CNCc1cc(Cl)cc(Cl)c1)C(F)(F)F ZINC000663262513 1024967830 /nfs/dbraw/zinc/96/78/30/1024967830.db2.gz SRVLFQSLMNUDID-VIFPVBQESA-N -1 3 344.160 4.126 20 0 EIADHM Cc1cc2cc(CNC[C@H](CCC(=O)[O-])C(F)(F)F)oc2cc1C ZINC000663261372 1024968578 /nfs/dbraw/zinc/96/85/78/1024968578.db2.gz JXUKVDHQRIUZEJ-ZDUSSCGKSA-N -1 3 343.345 4.183 20 0 EIADHM O=C(Nc1ncccc1[O-])c1sc(C2CC2)nc1-c1ccccc1 ZINC000341894859 1024972147 /nfs/dbraw/zinc/97/21/47/1024972147.db2.gz YWHGRAOCPHBCEU-UHFFFAOYSA-N -1 3 337.404 4.040 20 0 EIADHM CC(=O)[C@H](C)CCSc1nnc([N-]c2ccccc2F)s1 ZINC000657227679 1025307477 /nfs/dbraw/zinc/30/74/77/1025307477.db2.gz IRIHCVXGKWCCET-SECBINFHSA-N -1 3 325.434 4.128 20 0 EIADHM O=C([N-]c1ccccc1SC[C@@H]1CC1(Cl)Cl)c1ccon1 ZINC000128760209 1025512922 /nfs/dbraw/zinc/51/29/22/1025512922.db2.gz UTPLPJLCGNKNOB-VIFPVBQESA-N -1 3 343.235 4.213 20 0 EIADHM CCOc1ccccc1[C@@H](CC(C)C)NCc1nc(CC)cc(=O)[n-]1 ZINC000342245107 1025568274 /nfs/dbraw/zinc/56/82/74/1025568274.db2.gz PMRBGINQNOQORP-QGZVFWFLSA-N -1 3 343.471 4.020 20 0 EIADHM CC(C)c1ccc(S(=O)(=O)[N-]c2cc(F)c(F)cc2F)cc1 ZINC000519215726 1025606243 /nfs/dbraw/zinc/60/62/43/1025606243.db2.gz ZBMNGNQKLRZLJL-UHFFFAOYSA-N -1 3 329.343 4.028 20 0 EIADHM CCOC(=O)c1nc(C)sc1[N-]c1c(Cl)ccnc1Cl ZINC001216301154 1025814221 /nfs/dbraw/zinc/81/42/21/1025814221.db2.gz ZAARZEUPUPJZES-UHFFFAOYSA-N -1 3 332.212 4.074 20 0 EIADHM Cc1ccc(-c2csc(C[S@](=O)c3ccc([O-])cc3)n2)cc1 ZINC000349681513 1025865066 /nfs/dbraw/zinc/86/50/66/1025865066.db2.gz WHLPJIHMSMTIRN-QFIPXVFZSA-N -1 3 329.446 4.132 20 0 EIADHM Cc1c(C(=O)Nc2cc(Cl)ccc2[O-])cnn1C1CCCCC1 ZINC000512176656 1026239315 /nfs/dbraw/zinc/23/93/15/1026239315.db2.gz VEUJTKGPNPQHJJ-UHFFFAOYSA-N -1 3 333.819 4.308 20 0 EIADHM Cc1ccc(-c2nc(-c3ccccc3Br)no2)c([O-])c1 ZINC000111689403 1026320240 /nfs/dbraw/zinc/32/02/40/1026320240.db2.gz ZJESLWDUOFTBFF-UHFFFAOYSA-N -1 3 331.169 4.180 20 0 EIADHM O=C([O-])c1ccc(CN2CC[C@H](C(F)(F)F)C3(CCC3)C2)s1 ZINC000563282394 1026327768 /nfs/dbraw/zinc/32/77/68/1026327768.db2.gz KTSGJGQMODDENM-LBPRGKRZSA-N -1 3 333.375 4.001 20 0 EIADHM CC(=O)c1ccc(OCCCC(=O)Nc2c([O-])cccc2Cl)cc1 ZINC000582232808 1026355623 /nfs/dbraw/zinc/35/56/23/1026355623.db2.gz NIPJDWAFMKENDS-UHFFFAOYSA-N -1 3 347.798 4.046 20 0 EIADHM CN(Cc1ccc(Cl)c(F)c1)C(=O)c1cc([O-])ccc1Cl ZINC000344400952 1026381307 /nfs/dbraw/zinc/38/13/07/1026381307.db2.gz VZEIXWOPQWNWMV-UHFFFAOYSA-N -1 3 328.170 4.110 20 0 EIADHM Cc1n[nH]c(C)c1[C@@H]1CCCCCN1C(=O)c1cc([O-])ccc1Cl ZINC000344583480 1026466960 /nfs/dbraw/zinc/46/69/60/1026466960.db2.gz VJCYLSURDQHBPY-INIZCTEOSA-N -1 3 347.846 4.143 20 0 EIADHM C[C@H](CCC[C@H](C)NCc1ncc(-c2ccccc2)s1)C(=O)[O-] ZINC000426685063 1026473457 /nfs/dbraw/zinc/47/34/57/1026473457.db2.gz FSVGFJKYAQCEPG-KGLIPLIRSA-N -1 3 332.469 4.179 20 0 EIADHM O=C([O-])C[C@H](NCc1ccc(Cl)c(Cl)c1)c1ccsc1 ZINC000426684953 1026474748 /nfs/dbraw/zinc/47/47/48/1026474748.db2.gz DKEUZGQEEKPPCX-ZDUSSCGKSA-N -1 3 330.236 4.361 20 0 EIADHM CCCOc1cccc(CN[C@H](C(=O)[O-])c2cccc(Cl)c2)c1 ZINC000426731702 1026511229 /nfs/dbraw/zinc/51/12/29/1026511229.db2.gz FXRZNAVKRDYOPW-KRWDZBQOSA-N -1 3 333.815 4.044 20 0 EIADHM CC(C)C1(C)CCN(Cc2nc3c4ccccc4oc3c(=O)[n-]2)CC1 ZINC000426741115 1026522619 /nfs/dbraw/zinc/52/26/19/1026522619.db2.gz JYXHVKPGCXEUPG-UHFFFAOYSA-N -1 3 339.439 4.340 20 0 EIADHM O=C([O-])[C@@H](NCc1cccc(OC2CCCC2)c1)c1ccc(F)cc1 ZINC000426765149 1026530393 /nfs/dbraw/zinc/53/03/93/1026530393.db2.gz KNLLYXPXMUJTLP-IBGZPJMESA-N -1 3 343.398 4.063 20 0 EIADHM O=C([O-])[C@@H](NCc1ccc(Cl)c(F)c1)c1cccc(Cl)c1 ZINC000426727390 1026530733 /nfs/dbraw/zinc/53/07/33/1026530733.db2.gz OLQRNISVEJQKGP-AWEZNQCLSA-N -1 3 328.170 4.048 20 0 EIADHM O=C([O-])C[C@H](NCc1cccc(F)c1)c1cc(Cl)cc(Cl)c1 ZINC000426750572 1026534903 /nfs/dbraw/zinc/53/49/03/1026534903.db2.gz OHYUKKPFGAUTEJ-HNNXBMFYSA-N -1 3 342.197 4.438 20 0 EIADHM CC(C)COc1cccc(CN[C@@H](CC(=O)[O-])c2ccccc2)c1 ZINC000426780276 1026555293 /nfs/dbraw/zinc/55/52/93/1026555293.db2.gz QANFTNHWKOKLMM-IBGZPJMESA-N -1 3 327.424 4.027 20 0 EIADHM Cc1cc(C(F)(F)F)ccc1CN[C@@H](C(=O)[O-])c1cccc(F)c1 ZINC000426809129 1026573089 /nfs/dbraw/zinc/57/30/89/1026573089.db2.gz CDPHTCQIYRPJAT-OAHLLOKOSA-N -1 3 341.304 4.068 20 0 EIADHM CC(C)Oc1ccc(CN[C@@H](CC(=O)[O-])c2cccc(Cl)c2)cc1 ZINC000426820704 1026578872 /nfs/dbraw/zinc/57/88/72/1026578872.db2.gz MQAUSDGEDUOTMQ-SFHVURJKSA-N -1 3 347.842 4.433 20 0 EIADHM [O-]c1cccc(CN2CC=C(c3c[nH]c4ncccc34)CC2)c1Cl ZINC000507081770 1026633918 /nfs/dbraw/zinc/63/39/18/1026633918.db2.gz MUSIQCSEKDBFTC-UHFFFAOYSA-N -1 3 339.826 4.211 20 0 EIADHM Cc1ccccc1[C@@H](NC(=O)c1cc(=O)c2ccccc2[n-]1)C(C)(C)C ZINC000431417118 1026671947 /nfs/dbraw/zinc/67/19/47/1026671947.db2.gz HBXZUHZYIHZHQJ-HXUWFJFHSA-N -1 3 348.446 4.354 20 0 EIADHM COC(=O)c1cnc(SCc2ccc(-c3ccsc3)cc2)[n-]1 ZINC000432657896 1026679591 /nfs/dbraw/zinc/67/95/91/1026679591.db2.gz MRTPZZVVEFSABZ-UHFFFAOYSA-N -1 3 330.434 4.217 20 0 EIADHM COc1ccc2c(c1)CCC[C@H]2N(C)Cc1c(F)ccc([O-])c1F ZINC000507254233 1026717650 /nfs/dbraw/zinc/71/76/50/1026717650.db2.gz UEMBTNSZLITFGE-QGZVFWFLSA-N -1 3 333.378 4.188 20 0 EIADHM C[C@@H](NCc1cc(=O)oc2cc([O-])ccc12)c1cc2ccccc2o1 ZINC000176677618 1026725867 /nfs/dbraw/zinc/72/58/67/1026725867.db2.gz BDJDQEAIIUTRDF-GFCCVEGCSA-N -1 3 335.359 4.096 20 0 EIADHM Cc1ccc(C(=O)Nc2cccc(Oc3ccccn3)c2)c([O-])c1C ZINC000440657166 1026995429 /nfs/dbraw/zinc/99/54/29/1026995429.db2.gz CURUHSIFMWRQSA-UHFFFAOYSA-N -1 3 334.375 4.449 20 0 EIADHM Cc1ccccc1C1CCN(Cc2ccc(C(=O)[O-])c(F)c2)CC1 ZINC000563453061 1027074774 /nfs/dbraw/zinc/07/47/74/1027074774.db2.gz CWHHGWXPWSVJIR-UHFFFAOYSA-N -1 3 327.399 4.212 20 0 EIADHM CCc1nc(C)c([C@@H](C)N(C)C(=O)c2ccc(CC)cc2[O-])s1 ZINC000191758761 1027100167 /nfs/dbraw/zinc/10/01/67/1027100167.db2.gz JWKNPGDIFBFPMG-GFCCVEGCSA-N -1 3 332.469 4.115 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(NCc3ccc(C4CC4)cc3)nc2)n1 ZINC000302661448 1027353383 /nfs/dbraw/zinc/35/33/83/1027353383.db2.gz FAVKDUIXAFLPAM-UHFFFAOYSA-N -1 3 346.434 4.296 20 0 EIADHM CC[C@@H](Cc1ccc(Cl)cc1)NC(=O)c1cc([O-])ccc1Cl ZINC000582920518 1027688496 /nfs/dbraw/zinc/68/84/96/1027688496.db2.gz UBIBPLNPLOYGFV-ZDUSSCGKSA-N -1 3 338.234 4.450 20 0 EIADHM CC(C)(C)[C@H]1CCC[C@H](NC(=O)c2cc(=O)c3ccccc3[n-]2)CC1 ZINC000444438199 1027744145 /nfs/dbraw/zinc/74/41/45/1027744145.db2.gz RGBLKXQWROLJTA-GJZGRUSLSA-N -1 3 340.467 4.253 20 0 EIADHM CC(C)(c1nnc([N-]C(=O)c2ccoc2Cl)s1)c1ccccc1 ZINC000192306950 1027929125 /nfs/dbraw/zinc/92/91/25/1027929125.db2.gz IKNSURWGYVPFQW-UHFFFAOYSA-N -1 3 347.827 4.363 20 0 EIADHM Cc1cnn(Cc2ccccc2F)c1Nc1cc(F)c([O-])c(F)c1 ZINC001213377254 1027988165 /nfs/dbraw/zinc/98/81/65/1027988165.db2.gz FNJDLSOQRLXSAO-UHFFFAOYSA-N -1 3 333.313 4.106 20 0 EIADHM CC(C)Oc1ccccc1[C@@H](C)NC(=O)c1cc([O-])ccc1Cl ZINC000564411194 1027993999 /nfs/dbraw/zinc/99/39/99/1027993999.db2.gz MCBWZFHDBYSXLI-GFCCVEGCSA-N -1 3 333.815 4.324 20 0 EIADHM Cc1cc(Nc2cc(F)c([O-])c(F)c2)n(Cc2cccc(F)c2)n1 ZINC001213377354 1027997506 /nfs/dbraw/zinc/99/75/06/1027997506.db2.gz LBPPCQGBJOVZLA-UHFFFAOYSA-N -1 3 333.313 4.106 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)N[C@@H]1CCCC[C@H]1c1ccccc1 ZINC000523462698 1028132396 /nfs/dbraw/zinc/13/23/96/1028132396.db2.gz JTJPPFUEUUAJNA-FUHWJXTLSA-N -1 3 342.414 4.057 20 0 EIADHM CN(C(=O)NCc1ccc([O-])c(F)c1)C1CCC(C(C)(C)C)CC1 ZINC000523465736 1028133369 /nfs/dbraw/zinc/13/33/69/1028133369.db2.gz MRNQFFHBASYPIO-UHFFFAOYSA-N -1 3 336.451 4.278 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)N1CCC[C@@H]1CC1CCCCC1 ZINC000523509958 1028165393 /nfs/dbraw/zinc/16/53/93/1028165393.db2.gz FKHXVYOXUCQQFM-MRXNPFEDSA-N -1 3 334.435 4.176 20 0 EIADHM CCOc1ccc(S(=O)(=O)[N-]c2cccc(C(F)F)c2)cc1C ZINC000523728492 1028351192 /nfs/dbraw/zinc/35/11/92/1028351192.db2.gz HOVYEEFALHXOCZ-UHFFFAOYSA-N -1 3 341.379 4.132 20 0 EIADHM C[C@H](SCC1CC1)c1nc(=O)c2c(-c3ccco3)csc2[n-]1 ZINC000125122138 1028354900 /nfs/dbraw/zinc/35/49/00/1028354900.db2.gz LCJZEUWUXZVZLT-VIFPVBQESA-N -1 3 332.450 4.449 20 0 EIADHM Cc1cc(F)cc2c(=O)c(C(=O)Nc3cccc(Cl)c3C)c[n-]c12 ZINC000155249765 1028381970 /nfs/dbraw/zinc/38/19/70/1028381970.db2.gz GGZYPZKHYKJJLJ-UHFFFAOYSA-N -1 3 344.773 4.190 20 0 EIADHM Cc1ncc(CN[C@@H](C)c2ccc(Cl)c(Cl)c2Cl)c(=O)[n-]1 ZINC000346811731 1028668125 /nfs/dbraw/zinc/66/81/25/1028668125.db2.gz VGRXZEVEVXTQRP-ZETCQYMHSA-N -1 3 346.645 4.302 20 0 EIADHM Cc1nc2sccn2c1-c1noc(-c2ccc(C(C)C)cc2[O-])n1 ZINC000445635980 1028823470 /nfs/dbraw/zinc/82/34/70/1028823470.db2.gz VIKRRBMQANYNSK-UHFFFAOYSA-N -1 3 340.408 4.250 20 0 EIADHM Cc1cccc([O-])c1C(=O)Nc1cccc(NC(=O)c2ccccc2)c1 ZINC001625879269 1028867808 /nfs/dbraw/zinc/86/78/08/1028867808.db2.gz GBQOMAGUDHRXLL-UHFFFAOYSA-N -1 3 346.386 4.205 20 0 EIADHM O=S(=O)([N-][C@H](c1cccc(Cl)c1)C1CCCC1)c1ccco1 ZINC000445739915 1028868663 /nfs/dbraw/zinc/86/86/63/1028868663.db2.gz LNXULBIMHRTFNJ-INIZCTEOSA-N -1 3 339.844 4.143 20 0 EIADHM O=S(=O)([N-][C@@H](c1ccc(Cl)cc1)C1CCCC1)c1ccco1 ZINC000445743314 1028869162 /nfs/dbraw/zinc/86/91/62/1028869162.db2.gz QVFKRRBPMXDPCC-MRXNPFEDSA-N -1 3 339.844 4.143 20 0 EIADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)C[C@H](CC)C(C)C)c2)n1 ZINC000104273634 1029269936 /nfs/dbraw/zinc/26/99/36/1029269936.db2.gz MMFUALRUQQQNBS-AWEZNQCLSA-N -1 3 341.455 4.010 20 0 EIADHM Cc1cc(=O)[n-]c([C@@H](C)N[C@H](C)c2cc(F)c(Cl)cc2Cl)n1 ZINC000192722507 1029369257 /nfs/dbraw/zinc/36/92/57/1029369257.db2.gz KEXBONLPGMTERJ-RKDXNWHRSA-N -1 3 344.217 4.348 20 0 EIADHM C[C@@H](c1ccc(Cl)cc1)N(C(=O)c1ccc(O)cc1[O-])C1CC1 ZINC000193233198 1029590358 /nfs/dbraw/zinc/59/03/58/1029590358.db2.gz AMFLULGMLZSYAP-NSHDSACASA-N -1 3 331.799 4.117 20 0 EIADHM O=C([O-])c1ccc2c(c1)CN(CCC13CC4CC(CC(C4)C1)C3)C2 ZINC000326337043 1029590502 /nfs/dbraw/zinc/59/05/02/1029590502.db2.gz JKGBGMIPWKEMMU-UHFFFAOYSA-N -1 3 325.452 4.307 20 0 EIADHM O=C(Nc1ncccc1[O-])[C@H](Sc1ccccc1)c1ccccc1 ZINC000216634793 1029595391 /nfs/dbraw/zinc/59/53/91/1029595391.db2.gz BKINMYNIWJZDJI-QGZVFWFLSA-N -1 3 336.416 4.259 20 0 EIADHM COc1ccc([C@@H](C)N(C)C(=O)CCCc2ccc([O-])c(F)c2)cc1 ZINC000468367873 1029606523 /nfs/dbraw/zinc/60/65/23/1029606523.db2.gz PKBOAWGMQZSFKG-CQSZACIVSA-N -1 3 345.414 4.082 20 0 EIADHM Cc1ccccc1-c1cc(NC(=O)c2cc([O-])ccc2Cl)n(C)n1 ZINC000584128224 1029638489 /nfs/dbraw/zinc/63/84/89/1029638489.db2.gz KDMYAEZPEHLGRI-UHFFFAOYSA-N -1 3 341.798 4.007 20 0 EIADHM Cc1ccc(C[C@@H](C)N(C)Cc2cc(C(=O)[O-])ccc2Cl)cc1 ZINC000584177985 1029662227 /nfs/dbraw/zinc/66/22/27/1029662227.db2.gz WIABBJFHQGUGON-CQSZACIVSA-N -1 3 331.843 4.410 20 0 EIADHM CCSCc1cccc([N-]S(=O)(=O)c2ccc(C)c(C)c2)c1 ZINC000525522692 1029663984 /nfs/dbraw/zinc/66/39/84/1029663984.db2.gz WKKQWRHOULRBOX-UHFFFAOYSA-N -1 3 335.494 4.357 20 0 EIADHM [O-]c1ccc(CNc2nc(-c3ccncc3)nc3ccccc32)cc1F ZINC000301372466 1029718045 /nfs/dbraw/zinc/71/80/45/1029718045.db2.gz QOSFLWDAURCBAL-UHFFFAOYSA-N -1 3 346.365 4.149 20 0 EIADHM CCCn1c(=O)[n-]nc1S[C@H](c1ccccc1)c1ccc(F)cc1 ZINC000525623115 1029721525 /nfs/dbraw/zinc/72/15/25/1029721525.db2.gz DQUANPDFRLRVFK-MRXNPFEDSA-N -1 3 343.427 4.415 20 0 EIADHM O=S(=O)([N-]c1ccc(-c2ccco2)cc1F)c1cccc(F)c1 ZINC000447273490 1029939379 /nfs/dbraw/zinc/93/93/79/1029939379.db2.gz IAAKKHPKCKGBTH-UHFFFAOYSA-N -1 3 335.331 4.026 20 0 EIADHM CC(C)c1ccc(C(=O)N2C[C@@H](C)O[C@@H](c3ccccc3)C2)c([O-])c1 ZINC000143502444 1030071999 /nfs/dbraw/zinc/07/19/99/1030071999.db2.gz UIBFNTRWEIAMTO-FOIQADDNSA-N -1 3 339.435 4.118 20 0 EIADHM CCS[C@H]1CCCC[C@@H]1NC(=O)c1cc([O-])c2ccccc2c1 ZINC000525935499 1030127749 /nfs/dbraw/zinc/12/77/49/1030127749.db2.gz JQCSLHBGIDUXAI-WMZOPIPTSA-N -1 3 329.465 4.340 20 0 EIADHM O=C([N-]c1csc(-c2ccncc2)n1)c1cc(-c2ccccc2)no1 ZINC000185430969 1030151894 /nfs/dbraw/zinc/15/18/94/1030151894.db2.gz WPZHJFRRXGFSSR-UHFFFAOYSA-N -1 3 348.387 4.112 20 0 EIADHM COc1ccc([N-]S(=O)(=O)c2cc(C(C)(C)C)ccc2C)cc1 ZINC000006315871 1030166604 /nfs/dbraw/zinc/16/66/04/1030166604.db2.gz JDOHLHIGLZFZOL-UHFFFAOYSA-N -1 3 333.453 4.102 20 0 EIADHM CCOc1ccc(C2=CCN(Cc3cccc(C(=O)[O-])c3)CC2)cc1 ZINC000263375743 1030840374 /nfs/dbraw/zinc/84/03/74/1030840374.db2.gz ALTMALZTHKGSDI-UHFFFAOYSA-N -1 3 337.419 4.073 20 0 EIADHM C[C@]1(C(=O)[O-])CCN(Cc2c(Cl)cccc2Oc2ccccc2)C1 ZINC000263508662 1030902706 /nfs/dbraw/zinc/90/27/06/1030902706.db2.gz MRRGTOMEDHOSSX-IBGZPJMESA-N -1 3 345.826 4.429 20 0 EIADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)[C@]3(C)CC=CCC3)c2)n1 ZINC000448727092 1030990875 /nfs/dbraw/zinc/99/08/75/1030990875.db2.gz WPTCVJHODAKIHA-HXUWFJFHSA-N -1 3 337.423 4.097 20 0 EIADHM CCCCN(C(=O)Cc1ccc([O-])c(F)c1)[C@@H](C)c1ccc(C)o1 ZINC000648214363 1031048975 /nfs/dbraw/zinc/04/89/75/1031048975.db2.gz UTALPKVIGZCZFH-AWEZNQCLSA-N -1 3 333.403 4.365 20 0 EIADHM CSCc1cc(C(=O)Nc2cc(Cl)ccc2[O-])ccc1F ZINC000531319329 1031065317 /nfs/dbraw/zinc/06/53/17/1031065317.db2.gz ITFKTPBFEVNOAV-UHFFFAOYSA-N -1 3 325.792 4.300 20 0 EIADHM Cc1ccc2[nH]cc(CCC(=O)Nc3cc(Cl)ccc3[O-])c2c1 ZINC000531303874 1031065409 /nfs/dbraw/zinc/06/54/09/1031065409.db2.gz DODJIBIATSIQIJ-UHFFFAOYSA-N -1 3 328.799 4.407 20 0 EIADHM C[C@H](N(C)Cc1ccc(C(=O)[O-])cc1Br)C(C)(C)C ZINC000226726244 1031103209 /nfs/dbraw/zinc/10/32/09/1031103209.db2.gz CMVLNYMPZWCIBJ-JTQLQIEISA-N -1 3 328.250 4.014 20 0 EIADHM O=C(Cc1ccc([O-])c(F)c1)N(C1CC1)[C@@H]1CCCc2ccccc21 ZINC000448857276 1031148398 /nfs/dbraw/zinc/14/83/98/1031148398.db2.gz PKTGOXZFVINZDB-LJQANCHMSA-N -1 3 339.410 4.142 20 0 EIADHM O=[S@@](Cc1ncc(-c2cccc(Cl)c2)o1)c1ccc([O-])cc1 ZINC000108083114 1031286016 /nfs/dbraw/zinc/28/60/16/1031286016.db2.gz MXAAAAQMRFUJLW-JOCHJYFZSA-N -1 3 333.796 4.008 20 0 EIADHM CCCC[C@H](CC)CN1C[C@H]2C[C@@H](C1)N2C(=O)c1ccc([S-])cc1 ZINC001272016709 1031325382 /nfs/dbraw/zinc/32/53/82/1031325382.db2.gz GDUCHSUHFHFGNJ-RYQLBKOJSA-N -1 3 346.540 4.090 20 0 EIADHM Cc1nc(C(=O)[N-]c2nnc(C(C)C)s2)c(-c2ccccc2)s1 ZINC000040326569 1031458803 /nfs/dbraw/zinc/45/88/03/1031458803.db2.gz ILEKEKPEAWKXDI-UHFFFAOYSA-N -1 3 344.465 4.346 20 0 EIADHM COc1ccc2cc(NC(=O)c3cc([O-])c4ccccc4c3)ccc2n1 ZINC001143464221 1031484003 /nfs/dbraw/zinc/48/40/03/1031484003.db2.gz GTEYAWVPTQGDKN-UHFFFAOYSA-N -1 3 344.370 4.355 20 0 EIADHM CCCc1cc(=O)[n-]c(C(=Cc2c[nH]c(C(F)(F)F)c2)CC)n1 ZINC000453028933 1031521642 /nfs/dbraw/zinc/52/16/42/1031521642.db2.gz RPZFCUHKKUOSMQ-IZZDOVSWSA-N -1 3 325.334 4.020 20 0 EIADHM C[C@H](c1ccccc1)n1ccc(NC(=O)c2cc([O-])ccc2Cl)n1 ZINC000685784233 1031656708 /nfs/dbraw/zinc/65/67/08/1031656708.db2.gz UKWXAEHCRZCRNQ-GFCCVEGCSA-N -1 3 341.798 4.104 20 0 EIADHM C[C@H](c1cccs1)N(C)Cc1cccc([O-])c1Br ZINC000459304194 1031751285 /nfs/dbraw/zinc/75/12/85/1031751285.db2.gz NMMKZJOGQRJIGO-SNVBAGLBSA-N -1 3 326.259 4.409 20 0 EIADHM Cc1ccc(Cl)c([N-]S(=O)(=O)c2cccc3ccc(C)nc32)c1 ZINC000531885570 1031772593 /nfs/dbraw/zinc/77/25/93/1031772593.db2.gz XIMSRXLZBXANLS-UHFFFAOYSA-N -1 3 346.839 4.306 20 0 EIADHM CCOc1cc(CN2CC=C(C(F)(F)F)CC2)cc(Cl)c1[O-] ZINC000459358057 1031924447 /nfs/dbraw/zinc/92/44/47/1031924447.db2.gz DNFKFKACJZMOOE-UHFFFAOYSA-N -1 3 335.753 4.139 20 0 EIADHM [O-]c1cccc(CN[C@H](c2ccccc2)C2(CO)CCCC2)c1Cl ZINC000453615319 1032044985 /nfs/dbraw/zinc/04/49/85/1032044985.db2.gz NALAKDJTHVWDMN-LJQANCHMSA-N -1 3 345.870 4.429 20 0 EIADHM [O-]c1ccc(F)c(CNC[C@H](c2ccccc2)C(F)(F)F)c1F ZINC000512691660 1033713821 /nfs/dbraw/zinc/71/38/21/1033713821.db2.gz XCDOZUDGBAEJMN-GFCCVEGCSA-N -1 3 331.284 4.106 20 0 EIADHM CCCC(=O)Nc1cccc(CNCc2cccc([O-])c2Cl)c1 ZINC000645146333 1033831155 /nfs/dbraw/zinc/83/11/55/1033831155.db2.gz VPAJGPSVZZKTGM-UHFFFAOYSA-N -1 3 332.831 4.074 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2ccc(C)c(C(F)(F)F)c2)cc1 ZINC000010514285 1034613798 /nfs/dbraw/zinc/61/37/98/1034613798.db2.gz VMKNSTQDUIRXNR-UHFFFAOYSA-N -1 3 329.343 4.123 20 0 EIADHM CCC(=O)c1cccc([N-]S(=O)(=O)c2c(C)cc(C)cc2C)c1 ZINC000433598163 1034837083 /nfs/dbraw/zinc/83/70/83/1034837083.db2.gz DMCNUWXFACTZFF-UHFFFAOYSA-N -1 3 331.437 4.005 20 0 EIADHM [O-]c1ccc(F)c(CNCc2ccc(-c3ccco3)cc2F)c1F ZINC000513324678 1034878296 /nfs/dbraw/zinc/87/82/96/1034878296.db2.gz HRMFDFGGHMLFAX-UHFFFAOYSA-N -1 3 333.309 4.359 20 0 EIADHM CC(C)c1oc([C@H]2CCCN2CCCC(=O)[O-])nc1-c1ccccc1 ZINC000262183541 1034888053 /nfs/dbraw/zinc/88/80/53/1034888053.db2.gz DZJLDRBYGUTWSX-MRXNPFEDSA-N -1 3 342.439 4.467 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N(C)Cc3cc(C)cc(C)c3)nc2)n1 ZINC000433818231 1034937315 /nfs/dbraw/zinc/93/73/15/1034937315.db2.gz KNRMORULBDALEL-UHFFFAOYSA-N -1 3 348.450 4.060 20 0 EIADHM Cc1ccc2oc([N-][C@@H](c3nccn3C)c3ccc(F)cc3)nc2c1 ZINC000513639609 1035073572 /nfs/dbraw/zinc/07/35/72/1035073572.db2.gz DNJUOCLJXGWMMS-QGZVFWFLSA-N -1 3 336.370 4.210 20 0 EIADHM Cc1ccc2oc([N-][C@H](c3nccn3C)c3cccc(F)c3)nc2c1 ZINC000513650161 1035080090 /nfs/dbraw/zinc/08/00/90/1035080090.db2.gz JYRGALXUFKZJEH-KRWDZBQOSA-N -1 3 336.370 4.210 20 0 EIADHM Cc1nc([C@@H]2CCCN2C(=O)c2cc([O-])c3ccccc3c2)cs1 ZINC000280174210 1035196027 /nfs/dbraw/zinc/19/60/27/1035196027.db2.gz CVOXOOCVZDBFNB-KRWDZBQOSA-N -1 3 338.432 4.288 20 0 EIADHM CCCc1ccccc1[N-]S(=O)(=O)c1ccc(OCC)cc1C ZINC000501841495 1035705347 /nfs/dbraw/zinc/70/53/47/1035705347.db2.gz MUMCAXJPOPXPSD-UHFFFAOYSA-N -1 3 333.453 4.147 20 0 EIADHM O=C(Nc1ccccc1-c1cccs1)c1cc2c(cc1[O-])OCO2 ZINC000436753140 1035772869 /nfs/dbraw/zinc/77/28/69/1035772869.db2.gz CMDAWFSDGKPYAO-UHFFFAOYSA-N -1 3 339.372 4.102 20 0 EIADHM COc1ccc(C(=O)N2CCC[C@H]2c2cccc(Cl)c2)c([O-])c1 ZINC000195646866 1035875793 /nfs/dbraw/zinc/87/57/93/1035875793.db2.gz ZFYLXBLJHNPGCL-INIZCTEOSA-N -1 3 331.799 4.032 20 0 EIADHM Cc1cccc(C(=O)Nc2cccc(NC(=O)c3ccccc3)c2)c1[O-] ZINC000195636939 1035876350 /nfs/dbraw/zinc/87/63/50/1035876350.db2.gz BDTGCLBHYJPYAP-UHFFFAOYSA-N -1 3 346.386 4.205 20 0 EIADHM C[C@@H](CN1CCC(C(=O)[O-])(C(F)(F)F)CC1)c1cccc(Cl)c1 ZINC000905738361 1035879753 /nfs/dbraw/zinc/87/97/53/1035879753.db2.gz NCLJKTYNTXSZRA-NSHDSACASA-N -1 3 349.780 4.173 20 0 EIADHM COc1ccc(C(=O)N2CCC[C@H]2c2ccccc2Cl)c([O-])c1 ZINC000195703164 1035882171 /nfs/dbraw/zinc/88/21/71/1035882171.db2.gz HIVHWGZSJOFPFI-INIZCTEOSA-N -1 3 331.799 4.032 20 0 EIADHM COc1cc(C(=O)/C=C/c2csc(Br)c2)ccc1[O-] ZINC000045110860 1036322155 /nfs/dbraw/zinc/32/21/55/1036322155.db2.gz VRJPVFXAUMCSLJ-DUXPYHPUSA-N -1 3 339.210 4.121 20 0 EIADHM CC(C)(C)c1ccc(C=Cc2cc(=O)[n-]c(-c3ccncc3)n2)cc1 ZINC000486078270 1036466196 /nfs/dbraw/zinc/46/61/96/1036466196.db2.gz ULWGDPVWBDOACW-TWGQIWQCSA-N -1 3 331.419 4.300 20 0 EIADHM CCOc1cccc([C@@H](C)NC(=O)CCCc2ccc([O-])c(F)c2)c1 ZINC000469175038 1036545887 /nfs/dbraw/zinc/54/58/87/1036545887.db2.gz OWKUDZZDYGVURB-CQSZACIVSA-N -1 3 345.414 4.130 20 0 EIADHM CCS[C@H]1CC[C@H](N(C)C(=O)c2cc([O-])cc(C(F)(F)F)c2)C1 ZINC000598691306 1036752653 /nfs/dbraw/zinc/75/26/53/1036752653.db2.gz UHVVCASSOQZPRO-JSGCOSHPSA-N -1 3 347.402 4.157 20 0 EIADHM CC[C@H]1CCCN1Cc1nc(=O)c2c(-c3ccco3)csc2[n-]1 ZINC000590062055 1036969679 /nfs/dbraw/zinc/96/96/79/1036969679.db2.gz PWVHVSVWTIJGRS-NSHDSACASA-N -1 3 329.425 4.031 20 0 EIADHM CCC[C@H]1CCCC[C@@H]1C[N-]S(=O)(=O)c1cccc(Cl)c1F ZINC001212162413 1036977820 /nfs/dbraw/zinc/97/78/20/1036977820.db2.gz MZLIZPRWUOGVEC-QWHCGFSZSA-N -1 3 347.883 4.364 20 0 EIADHM CCCCN(C(=O)c1ccc(OC)cc1[O-])[C@H](C)c1ccc(C)o1 ZINC000642077342 1036992393 /nfs/dbraw/zinc/99/23/93/1036992393.db2.gz BQZJUXSGHDYHTG-CQSZACIVSA-N -1 3 331.412 4.306 20 0 EIADHM CCOc1cc(Cl)ccc1CNC(=O)c1cc([O-])ccc1Cl ZINC000487593142 1037160592 /nfs/dbraw/zinc/16/05/92/1037160592.db2.gz PTBDYSTXTYZLLA-UHFFFAOYSA-N -1 3 340.206 4.028 20 0 EIADHM COc1ccccc1C[C@H](C)N(C)Cc1cc(C(=O)[O-])ccc1Cl ZINC000569981444 1037361117 /nfs/dbraw/zinc/36/11/17/1037361117.db2.gz DXJKCNWRDPRRFL-ZDUSSCGKSA-N -1 3 347.842 4.110 20 0 EIADHM C[C@@H](/N=C/c1cc(Cl)ccc1[O-])c1ccc2c(c1)CCC(=O)N2 ZINC000044011460 1037425597 /nfs/dbraw/zinc/42/55/97/1037425597.db2.gz PDBQODZXWSXCBT-JZOCJUILSA-N -1 3 328.799 4.110 20 0 EIADHM Cc1cc(C)cc(-c2cc(=NC(=O)c3cccc(C(F)F)c3)[nH][n-]2)c1 ZINC000591452358 1037436637 /nfs/dbraw/zinc/43/66/37/1037436637.db2.gz WAYHRTOSKAFGTO-UHFFFAOYSA-N -1 3 341.361 4.305 20 0 EIADHM COc1ccccc1CN(Cc1cccs1)CC1(CC(=O)[O-])CC1 ZINC000573498486 1037570671 /nfs/dbraw/zinc/57/06/71/1037570671.db2.gz FWXJJCWZDQKJGF-UHFFFAOYSA-N -1 3 345.464 4.014 20 0 EIADHM Cc1cc(=O)[n-]c([C@@H](C)Sc2nccn2-c2ccc(Cl)cc2)n1 ZINC000488471075 1037621787 /nfs/dbraw/zinc/62/17/87/1037621787.db2.gz ADRWGVDLPVPKNX-LLVKDONJSA-N -1 3 346.843 4.183 20 0 EIADHM O=C([O-])c1ccc(-c2nc(CN(C3CC3)C3CCCC3)cs2)cc1 ZINC000573733448 1037683002 /nfs/dbraw/zinc/68/30/02/1037683002.db2.gz ISNOSVBZXAEHSX-UHFFFAOYSA-N -1 3 342.464 4.415 20 0 EIADHM CSc1ccc([O-])c(C(=O)N2C[C@@H](c3ccc(F)cc3)C[C@@H]2C)c1 ZINC000668944199 1037940912 /nfs/dbraw/zinc/94/09/12/1037940912.db2.gz FLPHTBUGEOYDSB-JSGCOSHPSA-N -1 3 345.439 4.271 20 0 EIADHM CC(C)(C)CC[C@@H](NCc1c(Cl)cccc1OC(F)F)C(=O)[O-] ZINC000669480353 1038024663 /nfs/dbraw/zinc/02/46/63/1038024663.db2.gz QISGICRLOGECJD-GFCCVEGCSA-N -1 3 349.805 4.311 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)c1ccccc1Nc1ccccc1 ZINC000606537582 1038153196 /nfs/dbraw/zinc/15/31/96/1038153196.db2.gz UCOCLHWJRPULSW-UHFFFAOYSA-N -1 3 336.366 4.205 20 0 EIADHM CC(C)(C)c1ccc(CCC(=O)NCc2ccc([O-])c(F)c2)cc1 ZINC000606536984 1038153420 /nfs/dbraw/zinc/15/34/20/1038153420.db2.gz OKYUZNCOMDXEOO-UHFFFAOYSA-N -1 3 329.415 4.078 20 0 EIADHM C[C@@H](C(=O)NCc1ccc([O-])c(F)c1)c1c(Cl)cccc1Cl ZINC000606537169 1038154602 /nfs/dbraw/zinc/15/46/02/1038154602.db2.gz VJVQWYRMQKASEC-SECBINFHSA-N -1 3 342.197 4.258 20 0 EIADHM O=C(Cc1ccc(Cl)s1)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000513809852 1038238191 /nfs/dbraw/zinc/23/81/91/1038238191.db2.gz QSWFKEUSTHCFBJ-UHFFFAOYSA-N -1 3 335.734 4.307 20 0 EIADHM O=S(=O)([N-][C@H](CC1CC1)c1ccccc1)c1ccc(Cl)s1 ZINC000608036801 1038431299 /nfs/dbraw/zinc/43/12/99/1038431299.db2.gz XUCSXPVSSKTXBI-CYBMUJFWSA-N -1 3 341.885 4.221 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)N1CCc2cc(Cl)ccc2C1 ZINC000480807551 1038824208 /nfs/dbraw/zinc/82/42/08/1038824208.db2.gz UMJGVAZDWMCFJU-UHFFFAOYSA-N -1 3 347.817 4.092 20 0 EIADHM CCC[C@H](CC)Sc1nc2c(cnn2-c2ccccc2)c(=O)[n-]1 ZINC000480854029 1038845565 /nfs/dbraw/zinc/84/55/65/1038845565.db2.gz RWDYDEXTFJKFQE-ZDUSSCGKSA-N -1 3 328.441 4.192 20 0 EIADHM Cc1ccc(Cc2nc(C(=O)Nc3cccc([O-])c3F)cs2)cc1 ZINC000119170143 1038867122 /nfs/dbraw/zinc/86/71/22/1038867122.db2.gz YJDGWWRWYUZTDM-UHFFFAOYSA-N -1 3 342.395 4.139 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2cccc(C)c2Cl)c(Cl)c1 ZINC000608755381 1038888389 /nfs/dbraw/zinc/88/83/89/1038888389.db2.gz UJSLCKAUDOZNQV-UHFFFAOYSA-N -1 3 330.236 4.411 20 0 EIADHM COC(=O)c1ccc(C(C)C)c(NC(=O)c2cc([O-])ccc2Cl)c1 ZINC000505086277 1038989515 /nfs/dbraw/zinc/98/95/15/1038989515.db2.gz GBQLUVMPQMKEAU-UHFFFAOYSA-N -1 3 347.798 4.208 20 0 EIADHM CSc1ccc([O-])c(C(=O)N2CC[C@@H](c3ccccc3C)C2)c1 ZINC000667828076 1039064397 /nfs/dbraw/zinc/06/43/97/1039064397.db2.gz HNNIBFRXHRBZDV-CQSZACIVSA-N -1 3 327.449 4.052 20 0 EIADHM CC(=O)c1cccc(NC(=O)Cc2coc3c2ccc(C)c3C)c1[O-] ZINC000552069062 1039090646 /nfs/dbraw/zinc/09/06/46/1039090646.db2.gz ABOCESPQAODFON-UHFFFAOYSA-N -1 3 337.375 4.139 20 0 EIADHM CC(=O)c1cccc(NC(=O)CCCc2c[nH]c3ccccc23)c1[O-] ZINC000552069436 1039095124 /nfs/dbraw/zinc/09/51/24/1039095124.db2.gz SAKWWJXLSGXJRB-UHFFFAOYSA-N -1 3 336.391 4.038 20 0 EIADHM CCCOc1ccc(C(=O)Nc2cccc([O-])c2F)c(OC(C)C)c1 ZINC000555396758 1039148893 /nfs/dbraw/zinc/14/88/93/1039148893.db2.gz RNWWTQSIOBIHRQ-UHFFFAOYSA-N -1 3 347.386 4.360 20 0 EIADHM O=C(N=c1cc(-c2ccccc2)o[n-]1)c1occc1-c1ccc(F)cc1 ZINC000505324566 1039203213 /nfs/dbraw/zinc/20/32/13/1039203213.db2.gz HZIZITVWEJAVRQ-UHFFFAOYSA-N -1 3 348.333 4.415 20 0 EIADHM Cc1oc(-c2ccsc2)nc1CC(=O)Nc1c([O-])cccc1Cl ZINC000552434677 1039509328 /nfs/dbraw/zinc/50/93/28/1039509328.db2.gz VMLANLWEYDYUIE-UHFFFAOYSA-N -1 3 348.811 4.252 20 0 EIADHM COc1ccc([O-])c(C(=O)N(CCc2ccccc2)c2ccccc2)c1 ZINC000537637738 1039523114 /nfs/dbraw/zinc/52/31/14/1039523114.db2.gz QMZKGDDANAAGDI-UHFFFAOYSA-N -1 3 347.414 4.290 20 0 EIADHM Cc1ccn(-c2ccc(NC(=O)c3cc([O-])c4ccccc4c3)cc2)n1 ZINC000552474063 1039561095 /nfs/dbraw/zinc/56/10/95/1039561095.db2.gz IRCZWHJUWMGMTI-UHFFFAOYSA-N -1 3 343.386 4.292 20 0 EIADHM CC(C)[C@@H](CNC(=O)c1cc([O-])ccc1Cl)Cc1ccccc1 ZINC000505428359 1039576538 /nfs/dbraw/zinc/57/65/38/1039576538.db2.gz RCYMXXMRXFSXRB-OAHLLOKOSA-N -1 3 331.843 4.290 20 0 EIADHM CC(C)(C)C1=CCN(Cc2nc3c4ccccc4oc3c(=O)[n-]2)CC1 ZINC000534658408 1039653835 /nfs/dbraw/zinc/65/38/35/1039653835.db2.gz JZOZNDRQFZGIGR-UHFFFAOYSA-N -1 3 337.423 4.260 20 0 EIADHM CCOc1ccc(F)c([N-]C(=O)c2cc(F)c(F)cc2F)c1F ZINC000534769553 1039773951 /nfs/dbraw/zinc/77/39/51/1039773951.db2.gz XGOXOZGOOPWDFD-UHFFFAOYSA-N -1 3 331.240 4.033 20 0 EIADHM CCC[C@H](CC)S(=O)(=O)[N-]c1cnn(-c2cc(C)ccc2C)c1C ZINC000555879632 1039779539 /nfs/dbraw/zinc/77/95/39/1039779539.db2.gz PQXGOYYPJNYCQV-INIZCTEOSA-N -1 3 349.500 4.118 20 0 EIADHM C[C@H](CC(=O)c1ccccc1F)C(=O)Nc1ccc(Cl)cc1[O-] ZINC000535421243 1040252583 /nfs/dbraw/zinc/25/25/83/1040252583.db2.gz VQLMBJAAKGCQMW-SNVBAGLBSA-N -1 3 335.762 4.032 20 0 EIADHM COc1cc(C(=O)Nc2cc(F)ccc2[O-])ccc1OCCC(C)C ZINC000535420762 1040253144 /nfs/dbraw/zinc/25/31/44/1040253144.db2.gz KNTIIIUDSMQKBE-UHFFFAOYSA-N -1 3 347.386 4.217 20 0 EIADHM O=C(Nc1ccc(Br)cc1[O-])c1cc2cc(F)ccc2[nH]1 ZINC000514820245 1040256810 /nfs/dbraw/zinc/25/68/10/1040256810.db2.gz BGQYRECQXWTBEG-UHFFFAOYSA-N -1 3 349.159 4.027 20 0 EIADHM O=C(O[C@H](c1ncccn1)C1CCCC1)c1cc2ccsc2[n-]1 ZINC000761395575 1040482205 /nfs/dbraw/zinc/48/22/05/1040482205.db2.gz PJCJFITUWGYHRI-AWEZNQCLSA-N -1 3 327.409 4.108 20 0 EIADHM CC(C)Oc1ccc(C=C(Cc2ccccc2)c2nccc(=O)[n-]2)cc1 ZINC000477415708 1040492191 /nfs/dbraw/zinc/49/21/91/1040492191.db2.gz SSPWBKNFCWMQFI-XDJHFCHBSA-N -1 3 346.430 4.340 20 0 EIADHM Cc1ccc(CCC(=O)Nc2ccc(Br)cc2[O-])cc1 ZINC000515205862 1040551379 /nfs/dbraw/zinc/55/13/79/1040551379.db2.gz JIFXOILSCBIAOS-UHFFFAOYSA-N -1 3 334.213 4.034 20 0 EIADHM O=C(Nc1ccc(Br)cc1[O-])c1ccc(Cl)cc1 ZINC000515206278 1040555329 /nfs/dbraw/zinc/55/53/29/1040555329.db2.gz DMWNZUFPLNVKRU-UHFFFAOYSA-N -1 3 326.577 4.060 20 0 EIADHM O=C(NC[C@@H]1CCC[C@H](C(F)(F)F)C1)c1cc([O-])ccc1Cl ZINC000551770261 1040571540 /nfs/dbraw/zinc/57/15/40/1040571540.db2.gz HKFBDAWYOJMAJS-ZJUUUORDSA-N -1 3 335.753 4.144 20 0 EIADHM Cc1noc(C)c1[N-]C(=O)c1ccc(Br)c(Cl)c1F ZINC000435751029 1040584712 /nfs/dbraw/zinc/58/47/12/1040584712.db2.gz DODKXPMCZZXCNL-UHFFFAOYSA-N -1 3 347.571 4.099 20 0 EIADHM CCc1cc(=O)[n-]c(CN[C@@H](C)c2ccc(Cl)c3ccccc32)n1 ZINC000462466802 1040624882 /nfs/dbraw/zinc/62/48/82/1040624882.db2.gz XPYZMGHNYHXPTH-LBPRGKRZSA-N -1 3 341.842 4.402 20 0 EIADHM Cc1csc(CSc2nnc([N-]c3ccccc3F)s2)n1 ZINC000086987418 1040661188 /nfs/dbraw/zinc/66/11/88/1040661188.db2.gz ZPCHINLBHHYKLO-UHFFFAOYSA-N -1 3 338.458 4.478 20 0 EIADHM CC[C@@H](CN(CC)C(=O)NCc1ccc([O-])c(F)c1)c1ccccc1 ZINC000483103432 1040694085 /nfs/dbraw/zinc/69/40/85/1040694085.db2.gz SEDMGXLKWCYBET-INIZCTEOSA-N -1 3 344.430 4.257 20 0 EIADHM CCOc1ccc([N-]S(=O)(=O)c2cccc(C(C)C)c2)c(C)c1 ZINC000460828922 1040980003 /nfs/dbraw/zinc/98/00/03/1040980003.db2.gz OUJLDOONEPJKAY-UHFFFAOYSA-N -1 3 333.453 4.318 20 0 EIADHM COc1cccc(C(=O)N2CC3(CCCC3)c3c2cccc3F)c1[O-] ZINC000194724758 1041091085 /nfs/dbraw/zinc/09/10/85/1041091085.db2.gz PONHBAJQAURSMG-UHFFFAOYSA-N -1 3 341.382 4.012 20 0 EIADHM C[C@@H]1[C@@H](C(=O)[O-])CCN1[C@@H](c1ccc(F)cc1)c1ccc(Cl)cc1 ZINC000903904328 1041225646 /nfs/dbraw/zinc/22/56/46/1041225646.db2.gz JRBYZXGPFWEVOY-OCBCSQNSSA-N -1 3 347.817 4.364 20 0 EIADHM O=C(CCc1ccc2[nH]ccc2c1)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000538282758 1041239984 /nfs/dbraw/zinc/23/99/84/1041239984.db2.gz MGKRJCFJYDSZPF-UHFFFAOYSA-N -1 3 348.324 4.464 20 0 EIADHM C[C@@H]1[C@@H](C(=O)[N-][C@H](c2ccc(F)c(Cl)c2)C(F)(F)F)C1(F)F ZINC000436445919 1041246852 /nfs/dbraw/zinc/24/68/52/1041246852.db2.gz CVJWZQKRELIQNZ-ZVCUKBJDSA-N -1 3 345.670 4.100 20 0 EIADHM Cc1cccc(Cl)c1[N-]S(=O)(=O)c1c(C)ccc2cccnc21 ZINC000461134992 1041259118 /nfs/dbraw/zinc/25/91/18/1041259118.db2.gz QXNRFFSXWFSFSU-UHFFFAOYSA-N -1 3 346.839 4.306 20 0 EIADHM C=Cc1ccc(S(=O)(=O)[N-]c2cc(C(F)(F)F)ccc2F)cc1 ZINC000436476962 1041276643 /nfs/dbraw/zinc/27/66/43/1041276643.db2.gz KQFMOKYPHSGBNM-UHFFFAOYSA-N -1 3 345.317 4.288 20 0 EIADHM CC(C)(C)c1csc(CN[C@@H](CCc2ccccc2)CC(=O)[O-])n1 ZINC000904040134 1041292885 /nfs/dbraw/zinc/29/28/85/1041292885.db2.gz KYAFKHTWTGKGPP-HNNXBMFYSA-N -1 3 346.496 4.006 20 0 EIADHM CCOc1ccc(-c2noc(-c3cc(OC)ccc3[O-])n2)cc1Cl ZINC000436522914 1041304589 /nfs/dbraw/zinc/30/45/89/1041304589.db2.gz OISBKWXKTIKDEO-UHFFFAOYSA-N -1 3 346.770 4.170 20 0 EIADHM COc1ccc(C(=O)N2CCCC[C@H]2CCc2ccccc2)c([O-])c1 ZINC000436523027 1041305613 /nfs/dbraw/zinc/30/56/13/1041305613.db2.gz YPVATRKNSZSAHE-KRWDZBQOSA-N -1 3 339.435 4.028 20 0 EIADHM Cc1ccc(C(=O)Nc2cc(NC(=O)C(C)C)ccc2C)c([O-])c1C ZINC000436527689 1041310346 /nfs/dbraw/zinc/31/03/46/1041310346.db2.gz UVIMJWWKOIFKMT-UHFFFAOYSA-N -1 3 340.423 4.164 20 0 EIADHM COc1ccccc1[C@@H]1CCN(C(=O)c2ccc(C(C)C)cc2[O-])C1 ZINC000436528883 1041312054 /nfs/dbraw/zinc/31/20/54/1041312054.db2.gz MSYYVKJVYNTPGQ-MRXNPFEDSA-N -1 3 339.435 4.154 20 0 EIADHM O=C(c1cc(CCc2ccccc2)ccc1[O-])N(CC(F)F)C1CC1 ZINC000436552521 1041327820 /nfs/dbraw/zinc/32/78/20/1041327820.db2.gz DNFWTIZMPGKELO-UHFFFAOYSA-N -1 3 345.389 4.047 20 0 EIADHM COc1ccc(C(=O)N(C)C2c3ccccc3-c3ccccc32)c([O-])c1 ZINC000436574059 1041339602 /nfs/dbraw/zinc/33/96/02/1041339602.db2.gz KCPDKELIMPBKLR-UHFFFAOYSA-N -1 3 345.398 4.243 20 0 EIADHM CC(=O)c1ccc(C(=O)N2CCC[C@H]2c2ccccc2Cl)cc1[O-] ZINC000436599589 1041358052 /nfs/dbraw/zinc/35/80/52/1041358052.db2.gz DTWQWGDFBSDGSS-KRWDZBQOSA-N -1 3 343.810 4.226 20 0 EIADHM COc1ccc(C(=O)N2CCCC[C@H]2c2ccc(C)cc2)c([O-])c1 ZINC000436581472 1041361295 /nfs/dbraw/zinc/36/12/95/1041361295.db2.gz FOQONRNMRZWUAJ-SFHVURJKSA-N -1 3 325.408 4.077 20 0 EIADHM CC[C@@H]1CN(C(=O)c2ccc(OC)cc2[O-])CC[C@@H]1c1ccccc1 ZINC000436587259 1041363909 /nfs/dbraw/zinc/36/39/09/1041363909.db2.gz OWPSDGPSSMESEO-QAPCUYQASA-N -1 3 339.435 4.057 20 0 EIADHM CCCCCN(Cc1ccc(F)cc1)C(=O)c1ccc(O)cc1[O-] ZINC000436615692 1041375021 /nfs/dbraw/zinc/37/50/21/1041375021.db2.gz BMXJWTBREPYZPB-UHFFFAOYSA-N -1 3 331.387 4.070 20 0 EIADHM Cc1ccc(C(=O)N2CC[C@@](F)(c3cccc(Cl)c3)C2)c([O-])c1 ZINC000436627662 1041378946 /nfs/dbraw/zinc/37/89/46/1041378946.db2.gz URSPMLGPIOYWQT-SFHVURJKSA-N -1 3 333.790 4.065 20 0 EIADHM CCCCN(Cc1ccccc1Cl)C(=O)c1ccc(O)cc1[O-] ZINC000436734333 1041446198 /nfs/dbraw/zinc/44/61/98/1041446198.db2.gz CTTGGDPZDMBNNU-UHFFFAOYSA-N -1 3 333.815 4.194 20 0 EIADHM CC(C)c1ccc(C(=O)N(C)CCCOc2ccccc2)c([O-])c1 ZINC000436756347 1041455656 /nfs/dbraw/zinc/45/56/56/1041455656.db2.gz CJXSNHSWYWKFRM-UHFFFAOYSA-N -1 3 327.424 4.057 20 0 EIADHM CC(C)c1ccc(C(=O)N[C@H](c2ccccc2)[C@H]2CCOC2)c([O-])c1 ZINC000436762283 1041459631 /nfs/dbraw/zinc/45/96/31/1041459631.db2.gz BVQAHWPLDGNNLC-FXAWDEMLSA-N -1 3 339.435 4.023 20 0 EIADHM CCN(C(=O)c1ccc(C)cc1[O-])c1cccc(Br)c1 ZINC000436752720 1041464917 /nfs/dbraw/zinc/46/49/17/1041464917.db2.gz ATLUYIMOUJPQFH-UHFFFAOYSA-N -1 3 334.213 4.130 20 0 EIADHM Cc1ccc(C(=O)Nc2cccc(COCC3CC3)c2)c([O-])c1C ZINC000436818315 1041489171 /nfs/dbraw/zinc/48/91/71/1041489171.db2.gz UQAXRGFIZFXOCQ-UHFFFAOYSA-N -1 3 325.408 4.188 20 0 EIADHM CCCN(C(=O)c1ccc(CC)cc1[O-])[C@@H]1CCCc2cccnc21 ZINC000436834788 1041499097 /nfs/dbraw/zinc/49/90/97/1041499097.db2.gz ATAUWAZYZGKMBL-GOSISDBHSA-N -1 3 338.451 4.279 20 0 EIADHM CCc1ccc(-c2nc(-c3ccc4cc(OC)ccc4n3)no2)c([O-])c1 ZINC000436837981 1041502516 /nfs/dbraw/zinc/50/25/16/1041502516.db2.gz IZHXZNBOKGHNGZ-UHFFFAOYSA-N -1 3 347.374 4.228 20 0 EIADHM CCc1ccc(-c2nc(Cc3c(C)[nH]c4ccccc43)no2)c([O-])c1 ZINC000436854158 1041503360 /nfs/dbraw/zinc/50/33/60/1041503360.db2.gz FPNJEZKUFCZDAR-UHFFFAOYSA-N -1 3 333.391 4.385 20 0 EIADHM CC(=O)c1ccc(C(=O)N(C)Cc2ccc3ccccc3c2)cc1[O-] ZINC000436857105 1041505731 /nfs/dbraw/zinc/50/57/31/1041505731.db2.gz CFDSLUPLNZHPIA-UHFFFAOYSA-N -1 3 333.387 4.020 20 0 EIADHM O=C(c1cc(CCc2ccccc2)ccc1[O-])N1CC[C@H]2CCC[C@H]21 ZINC000436838579 1041507084 /nfs/dbraw/zinc/50/70/84/1041507084.db2.gz ROROKRMZUFQPSM-UYAOXDASSA-N -1 3 335.447 4.192 20 0 EIADHM CCc1ccc(-c2nc(COc3ccc(Cl)cc3)no2)c([O-])c1 ZINC000436847293 1041515205 /nfs/dbraw/zinc/51/52/05/1041515205.db2.gz PUOXZFIEDYATDV-UHFFFAOYSA-N -1 3 330.771 4.237 20 0 EIADHM CCc1ccc(-c2nc(-c3cnc(-c4ccccc4)nc3)no2)c([O-])c1 ZINC000436864008 1041522769 /nfs/dbraw/zinc/52/27/69/1041522769.db2.gz MKLNVMKYBFYHDF-UHFFFAOYSA-N -1 3 344.374 4.129 20 0 EIADHM CCCCc1nc2ccc(NC(=O)c3ccc([O-])cc3F)cc2[nH]1 ZINC000436880321 1041537589 /nfs/dbraw/zinc/53/75/89/1041537589.db2.gz NMXUJBOHPBCKKB-UHFFFAOYSA-N -1 3 327.359 4.003 20 0 EIADHM COc1ccc([O-])c(-c2nc(Cc3cccc4ccccc43)no2)c1 ZINC000436890465 1041545740 /nfs/dbraw/zinc/54/57/40/1041545740.db2.gz BSULEKAYYCWTOW-UHFFFAOYSA-N -1 3 332.359 4.195 20 0 EIADHM Cc1ccnc(-c2noc(-c3cc(Cc4ccccc4)ccc3[O-])n2)c1 ZINC000436891650 1041545913 /nfs/dbraw/zinc/54/59/13/1041545913.db2.gz YBCIMBNSOWZJOE-UHFFFAOYSA-N -1 3 343.386 4.403 20 0 EIADHM CC(C)c1ccc(-c2nc(-c3ccc4c(c3)OCCO4)no2)c([O-])c1 ZINC000436902540 1041546834 /nfs/dbraw/zinc/54/68/34/1041546834.db2.gz JXFSMSYFLXFXII-UHFFFAOYSA-N -1 3 338.363 4.004 20 0 EIADHM O=C(c1cc(CCc2ccccc2)ccc1[O-])N1CC[C@@H](C2CC2)C1 ZINC000436915329 1041556330 /nfs/dbraw/zinc/55/63/30/1041556330.db2.gz NTHALMGEXDEMQO-LJQANCHMSA-N -1 3 335.447 4.050 20 0 EIADHM COc1cccc(-c2nc(CCCc3ccccc3Cl)no2)c1[O-] ZINC000436926904 1041562139 /nfs/dbraw/zinc/56/21/39/1041562139.db2.gz MDOALAUZAQKDTL-UHFFFAOYSA-N -1 3 344.798 4.280 20 0 EIADHM CC[C@@H](C)Oc1ccc(-c2noc(-c3cccc(OC)c3[O-])n2)cc1 ZINC000436936328 1041565833 /nfs/dbraw/zinc/56/58/33/1041565833.db2.gz BFYUXXIJAOVBLZ-GFCCVEGCSA-N -1 3 340.379 4.295 20 0 EIADHM Cc1cccc(C(=O)N2CC3(CCCC3)c3c2cccc3F)c1[O-] ZINC000436968295 1041572302 /nfs/dbraw/zinc/57/23/02/1041572302.db2.gz ZXGIFLVOYDBLLR-UHFFFAOYSA-N -1 3 325.383 4.312 20 0 EIADHM Cc1ccc(C(=O)N2CC=C(c3cccc4ccccc43)C2)c([O-])c1 ZINC000436961386 1041576504 /nfs/dbraw/zinc/57/65/04/1041576504.db2.gz SYIAXXMDVOTLDO-UHFFFAOYSA-N -1 3 329.399 4.393 20 0 EIADHM CCCCOc1ccc(C(=O)N(C)CCc2ccc(F)cc2)c([O-])c1 ZINC000436992515 1041584863 /nfs/dbraw/zinc/58/48/63/1041584863.db2.gz ZPJWAKPCFNOPJG-UHFFFAOYSA-N -1 3 345.414 4.025 20 0 EIADHM CC(C)c1ccc(-c2nc(COc3cccc(F)c3)no2)c([O-])c1 ZINC000437001814 1041587350 /nfs/dbraw/zinc/58/73/50/1041587350.db2.gz XARMLHDLFYDJGF-UHFFFAOYSA-N -1 3 328.343 4.284 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)N[C@@H]1C[C@H]1c1ccc(Cl)cc1 ZINC000437385011 1041784234 /nfs/dbraw/zinc/78/42/34/1041784234.db2.gz OOQRIZUTLAIWAY-DOTOQJQBSA-N -1 3 347.817 4.180 20 0 EIADHM O=C(Nc1ncccc1[O-])c1cccc(F)c1Sc1ccccc1 ZINC000541237704 1041860413 /nfs/dbraw/zinc/86/04/13/1041860413.db2.gz KDWUOHJJZKFSPI-UHFFFAOYSA-N -1 3 340.379 4.330 20 0 EIADHM [O-]C(=CC(F)(F)F)Nc1cc(C2CC2)nc2ccc(Cl)cc21 ZINC000464394818 1041984132 /nfs/dbraw/zinc/98/41/32/1041984132.db2.gz BFJTUQZVEQGEKM-UHFFFAOYSA-N -1 3 328.721 4.078 20 0 EIADHM O=C(CCCCC(=O)c1ccccc1)Nc1c([O-])cccc1Cl ZINC000560820581 1042181414 /nfs/dbraw/zinc/18/14/14/1042181414.db2.gz YXWGXZDNKJLOMG-UHFFFAOYSA-N -1 3 331.799 4.427 20 0 EIADHM CC(=O)c1ccc(C(=O)Nc2ccc(C(C)(C)C)cc2[O-])c(F)c1 ZINC000506237960 1042184956 /nfs/dbraw/zinc/18/49/56/1042184956.db2.gz JZMURLHNMCRSRZ-UHFFFAOYSA-N -1 3 329.371 4.284 20 0 EIADHM COc1cccc(C(=O)Nc2nc(-c3ccccc3C)cs2)c1[O-] ZINC000302946290 1042198769 /nfs/dbraw/zinc/19/87/69/1042198769.db2.gz MRXLVQDKWVLXAV-UHFFFAOYSA-N -1 3 340.404 4.085 20 0 EIADHM COc1cccc(C(=O)Nc2nc(-c3ccc(C)s3)cs2)c1[O-] ZINC000303003087 1042236247 /nfs/dbraw/zinc/23/62/47/1042236247.db2.gz YTNHCDZVUNMMDZ-UHFFFAOYSA-N -1 3 346.433 4.147 20 0 EIADHM Cc1ccc2nc(C)c(C(=O)Nc3cc(Cl)ccc3[O-])cc2c1 ZINC000518051679 1042322889 /nfs/dbraw/zinc/32/28/89/1042322889.db2.gz LPUZAGYQUMBAJT-UHFFFAOYSA-N -1 3 326.783 4.463 20 0 EIADHM COc1ccc2nc(C)cc(C(=O)Nc3cc(Cl)ccc3[O-])c2c1 ZINC000439100467 1042501743 /nfs/dbraw/zinc/50/17/43/1042501743.db2.gz WHBLQEBZKAZBFW-UHFFFAOYSA-N -1 3 342.782 4.163 20 0 EIADHM CC(C)(C)[C@@H](NCc1nc(=O)c2sccc2[n-]1)c1cccc(F)c1 ZINC000299075799 1042577401 /nfs/dbraw/zinc/57/74/01/1042577401.db2.gz TVUIYKWLYUVJFA-INIZCTEOSA-N -1 3 345.443 4.413 20 0 EIADHM O=c1nc(CN2CC[C@H]3CCC[C@@H]32)[n-]c2scc(-c3ccco3)c21 ZINC000426461857 1042729660 /nfs/dbraw/zinc/72/96/60/1042729660.db2.gz PSZHHFTXWZSTAI-YPMHNXCESA-N -1 3 341.436 4.031 20 0 EIADHM COc1ccc(-c2ncc(C(=O)[N-]c3c(F)cccc3F)s2)cc1 ZINC000175036899 1042731765 /nfs/dbraw/zinc/73/17/65/1042731765.db2.gz CIPOJTLSSIMZOQ-UHFFFAOYSA-N -1 3 346.358 4.349 20 0 EIADHM Cc1onc(-c2ccncc2)c1C(=O)[N-]c1cc(Cl)cc(F)c1F ZINC000441569051 1042889424 /nfs/dbraw/zinc/88/94/24/1042889424.db2.gz HPQNYUTWEBMBLC-UHFFFAOYSA-N -1 3 349.724 4.229 20 0 EIADHM COc1ccccc1[C@H](NCc1cc([O-])cc(F)c1)c1ccccc1 ZINC000185526009 1043194047 /nfs/dbraw/zinc/19/40/47/1043194047.db2.gz DNDCRFUYFSDCLI-OAQYLSRUSA-N -1 3 337.394 4.419 20 0 EIADHM O=C(NCCc1nc2ccccc2s1)c1cc([O-])c2ccccc2c1 ZINC000525924619 1043234015 /nfs/dbraw/zinc/23/40/15/1043234015.db2.gz WOXBLSNQWZQSEI-UHFFFAOYSA-N -1 3 348.427 4.128 20 0 EIADHM Cc1ccc(-n2cccn2)cc1NC(=O)c1cc([O-])c2ccccc2c1 ZINC000525942651 1043236342 /nfs/dbraw/zinc/23/63/42/1043236342.db2.gz DDTHAKQCWPOANN-UHFFFAOYSA-N -1 3 343.386 4.292 20 0 EIADHM Cc1ccccc1[C@@H]1CN(C(=O)c2cc([O-])c3ccccc3c2)CCO1 ZINC000525934167 1043237381 /nfs/dbraw/zinc/23/73/81/1043237381.db2.gz LPSPBZKPWDLNJY-NRFANRHFSA-N -1 3 347.414 4.068 20 0 EIADHM C[C@@H]1[C@@H](C(F)(F)F)CCCN1C(=O)c1cc([O-])c2ccccc2c1 ZINC000526919318 1043245220 /nfs/dbraw/zinc/24/52/20/1043245220.db2.gz MITLKYZLRHXBNO-ABAIWWIYSA-N -1 3 337.341 4.348 20 0 EIADHM C[C@H]([C@@H]1Cc2ccccc2O1)N(C)C(=O)c1cc([O-])c2ccccc2c1 ZINC000527166891 1043252988 /nfs/dbraw/zinc/25/29/88/1043252988.db2.gz PBBMWNLZFJPOOL-SZNDQCEHSA-N -1 3 347.414 4.010 20 0 EIADHM C[C@@H]([C@H]1Cc2ccccc2O1)N(C)C(=O)c1cc([O-])c2ccccc2c1 ZINC000527166884 1043253701 /nfs/dbraw/zinc/25/37/01/1043253701.db2.gz PBBMWNLZFJPOOL-LHSJRXKWSA-N -1 3 347.414 4.010 20 0 EIADHM CCC(CC)[C@@H]1C[C@@H](NC(=O)c2cc([O-])c3ccccc3c2)CCO1 ZINC000527170424 1043253836 /nfs/dbraw/zinc/25/38/36/1043253836.db2.gz IWXDPLAFDMQCQV-PXNSSMCTSA-N -1 3 341.451 4.259 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)C1(c2cccc(Cl)c2)CCCC1 ZINC000427941108 1043268030 /nfs/dbraw/zinc/26/80/30/1043268030.db2.gz NPYVQCKJNDCZHY-UHFFFAOYSA-N -1 3 347.817 4.313 20 0 EIADHM O=C([N-]c1nc2c(ccc3c2CCCC3)s1)c1ocnc1C(F)F ZINC000625609171 1043277051 /nfs/dbraw/zinc/27/70/51/1043277051.db2.gz OIZJUQQOXPJOLI-UHFFFAOYSA-N -1 3 349.362 4.353 20 0 EIADHM CCc1ccccc1S(=O)(=O)[N-]c1c(F)cccc1NC(C)C ZINC000187584493 1043362589 /nfs/dbraw/zinc/36/25/89/1043362589.db2.gz QPXHAACXZJSNNC-UHFFFAOYSA-N -1 3 336.432 4.009 20 0 EIADHM Cc1cc(Nc2cc(F)cc(F)c2[O-])nc(C)c1Br ZINC001212478089 1043406309 /nfs/dbraw/zinc/40/63/09/1043406309.db2.gz UFKWJJDTIJWAFR-UHFFFAOYSA-N -1 3 329.144 4.188 20 0 EIADHM CC(C)[C@@]1(C(=O)[O-])CCN(Cc2nc(C3CCCCC3)cs2)C1 ZINC000521257054 1043672357 /nfs/dbraw/zinc/67/23/57/1043672357.db2.gz CMNAVRKWGOMCKT-GOSISDBHSA-N -1 3 336.501 4.124 20 0 EIADHM Cc1ccc(-c2nsc([N-]C(=O)c3csc(C4CC4)n3)n2)s1 ZINC000066412850 1043687967 /nfs/dbraw/zinc/68/79/67/1043687967.db2.gz IVXPMPDFPUTJND-UHFFFAOYSA-N -1 3 348.478 4.161 20 0 EIADHM CC(=O)c1cccc(NC(=O)COc2cc(C)ccc2C(C)C)c1[O-] ZINC000521305643 1043701327 /nfs/dbraw/zinc/70/13/27/1043701327.db2.gz VWZQLSMZSQUDRN-UHFFFAOYSA-N -1 3 341.407 4.044 20 0 EIADHM Cc1csc(C(=O)Nc2cc(Cl)ccc2[O-])c1Br ZINC000190900284 1043746802 /nfs/dbraw/zinc/74/68/02/1043746802.db2.gz FCTJZBKXBSJLNX-UHFFFAOYSA-N -1 3 346.633 4.430 20 0 EIADHM CCCc1c(C(=O)Nc2cccc([O-])c2F)cnn1C1CCCC1 ZINC000543311564 1044325509 /nfs/dbraw/zinc/32/55/09/1044325509.db2.gz MOZJMDWTCSYDQE-UHFFFAOYSA-N -1 3 331.391 4.048 20 0 EIADHM Cc1ccc([O-])c(C(=O)Nc2cc(C)c(Br)c(F)c2)c1 ZINC001299309708 1044353018 /nfs/dbraw/zinc/35/30/18/1044353018.db2.gz PQHFRASCPRMKNN-UHFFFAOYSA-N -1 3 338.176 4.163 20 0 EIADHM Cc1ccc(Cl)c([N-]S(=O)(=O)c2cc(C)cc3cccnc32)c1 ZINC000675549397 1044381197 /nfs/dbraw/zinc/38/11/97/1044381197.db2.gz KRHCCHFDCMTDPZ-UHFFFAOYSA-N -1 3 346.839 4.306 20 0 EIADHM O=C(N[C@@H]1CCC(F)(F)C1)c1cc(Oc2ccccc2)ccc1[O-] ZINC000675708764 1044444192 /nfs/dbraw/zinc/44/41/92/1044444192.db2.gz INGGBSBSCKPLNO-GFCCVEGCSA-N -1 3 333.334 4.102 20 0 EIADHM COc1ccccc1[C@H]([N-]c1nc2cc(C)ccc2o1)c1nccn1C ZINC000734141046 1044500178 /nfs/dbraw/zinc/50/01/78/1044500178.db2.gz CDNYOPJMDMKMSO-SFHVURJKSA-N -1 3 348.406 4.080 20 0 EIADHM CC(C)=CCOc1cccc(C(=O)Nc2cccc(C(C)=O)c2[O-])c1 ZINC000673526931 1044584051 /nfs/dbraw/zinc/58/40/51/1044584051.db2.gz CTTITTPJERXMDV-UHFFFAOYSA-N -1 3 339.391 4.192 20 0 EIADHM COc1ccc([O-])c(C(=O)Nc2nc(C)c(-c3ccccc3)s2)c1 ZINC000914735903 1044719125 /nfs/dbraw/zinc/71/91/25/1044719125.db2.gz YOTMZCRUDRKVOH-UHFFFAOYSA-N -1 3 340.404 4.085 20 0 EIADHM CC(C)Cn1ncc(NC(=O)c2cc([O-])ccc2Cl)c1C(C)C ZINC000495145664 1044722173 /nfs/dbraw/zinc/72/21/73/1044722173.db2.gz VPLKULPFTUTFMZ-UHFFFAOYSA-N -1 3 335.835 4.274 20 0 EIADHM Cc1ccc(CSc2nnc([N-]c3ccccc3F)s2)nc1 ZINC000676408133 1044733527 /nfs/dbraw/zinc/73/35/27/1044733527.db2.gz OPGLCYPSWOSPFB-UHFFFAOYSA-N -1 3 332.429 4.417 20 0 EIADHM CC(C)CCN(CCC(C)C)Cn1[n-]c(-c2ccccn2)nc1=S ZINC000735296455 1044786517 /nfs/dbraw/zinc/78/65/17/1044786517.db2.gz URIZNWIEAYURBC-UHFFFAOYSA-N -1 3 347.532 4.354 20 0 EIADHM CCCN(CC1CCCCC1)Cn1[n-]c(-c2ccccn2)nc1=S ZINC000735296946 1044787354 /nfs/dbraw/zinc/78/73/54/1044787354.db2.gz FZKQYTSYSGZORX-UHFFFAOYSA-N -1 3 345.516 4.252 20 0 EIADHM Cc1cc(=O)[n-]c([C@H](C)Sc2nccn2-c2cccc(Cl)c2)n1 ZINC000469804288 1044816990 /nfs/dbraw/zinc/81/69/90/1044816990.db2.gz MCOGFNFZBALWFR-NSHDSACASA-N -1 3 346.843 4.183 20 0 EIADHM CC(C)Oc1cc(F)ccc1NC(=O)CCCc1ccc([O-])c(F)c1 ZINC000469808112 1044842425 /nfs/dbraw/zinc/84/24/25/1044842425.db2.gz JTSAJCJEYXMDPP-UHFFFAOYSA-N -1 3 349.377 4.419 20 0 EIADHM O=C(OCc1cc(F)cc2cccnc21)c1cc(Cl)c(Cl)[n-]1 ZINC000914895255 1044847776 /nfs/dbraw/zinc/84/77/76/1044847776.db2.gz ADHYRFYRGHCIJO-UHFFFAOYSA-N -1 3 339.153 4.366 20 0 EIADHM O=C(COC(=O)c1cc2ccsc2[n-]1)c1ccc2ccccc2c1 ZINC000914890148 1044852102 /nfs/dbraw/zinc/85/21/02/1044852102.db2.gz CRRXQVDDFWVJOQ-UHFFFAOYSA-N -1 3 335.384 4.422 20 0 EIADHM CCCCOc1ccc(CN[C@@H](CC(=O)[O-])c2cccs2)cc1 ZINC000319708833 1045088248 /nfs/dbraw/zinc/08/82/48/1045088248.db2.gz NWBLSWSHSLOZDI-INIZCTEOSA-N -1 3 333.453 4.233 20 0 EIADHM Cc1cc(=O)[n-]c(-c2ccc(NC(=O)C[C@H](C)CC(C)(C)C)cc2)n1 ZINC000625168129 1045134674 /nfs/dbraw/zinc/13/46/74/1045134674.db2.gz UGKBZPPIRXPERV-ZDUSSCGKSA-N -1 3 341.455 4.146 20 0 EIADHM CC(C)(C(=O)[O-])[C@@H]1CCCN(Cc2cccc(Cl)c2Cl)C1 ZINC000135042264 1045195840 /nfs/dbraw/zinc/19/58/40/1045195840.db2.gz SNIAOHACGSCVEF-GFCCVEGCSA-N -1 3 330.255 4.316 20 0 EIADHM CC(=O)c1cc(F)c([N-]C(=O)c2cc(Cl)cc(Cl)n2)c(F)c1 ZINC000762466069 1045252625 /nfs/dbraw/zinc/25/26/25/1045252625.db2.gz KFPDAPGJLWRNKB-UHFFFAOYSA-N -1 3 345.132 4.122 20 0 EIADHM Cc1ccc(Br)cc1NC(=O)c1cc([O-])ccc1Cl ZINC000235779621 1045341750 /nfs/dbraw/zinc/34/17/50/1045341750.db2.gz XLMMUNLCNHCQCU-UHFFFAOYSA-N -1 3 340.604 4.369 20 0 EIADHM O=C(Nc1ccc(Br)c(F)c1)c1cc([O-])ccc1Cl ZINC000236557603 1045359388 /nfs/dbraw/zinc/35/93/88/1045359388.db2.gz BLUNDIBVKUSRFA-UHFFFAOYSA-N -1 3 344.567 4.200 20 0 EIADHM O=C(NCCc1ccc(Cl)cc1Cl)c1cc([O-])ccc1Cl ZINC000236613194 1045359966 /nfs/dbraw/zinc/35/99/66/1045359966.db2.gz IVKCBSOMEWGDHL-UHFFFAOYSA-N -1 3 344.625 4.325 20 0 EIADHM Cc1ccccc1[C@H](C)NCc1cc(=O)oc2cc([O-])c(Cl)cc12 ZINC000915870799 1045522548 /nfs/dbraw/zinc/52/25/48/1045522548.db2.gz OWWNWQKHIWZPBJ-LBPRGKRZSA-N -1 3 343.810 4.311 20 0 EIADHM O=C(OCc1ncc(-c2cccc(F)c2)o1)c1cc2ccsc2[n-]1 ZINC000746929089 1045546434 /nfs/dbraw/zinc/54/64/34/1045546434.db2.gz VDYFBARJEJMUEH-UHFFFAOYSA-N -1 3 342.351 4.381 20 0 EIADHM O=C(Cc1ccc(-n2cccc2)cc1)Nc1ccc(Cl)cc1[O-] ZINC000533615363 1045656209 /nfs/dbraw/zinc/65/62/09/1045656209.db2.gz KMZHYAOAGHCQNN-UHFFFAOYSA-N -1 3 326.783 4.018 20 0 EIADHM C[C@H](C1CC1)n1nccc1NC(=O)c1cc2sccc2c([O-])c1 ZINC000791345846 1045725052 /nfs/dbraw/zinc/72/50/52/1045725052.db2.gz DIUYYXMKIKWBGY-SNVBAGLBSA-N -1 3 327.409 4.027 20 0 EIADHM C[C@H](CCc1ccc(O)cc1)NC(=O)c1cc2sccc2c([O-])c1 ZINC000791386973 1045729064 /nfs/dbraw/zinc/72/90/64/1045729064.db2.gz RLRQUVFSUYIRSS-GFCCVEGCSA-N -1 3 341.432 4.064 20 0 EIADHM O=C(NC1(c2ccccc2F)CC1)c1cc2sccc2c([O-])c1 ZINC000791364032 1045730805 /nfs/dbraw/zinc/73/08/05/1045730805.db2.gz LGTOGVFBVTXMLA-UHFFFAOYSA-N -1 3 327.380 4.165 20 0 EIADHM Cc1cc(=O)[n-]c(CSCc2coc(-c3cccc(Cl)c3)n2)n1 ZINC000763210054 1045750797 /nfs/dbraw/zinc/75/07/97/1045750797.db2.gz UKWZOVFXPOUYDW-UHFFFAOYSA-N -1 3 347.827 4.232 20 0 EIADHM CCOC(=O)c1c(Cl)cccc1Nc1ccc([O-])c(F)c1F ZINC001212010892 1045832535 /nfs/dbraw/zinc/83/25/35/1045832535.db2.gz FRHWKNIYCFZTQE-UHFFFAOYSA-N -1 3 327.714 4.244 20 0 EIADHM COc1c(F)cc(Br)cc1Nc1ccc([O-])c(F)c1F ZINC001212013772 1045834852 /nfs/dbraw/zinc/83/48/52/1045834852.db2.gz JDPDPQIXNCJQPT-UHFFFAOYSA-N -1 3 348.118 4.324 20 0 EIADHM COCc1ccc(Br)c(Nc2ccc([O-])c(F)c2F)c1 ZINC001212016153 1045840030 /nfs/dbraw/zinc/84/00/30/1045840030.db2.gz AIIZSFLLDOPMHI-UHFFFAOYSA-N -1 3 344.155 4.323 20 0 EIADHM CCOC(=O)c1coc2cc(Nc3ccc([O-])c(F)c3F)ccc12 ZINC001212016599 1045841414 /nfs/dbraw/zinc/84/14/14/1045841414.db2.gz XRQHTQLFHPFQJV-UHFFFAOYSA-N -1 3 333.290 4.337 20 0 EIADHM COc1ccc(C)cc1[N-]S(=O)(=O)/C=C\c1cccc(Cl)c1 ZINC000768865070 1045850105 /nfs/dbraw/zinc/85/01/05/1045850105.db2.gz YPTBLYQIUAYIEF-HJWRWDBZSA-N -1 3 337.828 4.070 20 0 EIADHM CC(=O)Nc1c(C)ccc(NC(=O)c2cc([O-])c3ccccc3c2)c1C ZINC000792077383 1045854773 /nfs/dbraw/zinc/85/47/73/1045854773.db2.gz ZTOOKTKZZLWELL-UHFFFAOYSA-N -1 3 348.402 4.373 20 0 EIADHM Cc1cn(-c2ccccc2)nc1NC(=O)c1cc([O-])c2ccccc2c1 ZINC000792146630 1045865042 /nfs/dbraw/zinc/86/50/42/1045865042.db2.gz GMCBDYDUCLEMKS-UHFFFAOYSA-N -1 3 343.386 4.292 20 0 EIADHM C[C@@H]1CC[C@@H](C(F)(F)F)CN1C(=O)c1cc([O-])c2ccccc2c1 ZINC000792308385 1045887788 /nfs/dbraw/zinc/88/77/88/1045887788.db2.gz XPCYPNLPXMAAKT-BXUZGUMPSA-N -1 3 337.341 4.348 20 0 EIADHM O=C([O-])[C@@H]1CCN(Cc2cc(Cl)ccc2Cl)[C@H]2CCC[C@H]21 ZINC000629374931 1045899470 /nfs/dbraw/zinc/89/94/70/1045899470.db2.gz XEHUBNISLKSXSJ-GUTXKFCHSA-N -1 3 328.239 4.069 20 0 EIADHM CCN(c1ccc([N-]S(=O)(=O)c2cccc(C)c2)cc1)C(C)C ZINC000916108633 1045908551 /nfs/dbraw/zinc/90/85/51/1045908551.db2.gz DLJLCMBAIKDZDP-UHFFFAOYSA-N -1 3 332.469 4.031 20 0 EIADHM Cc1cc(Br)cc2c1NC(=O)/C2=C/c1ccc([O-])c(F)c1 ZINC000769618035 1046036030 /nfs/dbraw/zinc/03/60/30/1046036030.db2.gz VOUVEQKUKAYNET-LFYBBSHMSA-N -1 3 348.171 4.095 20 0 EIADHM C[C@@H]1CCCN(Cc2nc(=O)c3c(-c4ccco4)csc3[n-]2)[C@H]1C ZINC000253544558 1046058003 /nfs/dbraw/zinc/05/80/03/1046058003.db2.gz PFVQJOHOISCXRL-NEPJUHHUSA-N -1 3 343.452 4.277 20 0 EIADHM CCc1cc(=O)[n-]c(CS[C@H](C)c2ncc(-c3ccccc3)o2)n1 ZINC000125641230 1046322073 /nfs/dbraw/zinc/32/20/73/1046322073.db2.gz BGYGTSIWIQLQBX-GFCCVEGCSA-N -1 3 341.436 4.394 20 0 EIADHM CCCCCC[C@H](C)CC(=O)Nc1nc2c(cccc2C(=O)OC)[n-]1 ZINC001127418019 1046339346 /nfs/dbraw/zinc/33/93/46/1046339346.db2.gz FCCOCDJHWSNZEP-ZDUSSCGKSA-N -1 3 345.443 4.285 20 0 EIADHM Cc1coc(-c2cccc([N-]S(=O)(=O)c3ccc(C)cc3C)c2)n1 ZINC000126806052 1046556323 /nfs/dbraw/zinc/55/63/23/1046556323.db2.gz GPRJFTKIJLYQJD-UHFFFAOYSA-N -1 3 342.420 4.068 20 0 EIADHM [O-]c1cccc(CNC2(c3ccccc3F)CC2)c1Br ZINC000459443653 1046675410 /nfs/dbraw/zinc/67/54/10/1046675410.db2.gz LBCJGUZWHYHKEF-UHFFFAOYSA-N -1 3 336.204 4.073 20 0 EIADHM Cc1cc([C@H](C)NCc2cccc([O-])c2Br)ccc1F ZINC000459438348 1046684779 /nfs/dbraw/zinc/68/47/79/1046684779.db2.gz LIGLSXHRXALUFS-NSHDSACASA-N -1 3 338.220 4.453 20 0 EIADHM CCCCn1ncc(NCc2cc(Cl)c([O-])c(OCC)c2)c1C ZINC000459455485 1046692038 /nfs/dbraw/zinc/69/20/38/1046692038.db2.gz DCMQTMAIDIPCBH-UHFFFAOYSA-N -1 3 337.851 4.361 20 0 EIADHM C[C@H](c1ccccc1)N(C)Cc1cc(=O)oc2cc([O-])c(Cl)cc12 ZINC000917180202 1046801305 /nfs/dbraw/zinc/80/13/05/1046801305.db2.gz ORZDCXHFTJSARI-GFCCVEGCSA-N -1 3 343.810 4.345 20 0 EIADHM O=C(OCc1cncc(OCc2ccccc2)c1)c1cc2occc2[n-]1 ZINC000786030816 1046803634 /nfs/dbraw/zinc/80/36/34/1046803634.db2.gz DNNRDJVQMXWEEP-UHFFFAOYSA-N -1 3 348.358 4.092 20 0 EIADHM O=C(OCc1ccc(Cl)c2cccnc12)c1cc2occc2[n-]1 ZINC000786032202 1046803650 /nfs/dbraw/zinc/80/36/50/1046803650.db2.gz UHKFXUXWWPLCIC-UHFFFAOYSA-N -1 3 326.739 4.320 20 0 EIADHM Cc1ccc(-c2nc(COC(=O)c3cc4occc4[n-]3)cs2)o1 ZINC000786031689 1046803903 /nfs/dbraw/zinc/80/39/03/1046803903.db2.gz OFYLOUPVPLNRRO-UHFFFAOYSA-N -1 3 328.349 4.143 20 0 EIADHM Cc1ccc([C@@H]([N-]C(=O)C(F)F)c2ccc(F)cc2Cl)cc1 ZINC000787337637 1047000589 /nfs/dbraw/zinc/00/05/89/1047000589.db2.gz NJVVKOBJKXJKFK-CQSZACIVSA-N -1 3 327.733 4.258 20 0 EIADHM CCCCOc1ccc(C(=O)Nc2cccc([O-])c2F)cc1OCC ZINC000128718963 1047037137 /nfs/dbraw/zinc/03/71/37/1047037137.db2.gz KEIZEVGROOTFRA-UHFFFAOYSA-N -1 3 347.386 4.361 20 0 EIADHM O=C(CCCc1ncc(-c2ccccc2)o1)Nc1cccc([O-])c1F ZINC000129086696 1047287388 /nfs/dbraw/zinc/28/73/88/1047287388.db2.gz CXIQGGLXGLFWSU-UHFFFAOYSA-N -1 3 340.354 4.148 20 0 EIADHM O=C(Nc1cccc([O-])c1F)c1ncoc1-c1ccccc1Cl ZINC000129163759 1047322106 /nfs/dbraw/zinc/32/21/06/1047322106.db2.gz KMHXXXPPHALVRZ-UHFFFAOYSA-N -1 3 332.718 4.092 20 0 EIADHM O=C(/C=C/c1cc(Br)cs1)Nc1cccc([O-])c1F ZINC000129170287 1047324537 /nfs/dbraw/zinc/32/45/37/1047324537.db2.gz JKHGJAKFGCDDQO-SNAWJCMRSA-N -1 3 342.189 4.007 20 0 EIADHM O=C(Nc1cccc([O-])c1F)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1 ZINC000129262219 1047342413 /nfs/dbraw/zinc/34/24/13/1047342413.db2.gz SMTMGXIKERQVKC-NWDGAFQWSA-N -1 3 339.288 4.292 20 0 EIADHM CS[C@H](C(=O)Nc1ccc([O-])c(C(F)(F)F)c1)c1ccccc1 ZINC000476157797 1047390474 /nfs/dbraw/zinc/39/04/74/1047390474.db2.gz NFISFDGTAASKHJ-AWEZNQCLSA-N -1 3 341.354 4.454 20 0 EIADHM CC(C)OCc1c2ccccc2oc1C(=O)Nc1cccc([O-])c1F ZINC000129457601 1047396298 /nfs/dbraw/zinc/39/62/98/1047396298.db2.gz UVRVADVJELAHRB-UHFFFAOYSA-N -1 3 343.354 4.455 20 0 EIADHM O=C(Nc1ccc([O-])c(C(F)(F)F)c1)c1cc(-c2ccccc2)on1 ZINC000476182924 1047407647 /nfs/dbraw/zinc/40/76/47/1047407647.db2.gz YVCGHGBIAFWERF-UHFFFAOYSA-N -1 3 348.280 4.318 20 0 EIADHM COc1cc(NC(=O)c2cc([O-])ccc2Cl)cc(OC)c1C(C)C ZINC000498440278 1047667139 /nfs/dbraw/zinc/66/71/39/1047667139.db2.gz KAGKKSAGRXUBIJ-UHFFFAOYSA-N -1 3 349.814 4.439 20 0 EIADHM CSc1ccc(NC(=O)c2c[n-]c3ccccc3c2=O)cc1Cl ZINC000083014892 1047811321 /nfs/dbraw/zinc/81/13/21/1047811321.db2.gz NKIWEQRFLOCYOI-UHFFFAOYSA-N -1 3 344.823 4.156 20 0 EIADHM Cc1ccc(Cl)cc1S(=O)(=O)[N-]c1ccc(OC(C)C)cc1 ZINC000071977255 1047819733 /nfs/dbraw/zinc/81/97/33/1047819733.db2.gz ZBGPKKSCOOJADE-UHFFFAOYSA-N -1 3 339.844 4.236 20 0 EIADHM CCCN(C(=O)c1ccc(CC)cc1[O-])[C@H]1C[C@@H](OCC)C1(C)C ZINC001136849022 1047852366 /nfs/dbraw/zinc/85/23/66/1047852366.db2.gz WDZSEOSMVOJXSZ-ZWKOTPCHSA-N -1 3 333.472 4.010 20 0 EIADHM Cc1cc(C)cc(CCNC(=O)c2cc3sccc3c([O-])c2)c1 ZINC001136869724 1047865662 /nfs/dbraw/zinc/86/56/62/1047865662.db2.gz UVRVLVUJDFSGBQ-UHFFFAOYSA-N -1 3 325.433 4.196 20 0 EIADHM CC(=O)c1ccc([C@H](C)Nc2[n-]c(=O)c(Cl)cc2Cl)cc1 ZINC001171054523 1047866111 /nfs/dbraw/zinc/86/61/11/1047866111.db2.gz QWJJKBVWDAKSMF-QMMMGPOBSA-N -1 3 325.195 4.470 20 0 EIADHM C[C@@H](OC(=O)c1cc2ccsc2[n-]1)C(=O)C1(c2ccccc2)CC1 ZINC000808494466 1047969620 /nfs/dbraw/zinc/96/96/20/1047969620.db2.gz ZWGJDUNPOUSOFG-GFCCVEGCSA-N -1 3 339.416 4.076 20 0 EIADHM [O-]c1ccc(F)c(CNc2cnn(Cc3ccc(Cl)cc3)c2)c1F ZINC000556833731 1048046132 /nfs/dbraw/zinc/04/61/32/1048046132.db2.gz SGWAJZRJLHTHOA-UHFFFAOYSA-N -1 3 349.768 4.181 20 0 EIADHM CCc1ccc([C@@H]2C[C@H](C)CCN2C(=O)c2ccc(OC)cc2[O-])o1 ZINC001137026845 1048078752 /nfs/dbraw/zinc/07/87/52/1048078752.db2.gz UWRJMUZVNKWSNP-DYVFJYSZSA-N -1 3 343.423 4.170 20 0 EIADHM CC(=O)c1cccc(NC(=O)[C@H](C)Oc2cccc3ccccc32)c1[O-] ZINC000556893705 1048136059 /nfs/dbraw/zinc/13/60/59/1048136059.db2.gz YTGRXZQHXHKVKR-AWEZNQCLSA-N -1 3 349.386 4.154 20 0 EIADHM CC(=O)c1cccc(NC(=O)c2csc3c2CC[C@@H](C)C3)c1[O-] ZINC000556893735 1048137174 /nfs/dbraw/zinc/13/71/74/1048137174.db2.gz ZYUQRFBMZCDCLC-SNVBAGLBSA-N -1 3 329.421 4.033 20 0 EIADHM CCC[C@H](Cc1ccccc1)NC(=O)c1cc(SC)ccc1[O-] ZINC001143696658 1048158439 /nfs/dbraw/zinc/15/84/39/1048158439.db2.gz MIFCRKJWIOOUMZ-OAHLLOKOSA-N -1 3 329.465 4.255 20 0 EIADHM COc1ccc2cc([C@H](C)C(=O)Nc3ccc(F)c([O-])c3)ccc2c1 ZINC001143744366 1048180814 /nfs/dbraw/zinc/18/08/14/1048180814.db2.gz OJAQMRFJANCVQH-LBPRGKRZSA-N -1 3 339.366 4.435 20 0 EIADHM C[C@@H](NCc1cccc([O-])c1Cl)c1ccc(N2CCCC2=O)cc1 ZINC000815118084 1048332521 /nfs/dbraw/zinc/33/25/21/1048332521.db2.gz FPPZFODOKGNBMN-CYBMUJFWSA-N -1 3 344.842 4.023 20 0 EIADHM O=C(Cc1cnc2ccccc2c1)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000132717256 1048464444 /nfs/dbraw/zinc/46/44/44/1048464444.db2.gz ISPXIPQQJRUAAD-UHFFFAOYSA-N -1 3 346.308 4.140 20 0 EIADHM [O-]C(=NO[C@@H]1CCCCO1)Nc1cc(Cl)c(Cl)c(Cl)c1 ZINC000844786987 1048500358 /nfs/dbraw/zinc/50/03/58/1048500358.db2.gz PKQJITDZKAVCFT-SNVBAGLBSA-N -1 3 339.606 4.227 20 0 EIADHM O=C([N-]O[C@@H]1CCCCO1)Nc1cc(Cl)c(Cl)c(Cl)c1 ZINC000844786987 1048500384 /nfs/dbraw/zinc/50/03/84/1048500384.db2.gz PKQJITDZKAVCFT-SNVBAGLBSA-N -1 3 339.606 4.227 20 0 EIADHM O=C([N-]Cc1csc(C(F)(F)F)c1)C(F)(F)Cc1ccccc1 ZINC001132063639 1048636969 /nfs/dbraw/zinc/63/69/69/1048636969.db2.gz SXEKMMSVSHVQNS-UHFFFAOYSA-N -1 3 349.324 4.261 20 0 EIADHM COc1ccccc1S(=O)(=O)[N-]c1cc(Cl)c(C)cc1Cl ZINC000133583574 1048742789 /nfs/dbraw/zinc/74/27/89/1048742789.db2.gz URQHCEUDJQDFAT-UHFFFAOYSA-N -1 3 346.235 4.111 20 0 EIADHM CCC/C(C)=C\C(=O)O[C@H](C)c1nc(=O)c2c(C)c(C)sc2[n-]1 ZINC000920694119 1048749656 /nfs/dbraw/zinc/74/96/56/1048749656.db2.gz UTCMBFHLMPVUCV-TYBABMIJSA-N -1 3 334.441 4.364 20 0 EIADHM Cc1nsc(C)c1COC(=O)c1cc2cc(Cl)sc2[n-]1 ZINC000816339769 1048765697 /nfs/dbraw/zinc/76/56/97/1048765697.db2.gz KJDIJMADQSHKKC-UHFFFAOYSA-N -1 3 326.830 4.313 20 0 EIADHM [O-]c1ccc(F)c(CN2CCC[C@@H]2c2ccc(F)c(F)c2)c1F ZINC000816511823 1048823263 /nfs/dbraw/zinc/82/32/63/1048823263.db2.gz LUSSMVWNEBCOCY-OAHLLOKOSA-N -1 3 325.305 4.286 20 0 EIADHM Cc1ccc(C(=O)CCC(=O)Nc2c([O-])cccc2Cl)cc1C ZINC000816768886 1048856898 /nfs/dbraw/zinc/85/68/98/1048856898.db2.gz LPKGREHGLJYKKX-UHFFFAOYSA-N -1 3 331.799 4.264 20 0 EIADHM COC(=O)c1ccc(C(=O)Nc2ccc(-c3ccccc3)c(C)c2)[n-]1 ZINC000816775308 1048859354 /nfs/dbraw/zinc/85/93/54/1048859354.db2.gz QZVAXPGIANWVAP-UHFFFAOYSA-N -1 3 334.375 4.029 20 0 EIADHM O=C(Nc1cccc(-c2cnco2)c1)c1cc([O-])cc(C(F)(F)F)c1 ZINC000816891840 1048874656 /nfs/dbraw/zinc/87/46/56/1048874656.db2.gz FWCAROKCWXDUCG-UHFFFAOYSA-N -1 3 348.280 4.318 20 0 EIADHM O=C([N-]c1nc2c(s1)CCCCC2)c1snc(Cl)c1Cl ZINC000816906214 1048879813 /nfs/dbraw/zinc/87/98/13/1048879813.db2.gz BMJKTDPFZINRCT-UHFFFAOYSA-N -1 3 348.280 4.428 20 0 EIADHM CC[C@H](C)CO[N-]C(=O)[C@@H]1CC=CC[C@@H]1c1nc2ccccc2s1 ZINC000816976803 1048884326 /nfs/dbraw/zinc/88/43/26/1048884326.db2.gz KFQDPQMXXURSSI-ZNMIVQPWSA-N -1 3 344.480 4.440 20 0 EIADHM CC(C)c1ccc(C(=O)N(Cc2ccccc2F)C2CC2)c([O-])c1 ZINC001135822709 1048905744 /nfs/dbraw/zinc/90/57/44/1048905744.db2.gz AJEWPAXPZYIVFI-UHFFFAOYSA-N -1 3 327.399 4.460 20 0 EIADHM CCCCN(C(=O)c1nnc2ccccc2c1[O-])[C@H]1CCC[C@H](C)C1 ZINC000818801927 1049207154 /nfs/dbraw/zinc/20/71/54/1049207154.db2.gz HTNHMYVTZMREEK-GJZGRUSLSA-N -1 3 341.455 4.156 20 0 EIADHM Cc1ccc([C@H]2CCC[C@H]2N(C)C(=O)Cc2ccc([O-])c(F)c2)cc1 ZINC001147971447 1049245151 /nfs/dbraw/zinc/24/51/51/1049245151.db2.gz XXNHCWFTIKNDJN-IEBWSBKVSA-N -1 3 341.426 4.177 20 0 EIADHM CC(=O)c1ccc(C(=O)Nc2cccc(Oc3ccccn3)c2)cc1[O-] ZINC001148105688 1049263138 /nfs/dbraw/zinc/26/31/38/1049263138.db2.gz VDOFGWKSZKKQLG-UHFFFAOYSA-N -1 3 348.358 4.034 20 0 EIADHM COc1cccc(C(=O)Nc2ccc(-c3cccc(O)c3)cc2)c1[O-] ZINC001148207483 1049280838 /nfs/dbraw/zinc/28/08/38/1049280838.db2.gz CZXCBBJAGKDUCG-UHFFFAOYSA-N -1 3 335.359 4.026 20 0 EIADHM O=C(Nc1ccc(Br)cc1[O-])c1ccc2c(c1)CCC=C2 ZINC001136219033 1049320432 /nfs/dbraw/zinc/32/04/32/1049320432.db2.gz JNYQERKTRPKQCS-UHFFFAOYSA-N -1 3 344.208 4.366 20 0 EIADHM CC(=O)c1cc(C(=O)N[C@@H](CC(C)C)c2ccccc2)ccc1[O-] ZINC001148668345 1049356553 /nfs/dbraw/zinc/35/65/53/1049356553.db2.gz ALTPJXHHTDHRQC-SFHVURJKSA-N -1 3 325.408 4.112 20 0 EIADHM CC(=O)c1cc(C(=O)N[C@H](CC(C)C)c2ccccc2)ccc1[O-] ZINC001148668344 1049357545 /nfs/dbraw/zinc/35/75/45/1049357545.db2.gz ALTPJXHHTDHRQC-GOSISDBHSA-N -1 3 325.408 4.112 20 0 EIADHM O=C(NCCc1nsc2ccccc12)c1cc([O-])c2ccccc2c1 ZINC001148894839 1049393698 /nfs/dbraw/zinc/39/36/98/1049393698.db2.gz MWEVJOODIASTGM-UHFFFAOYSA-N -1 3 348.427 4.128 20 0 EIADHM Cc1onc(-c2ccccc2)c1C(=O)[N-]c1cc(F)cc(F)c1F ZINC000348139700 1049460777 /nfs/dbraw/zinc/46/07/77/1049460777.db2.gz DZQNYHLWUSHJBX-UHFFFAOYSA-N -1 3 332.281 4.320 20 0 EIADHM CCc1ccc([O-])c(C(=O)N2CCC[C@H]2Cc2ccccc2Cl)c1 ZINC001136408425 1049592175 /nfs/dbraw/zinc/59/21/75/1049592175.db2.gz NCECWMFLHRPCST-INIZCTEOSA-N -1 3 343.854 4.455 20 0 EIADHM C[C@@H](CC(=O)Nc1cc(Cl)ccc1[O-])C(=O)c1cccc(F)c1 ZINC000080655148 1049593034 /nfs/dbraw/zinc/59/30/34/1049593034.db2.gz GYNFPNQPHJRNDB-JTQLQIEISA-N -1 3 335.762 4.032 20 0 EIADHM Cc1sc2[n-]c([C@H](C)OC(=O)C(F)=C3CCC3)nc(=O)c2c1C ZINC000821380365 1049625725 /nfs/dbraw/zinc/62/57/25/1049625725.db2.gz PJMTUNVFXCPHPK-QMMMGPOBSA-N -1 3 336.388 4.025 20 0 EIADHM Fc1cccc(C2(Nc3ccccc3-c3nnn[n-]3)CCCCC2)c1 ZINC001171409966 1049641984 /nfs/dbraw/zinc/64/19/84/1049641984.db2.gz ZRQKGXLUBXHCMQ-UHFFFAOYSA-N -1 3 337.402 4.277 20 0 EIADHM Fc1cccc(C2(Nc3ccccc3-c3nn[n-]n3)CCCCC2)c1 ZINC001171409966 1049641991 /nfs/dbraw/zinc/64/19/91/1049641991.db2.gz ZRQKGXLUBXHCMQ-UHFFFAOYSA-N -1 3 337.402 4.277 20 0 EIADHM CCOC(=O)C[C@H]1CC[C@H](Nc2[n-]c(=O)c(Cl)cc2Cl)CC1 ZINC001170694031 1049651116 /nfs/dbraw/zinc/65/11/16/1049651116.db2.gz VURGENOBCPAUMI-MGCOHNPYSA-N -1 3 347.242 4.018 20 0 EIADHM O=C(Cc1ccc([O-])c(F)c1)Nc1ccc(N2CCCCCC2)cc1 ZINC000822225559 1049742959 /nfs/dbraw/zinc/74/29/59/1049742959.db2.gz IFHZJLAAYYHXBR-UHFFFAOYSA-N -1 3 342.414 4.093 20 0 EIADHM O=c1cc(Nc2ccc(C(F)(F)F)cc2O)[n-]n1-c1ccccc1 ZINC001212632397 1049833163 /nfs/dbraw/zinc/83/31/63/1049833163.db2.gz XOMAGIQAJJQFFL-UHFFFAOYSA-N -1 3 335.285 4.046 20 0 EIADHM CC(C)OC(=O)[C@@H](OC(=O)c1cc2ccsc2[n-]1)c1ccccc1 ZINC000813966186 1049844461 /nfs/dbraw/zinc/84/44/61/1049844461.db2.gz CQMCTSLLKGFLAK-HNNXBMFYSA-N -1 3 343.404 4.079 20 0 EIADHM COc1cccc(SC)c1[N-]C(=O)c1noc2c1CC(C)(C)CC2 ZINC000823695839 1049869043 /nfs/dbraw/zinc/86/90/43/1049869043.db2.gz PECSSSPOZLVTJH-UHFFFAOYSA-N -1 3 346.452 4.172 20 0 EIADHM Cc1cccc([O-])c1C(=O)NCC(C)(C)c1ccc(F)cc1Cl ZINC001136789477 1049883218 /nfs/dbraw/zinc/88/32/18/1049883218.db2.gz UVHBAQRCCJZNOG-UHFFFAOYSA-N -1 3 335.806 4.201 20 0 EIADHM Cc1cc(=O)[n-]c(C(C)(C)NC(=O)C=C2CCC(C(C)(C)C)CC2)n1 ZINC000824154908 1049903006 /nfs/dbraw/zinc/90/30/06/1049903006.db2.gz UZGYBNMSMYCFAD-UHFFFAOYSA-N -1 3 345.487 4.005 20 0 EIADHM Cc1cccc(C)c1[C@H]1CCCN1C(=O)Cc1ccc([O-])c(F)c1 ZINC000617173984 1049962210 /nfs/dbraw/zinc/96/22/10/1049962210.db2.gz PQSSJOCGHHOVGU-QGZVFWFLSA-N -1 3 327.399 4.054 20 0 EIADHM O=C([N-]c1cc(-c2cccs2)no1)Nc1c(F)cc(F)cc1F ZINC001186021178 1050216163 /nfs/dbraw/zinc/21/61/63/1050216163.db2.gz UMJCPQNPFIUFRB-UHFFFAOYSA-N -1 3 339.298 4.464 20 0 EIADHM [O-]c1cccc(Nc2ccc(Cn3ccnc3)cc2)c1Br ZINC001212700214 1050265962 /nfs/dbraw/zinc/26/59/62/1050265962.db2.gz ZJZFXEWKZZDVRD-UHFFFAOYSA-N -1 3 344.212 4.143 20 0 EIADHM CC(=O)c1cc(F)cc(CN[C@H](C)c2c(F)cccc2Cl)c1[O-] ZINC000181762669 1050328204 /nfs/dbraw/zinc/32/82/04/1050328204.db2.gz FRSKNFDWQLMDTP-SECBINFHSA-N -1 3 339.769 4.377 20 0 EIADHM O=C(NCC[C@@H]1C[C@H]1C1CC1)c1cc(Cc2ccccc2)ccc1[O-] ZINC001177929915 1050336912 /nfs/dbraw/zinc/33/69/12/1050336912.db2.gz OREJOHCBLUVPBL-MOPGFXCFSA-N -1 3 335.447 4.149 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-][C@@H]2CCC[C@@H]2CCC(C)C)c(F)c1F ZINC001186523876 1050351647 /nfs/dbraw/zinc/35/16/47/1050351647.db2.gz DUQUSSZFXYSGRG-ZIAGYGMSSA-N -1 3 345.455 4.156 20 0 EIADHM CCc1ccccc1NC(=O)Nc1cc(Br)ccc1[O-] ZINC001187636589 1050584494 /nfs/dbraw/zinc/58/44/94/1050584494.db2.gz DYIQKNXZBPXBFG-UHFFFAOYSA-N -1 3 335.201 4.361 20 0 EIADHM Cc1ccc(NC(=O)Nc2cc(Br)ccc2[O-])cc1F ZINC001187985687 1050664097 /nfs/dbraw/zinc/66/40/97/1050664097.db2.gz JUOMXKHPEVTMOM-UHFFFAOYSA-N -1 3 339.164 4.246 20 0 EIADHM Fc1cc(CSc2nnc([N-]c3ccccc3F)s2)ccn1 ZINC001188114944 1050702756 /nfs/dbraw/zinc/70/27/56/1050702756.db2.gz QOQBQMXSYTYUBP-UHFFFAOYSA-N -1 3 336.392 4.247 20 0 EIADHM CC(=O)c1ccc(NC(=O)c2c(C)ccc(C(C)C)c2[O-])c(F)c1 ZINC001188181771 1050717534 /nfs/dbraw/zinc/71/75/34/1050717534.db2.gz OTIOZIXPEYWLPI-UHFFFAOYSA-N -1 3 329.371 4.418 20 0 EIADHM Cc1ccc(C(=O)Nc2cc(F)ccc2N2CCC(C)CC2)c([O-])c1 ZINC001179608859 1050730380 /nfs/dbraw/zinc/73/03/80/1050730380.db2.gz FTJRHZRQVWDCOY-UHFFFAOYSA-N -1 3 342.414 4.328 20 0 EIADHM COCc1ccccc1Nc1cc(Br)cc(F)c1[O-] ZINC001174106406 1050732376 /nfs/dbraw/zinc/73/23/76/1050732376.db2.gz ZUQAPXAMHKZGTG-UHFFFAOYSA-N -1 3 326.165 4.184 20 0 EIADHM COc1ccc(NC(=O)[N-]c2cc(-c3ccccc3)no2)c(OC)c1 ZINC001188510372 1050790424 /nfs/dbraw/zinc/79/04/24/1050790424.db2.gz QXZUTWBBEFNVGU-UHFFFAOYSA-N -1 3 339.351 4.003 20 0 EIADHM Cc1cccc([O-])c1C(=O)NC/C(=C/F)CCc1ccc(F)cc1 ZINC001188659232 1050814474 /nfs/dbraw/zinc/81/44/74/1050814474.db2.gz JDYXTCVAFITDMG-RVDMUPIBSA-N -1 3 331.362 4.056 20 0 EIADHM O=C(/C=C/c1cc(F)c(F)cc1F)Nc1cc([O-])cc(Cl)c1 ZINC001179885213 1050817246 /nfs/dbraw/zinc/81/72/46/1050817246.db2.gz ZVEBRHDBKYKJBF-OWOJBTEDSA-N -1 3 327.689 4.115 20 0 EIADHM Cc1ccc(Cl)cc1CNC(=O)c1cc2sccc2c([O-])c1 ZINC001179943277 1050826435 /nfs/dbraw/zinc/82/64/35/1050826435.db2.gz IDBRONJKTDVBBF-UHFFFAOYSA-N -1 3 331.824 4.499 20 0 EIADHM C[C@@H]1c2cc(F)cc(F)c2CCN1Cc1c(F)ccc([O-])c1F ZINC001180111443 1050888518 /nfs/dbraw/zinc/88/85/18/1050888518.db2.gz BGXSUQHVIAVYQA-SECBINFHSA-N -1 3 325.305 4.068 20 0 EIADHM Cn1nc(C(F)(F)F)cc1Nc1cc(Cl)c([O-])cc1Cl ZINC001174325605 1050891995 /nfs/dbraw/zinc/89/19/95/1050891995.db2.gz GUCXLWLHFORHJR-UHFFFAOYSA-N -1 3 326.105 4.195 20 0 EIADHM O=C(CCc1ccc(Cl)c(F)c1)Nc1cc(Cl)ccc1[O-] ZINC001151754286 1050942829 /nfs/dbraw/zinc/94/28/29/1050942829.db2.gz VZNFUYLXGIFEDS-UHFFFAOYSA-N -1 3 328.170 4.409 20 0 EIADHM CC(C)n1cnc2cc(Nc3ccc(-n4ccc(=O)[n-]4)cc3)ccc21 ZINC001174385710 1050949799 /nfs/dbraw/zinc/94/97/99/1050949799.db2.gz VCLSVFUGZIIGIU-UHFFFAOYSA-N -1 3 333.395 4.252 20 0 EIADHM O=S(=O)(Cc1cccc(F)c1F)[N-]c1cc2cccccc-2c1 ZINC001189425141 1050988316 /nfs/dbraw/zinc/98/83/16/1050988316.db2.gz BLNYWHYDCWCSAI-UHFFFAOYSA-N -1 3 333.359 4.012 20 0 EIADHM CC(C)c1cccc(F)c1[N-]S(=O)(=O)Cc1cccc(F)c1F ZINC001189469723 1050990355 /nfs/dbraw/zinc/99/03/55/1050990355.db2.gz XRXKHNDUCXXXRI-UHFFFAOYSA-N -1 3 343.370 4.169 20 0 EIADHM [O-]c1cccc(Nc2ccc(N3CCCC3)cc2)c1Br ZINC001174529819 1051025197 /nfs/dbraw/zinc/02/51/97/1051025197.db2.gz ZARAWWUEURSGRB-UHFFFAOYSA-N -1 3 333.229 4.499 20 0 EIADHM O=C(NCc1ccc(Cl)cc1Cl)Nc1ccc(F)c([O-])c1 ZINC001190093695 1051112068 /nfs/dbraw/zinc/11/20/68/1051112068.db2.gz XQBFXAVLVKAPSW-UHFFFAOYSA-N -1 3 329.158 4.160 20 0 EIADHM O=C(Cn1ccc2ccc(Cl)cc21)Nc1cc([O-])cc(Cl)c1 ZINC001180972915 1051123751 /nfs/dbraw/zinc/12/37/51/1051123751.db2.gz BEVPRMUHEMGQTR-UHFFFAOYSA-N -1 3 335.190 4.292 20 0 EIADHM O=C(NCc1ncccc1[O-])C(C1CCCCC1)C1CCCCC1 ZINC001180983076 1051131835 /nfs/dbraw/zinc/13/18/35/1051131835.db2.gz IRNRBFGQFZMBBF-UHFFFAOYSA-N -1 3 330.472 4.180 20 0 EIADHM COc1ccc(C(F)(F)F)cc1Nc1cc(=O)n(-c2ccccc2)[n-]1 ZINC001174776969 1051168008 /nfs/dbraw/zinc/16/80/08/1051168008.db2.gz ZYSRWDXOQZCXSP-UHFFFAOYSA-N -1 3 349.312 4.349 20 0 EIADHM O=S(=O)([N-]c1cccc(Cl)c1F)c1ccc(C2CC2)cc1 ZINC001190499513 1051193327 /nfs/dbraw/zinc/19/33/27/1051193327.db2.gz BIZOAYCNRWPHKC-UHFFFAOYSA-N -1 3 325.792 4.157 20 0 EIADHM COc1cccc(Cl)c1[N-]S(=O)(=O)c1ccc(C2CC2)cc1 ZINC001190506867 1051198192 /nfs/dbraw/zinc/19/81/92/1051198192.db2.gz NSPILGZQYLGUFW-UHFFFAOYSA-N -1 3 337.828 4.027 20 0 EIADHM O=C(Nc1ccc(Cl)cc1[O-])c1ccccc1Br ZINC000153583251 1051199841 /nfs/dbraw/zinc/19/98/41/1051199841.db2.gz ZUPVYGSACUSKCO-UHFFFAOYSA-N -1 3 326.577 4.060 20 0 EIADHM O=C(Cc1cccc2cccnc21)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000153702586 1051217584 /nfs/dbraw/zinc/21/75/84/1051217584.db2.gz HPHNMMCCABNRAT-UHFFFAOYSA-N -1 3 346.308 4.140 20 0 EIADHM O=S(=O)([N-]c1c(Cl)cccc1-c1ccccc1)c1ccncc1 ZINC001190897579 1051302345 /nfs/dbraw/zinc/30/23/45/1051302345.db2.gz GRMQKBCFFMPDKA-UHFFFAOYSA-N -1 3 344.823 4.203 20 0 EIADHM CC(C)(C[N-]S(=O)(=O)c1c(Cl)cccc1Cl)C1=CCCC1 ZINC001191064710 1051337530 /nfs/dbraw/zinc/33/75/30/1051337530.db2.gz JLDIAJDBGNNSGE-UHFFFAOYSA-N -1 3 348.295 4.408 20 0 EIADHM O=C(NC1CCCC1)c1ccc(Nc2c(F)cc([O-])cc2F)cc1 ZINC001175100603 1051346825 /nfs/dbraw/zinc/34/68/25/1051346825.db2.gz XQDOVKMTCOOUMF-UHFFFAOYSA-N -1 3 332.350 4.086 20 0 EIADHM CCOC(=O)c1ccc(Nc2c(F)cc([O-])cc2F)cc1Cl ZINC001175100598 1051348005 /nfs/dbraw/zinc/34/80/05/1051348005.db2.gz XKUSEUBIDLVSPZ-UHFFFAOYSA-N -1 3 327.714 4.244 20 0 EIADHM CCOC(=O)c1cnc2cccc(Nc3c(F)cc([O-])cc3F)c2c1 ZINC001175102000 1051349791 /nfs/dbraw/zinc/34/97/91/1051349791.db2.gz CDDVPEZHNPZMAA-UHFFFAOYSA-N -1 3 344.317 4.139 20 0 EIADHM COc1cc(Br)cc(Nc2c(F)cc([O-])cc2F)c1 ZINC001175096427 1051380525 /nfs/dbraw/zinc/38/05/25/1051380525.db2.gz AANALOHFSPSVON-UHFFFAOYSA-N -1 3 330.128 4.185 20 0 EIADHM COc1ccc(F)c(Nc2cc(Br)cc(F)c2[O-])c1F ZINC001175120942 1051392351 /nfs/dbraw/zinc/39/23/51/1051392351.db2.gz INIBUJUENXNMOP-UHFFFAOYSA-N -1 3 348.118 4.324 20 0 EIADHM CC(=O)c1cccc([O-])c1NC(=O)C1(c2cccc(Cl)c2)CCC1 ZINC001182248213 1051440998 /nfs/dbraw/zinc/44/09/98/1051440998.db2.gz BNBHFSHHCITYHD-UHFFFAOYSA-N -1 3 343.810 4.309 20 0 EIADHM C/C(=C/C(C)(C)C)C(=O)Oc1cccc(-c2nc(C)cc(=O)[n-]2)c1 ZINC000774104680 1051454519 /nfs/dbraw/zinc/45/45/19/1051454519.db2.gz JVEZUUDHPLDERH-QXMHVHEDSA-N -1 3 326.396 4.055 20 0 EIADHM CCOc1cccc(F)c1Nc1cccc([O-])c1Br ZINC001175228026 1051457855 /nfs/dbraw/zinc/45/78/55/1051457855.db2.gz XEXMPPWYZIYCDL-UHFFFAOYSA-N -1 3 326.165 4.436 20 0 EIADHM [O-]c1ccc(F)c(Nc2cc(Cl)cc(Br)n2)c1F ZINC001175264589 1051501013 /nfs/dbraw/zinc/50/10/13/1051501013.db2.gz YIYJOBGRIKWPHA-UHFFFAOYSA-N -1 3 335.535 4.225 20 0 EIADHM [O-]c1ccc(F)c(Nc2cc(F)c(Br)cc2F)c1F ZINC001175264229 1051501092 /nfs/dbraw/zinc/50/10/92/1051501092.db2.gz CNOYOFROEQDOKW-UHFFFAOYSA-N -1 3 336.082 4.455 20 0 EIADHM COC(=O)c1ccc(C(F)(F)F)c(Nc2c(F)ccc([O-])c2F)c1 ZINC001175268804 1051502929 /nfs/dbraw/zinc/50/29/29/1051502929.db2.gz WXQBOMSESLSULV-UHFFFAOYSA-N -1 3 347.239 4.219 20 0 EIADHM COc1cc(Br)c(F)cc1Nc1c(F)ccc([O-])c1F ZINC001175267790 1051503984 /nfs/dbraw/zinc/50/39/84/1051503984.db2.gz GWGKEQXBKVALFW-UHFFFAOYSA-N -1 3 348.118 4.324 20 0 EIADHM O=C(c1ccc(Nc2c(F)ccc([O-])c2F)cc1)N1CCCCC1 ZINC001175268202 1051504589 /nfs/dbraw/zinc/50/45/89/1051504589.db2.gz JYBGSIKVDRWSND-UHFFFAOYSA-N -1 3 332.350 4.040 20 0 EIADHM CC(=O)c1cc(Nc2c(F)ccc([O-])c2F)ccc1Br ZINC001175269151 1051506801 /nfs/dbraw/zinc/50/68/01/1051506801.db2.gz DWLXMYXYMGVFES-UHFFFAOYSA-N -1 3 342.139 4.379 20 0 EIADHM COc1ccc(-c2ccccc2)cc1Nc1ccc(-c2nn[n-]n2)cc1 ZINC001175429244 1051586278 /nfs/dbraw/zinc/58/62/78/1051586278.db2.gz TZSGNPNQVXNOBW-UHFFFAOYSA-N -1 3 343.390 4.286 20 0 EIADHM C[C@@H]1CN(CCSc2cc(Cl)ccc2Cl)CC[C@@H]1C(=O)[O-] ZINC000385874450 1051608016 /nfs/dbraw/zinc/60/80/16/1051608016.db2.gz OBXASROZKKMASS-PWSUYJOCSA-N -1 3 348.295 4.128 20 0 EIADHM O=C(Nc1ccc(OC(F)F)cc1)Nc1c([O-])cccc1Cl ZINC001192176439 1051657839 /nfs/dbraw/zinc/65/78/39/1051657839.db2.gz LRXZOQJESJBPBY-UHFFFAOYSA-N -1 3 328.702 4.291 20 0 EIADHM Brc1ccc2oc([N-]c3cccc4c[nH]nc43)nc2c1 ZINC001175636182 1051685681 /nfs/dbraw/zinc/68/56/81/1051685681.db2.gz QXQUQNCBLNHKFC-UHFFFAOYSA-N -1 3 329.157 4.210 20 0 EIADHM C[C@H]1CC[C@@](C)(C[N-]S(=O)(=O)c2cccc(Cl)c2F)C1(C)C ZINC001192309414 1051687071 /nfs/dbraw/zinc/68/70/71/1051687071.db2.gz GVNLPHUZMPEGFN-ZBEGNZNMSA-N -1 3 347.883 4.220 20 0 EIADHM CN(Cc1ccc(F)cc1F)C(=O)c1ccc(C(C)(C)C)cc1[O-] ZINC001192322727 1051690045 /nfs/dbraw/zinc/69/00/45/1051690045.db2.gz LFMWPWVMYQBCSD-UHFFFAOYSA-N -1 3 333.378 4.240 20 0 EIADHM CN(Cc1nc2ccccc2o1)C(=O)c1ccc(C(C)(C)C)cc1[O-] ZINC001192322914 1051692501 /nfs/dbraw/zinc/69/25/01/1051692501.db2.gz SATPTYADZMEDGT-UHFFFAOYSA-N -1 3 338.407 4.103 20 0 EIADHM Cc1cc(NC(=O)Nc2cc(Br)ccc2[O-])ccc1F ZINC001192382326 1051712243 /nfs/dbraw/zinc/71/22/43/1051712243.db2.gz MABCTJGCFVEXTC-UHFFFAOYSA-N -1 3 339.164 4.246 20 0 EIADHM O=C([N-]Cc1cccc(C(F)F)c1)C(F)(F)c1ccc(F)cc1 ZINC001182891314 1051734284 /nfs/dbraw/zinc/73/42/84/1051734284.db2.gz QUEFGTJCLQHQBA-UHFFFAOYSA-N -1 3 329.268 4.172 20 0 EIADHM O=S(=O)([N-][C@H]1CCCC12CCCCC2)c1cc(F)ccc1Cl ZINC001192483578 1051756929 /nfs/dbraw/zinc/75/69/29/1051756929.db2.gz BAKDWMPVJRTTFB-HNNXBMFYSA-N -1 3 345.867 4.260 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)N[C@H](c1ccc(F)cc1)C1CCC1 ZINC000159060469 1051808159 /nfs/dbraw/zinc/80/81/59/1051808159.db2.gz NDAWCVHCAWZOML-SFHVURJKSA-N -1 3 346.377 4.011 20 0 EIADHM CC(C)Cc1nnc([N-]C(=O)c2cscc2C(F)(F)F)s1 ZINC000621399182 1051854388 /nfs/dbraw/zinc/85/43/88/1051854388.db2.gz HZFDLJPUDRVIBI-UHFFFAOYSA-N -1 3 335.376 4.069 20 0 EIADHM CN(C)C(=O)c1cc(Nc2nc3c(cccc3[O-])s2)ccc1Cl ZINC001176150009 1051910522 /nfs/dbraw/zinc/91/05/22/1051910522.db2.gz HOIMPNFKHBYALQ-UHFFFAOYSA-N -1 3 347.827 4.101 20 0 EIADHM COc1cc(Nc2cccc([O-])c2Br)c(F)cc1F ZINC001176111525 1051915382 /nfs/dbraw/zinc/91/53/82/1051915382.db2.gz HGOMDSHJFUKDDD-UHFFFAOYSA-N -1 3 330.128 4.185 20 0 EIADHM CC(C)Oc1ccc([N-]c2nonc2C2CC2)c(C(F)(F)F)c1 ZINC001176172007 1051926133 /nfs/dbraw/zinc/92/61/33/1051926133.db2.gz ABYYQWDJBHCEJO-UHFFFAOYSA-N -1 3 327.306 4.497 20 0 EIADHM CC(C)(CC1CCC1)C(=O)Nc1cc(Br)ccc1[O-] ZINC001183924817 1051927766 /nfs/dbraw/zinc/92/77/66/1051927766.db2.gz BKYPVEOBJWQXHA-UHFFFAOYSA-N -1 3 326.234 4.310 20 0 EIADHM O=C(Nc1ncccc1[O-])c1cc(-c2ccccc2)oc1C(F)(F)F ZINC001193786646 1051989882 /nfs/dbraw/zinc/98/98/82/1051989882.db2.gz CZUYJTAAUGISFI-UHFFFAOYSA-N -1 3 348.280 4.318 20 0 EIADHM Cc1cc2ccc(NC(=O)c3ccc([O-])cc3C(F)(F)F)cc2[nH]1 ZINC001193748819 1051991131 /nfs/dbraw/zinc/99/11/31/1051991131.db2.gz UULQTSJSBXZMLA-UHFFFAOYSA-N -1 3 334.297 4.453 20 0 EIADHM O=C(Nc1ccccc1-c1cc[nH]n1)c1ccc([O-])cc1C(F)(F)F ZINC001193748066 1051992117 /nfs/dbraw/zinc/99/21/17/1051992117.db2.gz OVFVQDQFBREJGY-UHFFFAOYSA-N -1 3 347.296 4.053 20 0 EIADHM [O-]c1cc(F)c(Nc2cccc3c2cnn3[C@@H]2CCCCO2)c(F)c1 ZINC001176322132 1052026837 /nfs/dbraw/zinc/02/68/37/1052026837.db2.gz DJUOMZAUJPUMDT-KRWDZBQOSA-N -1 3 345.349 4.463 20 0 EIADHM O=c1ccn(-c2ccc(Nc3ccc(-c4ccncc4)cc3)cc2)[n-]1 ZINC001176700730 1052163485 /nfs/dbraw/zinc/16/34/85/1052163485.db2.gz LLVQHXKJDCCRMY-UHFFFAOYSA-N -1 3 328.375 4.384 20 0 EIADHM Cc1ccc([C@H](C)CNC(=O)c2cc([O-])cc(C(F)(F)F)c2)cc1 ZINC000622384036 1052238842 /nfs/dbraw/zinc/23/88/42/1052238842.db2.gz TXYXNLJDKJSQMS-GFCCVEGCSA-N -1 3 337.341 4.253 20 0 EIADHM CCc1cccc(C(=O)N(C)[C@@H](Cc2ccc(F)cc2)C(C)C)c1[O-] ZINC000622400868 1052245495 /nfs/dbraw/zinc/24/54/95/1052245495.db2.gz CDKUJAOZELMQCD-IBGZPJMESA-N -1 3 343.442 4.433 20 0 EIADHM O=C(c1cc2c(cc1[O-])CCCC2)N1CCc2c1cccc2Cl ZINC000622428203 1052264072 /nfs/dbraw/zinc/26/40/72/1052264072.db2.gz WKRMUPOCUNKWAA-UHFFFAOYSA-N -1 3 327.811 4.127 20 0 EIADHM CN(CC1(c2ccccc2)CC1)C(=O)c1cc([O-])cc(C(F)(F)F)c1 ZINC000622540356 1052320150 /nfs/dbraw/zinc/32/01/50/1052320150.db2.gz ATUKMTCDKFERDV-UHFFFAOYSA-N -1 3 349.352 4.215 20 0 EIADHM Cc1ccc(C(=O)Nc2cn(C)nc2C2CCCCC2)c([O-])c1C ZINC000622626843 1052356310 /nfs/dbraw/zinc/35/63/10/1052356310.db2.gz MKERCFUMYYZFBQ-UHFFFAOYSA-N -1 3 327.428 4.043 20 0 EIADHM COc1ccc2c(c1)C[C@H](C(C)C)CN2C(=O)c1cccc(C)c1[O-] ZINC000622728674 1052396248 /nfs/dbraw/zinc/39/62/48/1052396248.db2.gz IAMDAZVNQGBPPB-INIZCTEOSA-N -1 3 339.435 4.184 20 0 EIADHM CSc1nc2ccccc2c(C)c1[N-]C(=O)c1ocnc1C1CC1 ZINC000622968219 1052560042 /nfs/dbraw/zinc/56/00/42/1052560042.db2.gz IHJJLEDGMUPSNL-UHFFFAOYSA-N -1 3 339.420 4.383 20 0 EIADHM Cc1csc(-c2cccc(C(=O)Nc3cc(F)ccc3[O-])c2)n1 ZINC000174905911 1052577122 /nfs/dbraw/zinc/57/71/22/1052577122.db2.gz YCZBDFKGRFNHRB-UHFFFAOYSA-N -1 3 328.368 4.216 20 0 EIADHM O=C(Nc1cc(Br)ccc1[O-])c1ccc(Cl)cc1F ZINC000176436490 1052622823 /nfs/dbraw/zinc/62/28/23/1052622823.db2.gz YBSQYTLIBNIIAH-UHFFFAOYSA-N -1 3 344.567 4.200 20 0 EIADHM COc1cc(C)c(S(=O)(=O)[N-]c2cccc(C)c2C)c(C)c1C ZINC001194835637 1053125307 /nfs/dbraw/zinc/12/53/07/1053125307.db2.gz LQQABZOBLUEFHI-UHFFFAOYSA-N -1 3 333.453 4.038 20 0 EIADHM C[C@H](c1cccc2ccccc21)N(C)C(=O)c1ccc(Cl)[n-]c1=O ZINC001195134984 1053286808 /nfs/dbraw/zinc/28/68/08/1053286808.db2.gz YAYMOBYRBVAMOJ-GFCCVEGCSA-N -1 3 340.810 4.427 20 0 EIADHM COc1cccc([N-]S(=O)(=O)c2c(C)cccc2Cl)c1Cl ZINC001195310309 1053373444 /nfs/dbraw/zinc/37/34/44/1053373444.db2.gz YASRZZSAIYUSTH-UHFFFAOYSA-N -1 3 346.235 4.111 20 0 EIADHM O=S(=O)([N-]C1(C2CCCCC2)CC1)c1cc(Cl)ccc1Cl ZINC001195830595 1053499667 /nfs/dbraw/zinc/49/96/67/1053499667.db2.gz LUIDYVIRDCRJOQ-UHFFFAOYSA-N -1 3 348.295 4.385 20 0 EIADHM Cc1oc(-c2cccs2)nc1C(=O)Nc1cc(Cl)ccc1[O-] ZINC000111210967 1053664036 /nfs/dbraw/zinc/66/40/36/1053664036.db2.gz BOOQUBDMWSVDRI-UHFFFAOYSA-N -1 3 334.784 4.323 20 0 EIADHM O=C(Nc1cccc(NC(=O)C2CC2)c1)c1cc([O-])c2ccccc2c1 ZINC000471709949 1053690896 /nfs/dbraw/zinc/69/08/96/1053690896.db2.gz WGLWAQVQZGZNNX-UHFFFAOYSA-N -1 3 346.386 4.146 20 0 EIADHM O=C(Nc1cccc(NC2CCCC2)c1)c1[n-]cnc1C(F)(F)F ZINC000869363339 1053991867 /nfs/dbraw/zinc/99/18/67/1053991867.db2.gz GICIOPZACQTXQT-UHFFFAOYSA-N -1 3 338.333 4.035 20 0 EIADHM O=C(Nc1cccc(NC2CCCC2)c1)c1nc[n-]c1C(F)(F)F ZINC000869363339 1053991880 /nfs/dbraw/zinc/99/18/80/1053991880.db2.gz GICIOPZACQTXQT-UHFFFAOYSA-N -1 3 338.333 4.035 20 0 EIADHM O=C(c1cc2sccc2c([O-])c1)N1CCC2(CCSCC2)CC1 ZINC000870250939 1054076836 /nfs/dbraw/zinc/07/68/36/1054076836.db2.gz BBVKJVDUFDQPCI-UHFFFAOYSA-N -1 3 347.505 4.356 20 0 EIADHM CCN(C(=O)Nc1ccc(-c2cc(=O)[n-]c(C)n2)cc1)[C@@H](C)C(C)C ZINC000339104726 1054111431 /nfs/dbraw/zinc/11/14/31/1054111431.db2.gz GPVUTWSURWDQFA-ZDUSSCGKSA-N -1 3 342.443 4.056 20 0 EIADHM O=C([N-]OCCCC(F)(F)F)C1(Cc2ccc(Cl)cc2)CC1 ZINC000871214989 1054170145 /nfs/dbraw/zinc/17/01/45/1054170145.db2.gz WVXTZNCAJKYWID-UHFFFAOYSA-N -1 3 335.753 4.053 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N(Cc1ccco1)CC(F)(F)F ZINC000471953576 1054201849 /nfs/dbraw/zinc/20/18/49/1054201849.db2.gz LWUZGQFFYTZFNE-UHFFFAOYSA-N -1 3 349.308 4.343 20 0 EIADHM Cc1ccccc1-n1nccc1NC(=O)c1cc([O-])c2ccccc2c1 ZINC000472146343 1054214365 /nfs/dbraw/zinc/21/43/65/1054214365.db2.gz VPUPROLMHBFOTG-UHFFFAOYSA-N -1 3 343.386 4.292 20 0 EIADHM Cc1ccc([C@H](C)NC(=O)c2cc([O-])cc(C(F)(F)F)c2)s1 ZINC000857440759 1054241894 /nfs/dbraw/zinc/24/18/94/1054241894.db2.gz CBWDKBPCZDLCGZ-VIFPVBQESA-N -1 3 329.343 4.272 20 0 EIADHM CCc1cc(Cl)ccc1[N-]S(=O)(=O)c1ccc(OC)cc1C ZINC001198942083 1054309323 /nfs/dbraw/zinc/30/93/23/1054309323.db2.gz UDFDXOVWRWEEGW-UHFFFAOYSA-N -1 3 339.844 4.020 20 0 EIADHM COc1cc(CN[C@H](C)c2cccc([O-])c2F)ccc1OC(C)C ZINC000872020764 1054334964 /nfs/dbraw/zinc/33/49/64/1054334964.db2.gz KBKKZLJBZBKCQF-CYBMUJFWSA-N -1 3 333.403 4.178 20 0 EIADHM C[C@@H](NCc1ccccc1OCC(F)(F)F)c1cccc([O-])c1F ZINC000872023955 1054338285 /nfs/dbraw/zinc/33/82/85/1054338285.db2.gz LXMWSYCGZBFSFK-LLVKDONJSA-N -1 3 343.320 4.323 20 0 EIADHM CCCC(=O)Nc1cccc(CN[C@@H](C)c2cccc([O-])c2F)c1 ZINC000872024539 1054340188 /nfs/dbraw/zinc/34/01/88/1054340188.db2.gz BVQZIQXZWPDIBH-ZDUSSCGKSA-N -1 3 330.403 4.121 20 0 EIADHM COc1cc(F)c([C@@H](C)N[C@@H](C)c2cccc([O-])c2F)cc1OC ZINC000872033359 1054351225 /nfs/dbraw/zinc/35/12/25/1054351225.db2.gz CNMMYDDXZFOSEQ-WDEREUQCSA-N -1 3 337.366 4.099 20 0 EIADHM CCOCCOc1cc(C)ccc1CN[C@H](C)c1cccc([O-])c1F ZINC000872042755 1054356269 /nfs/dbraw/zinc/35/62/69/1054356269.db2.gz SDHFIVAXNIRHPJ-OAHLLOKOSA-N -1 3 347.430 4.106 20 0 EIADHM C[C@H](NCc1c(F)cccc1OC(F)F)c1cccc([O-])c1F ZINC000872049133 1054362357 /nfs/dbraw/zinc/36/23/57/1054362357.db2.gz PISQQZYKUUBQHC-VIFPVBQESA-N -1 3 329.293 4.123 20 0 EIADHM C[C@H](N[C@@H](C)c1cccc([O-])c1F)c1ccc(C(F)(F)F)nc1 ZINC000872130824 1054406097 /nfs/dbraw/zinc/40/60/97/1054406097.db2.gz SKLPTQDQZCGNLZ-UWVGGRQHSA-N -1 3 328.309 4.357 20 0 EIADHM [O-]c1cc(Br)ccc1NC(=S)NCC1CCCCC1 ZINC001199923288 1054496292 /nfs/dbraw/zinc/49/62/92/1054496292.db2.gz TXWYEGVVVBJZSS-UHFFFAOYSA-N -1 3 343.290 4.021 20 0 EIADHM CCCCn1nc(C)c(CNCc2ccc([O-])c(Cl)c2)c1Cl ZINC000873179028 1054500694 /nfs/dbraw/zinc/50/06/94/1054500694.db2.gz JTHHHZQPVNGPLN-UHFFFAOYSA-N -1 3 342.270 4.294 20 0 EIADHM [O-]c1cccc(Br)c1NC(=S)NC1CCCCCC1 ZINC001199969402 1054507173 /nfs/dbraw/zinc/50/71/73/1054507173.db2.gz QFJJNXPMIUSDML-UHFFFAOYSA-N -1 3 343.290 4.164 20 0 EIADHM CCc1ccc([O-])c(C(=O)N2C[C@@H](C)C[C@H]2c2ccccc2F)c1 ZINC001137070521 1054523227 /nfs/dbraw/zinc/52/32/27/1054523227.db2.gz DCQNNRMNLHXRMW-UGSOOPFHSA-N -1 3 327.399 4.317 20 0 EIADHM O=C([O-])[C@H]1C[C@@H](NCc2c(Cl)cccc2Oc2ccccc2)C1 ZINC000874045882 1054615016 /nfs/dbraw/zinc/61/50/16/1054615016.db2.gz HTYYZCNAKDRXGS-BETUJISGSA-N -1 3 331.799 4.085 20 0 EIADHM CCn1ccnc1[C@H]1CCCCN1C(=O)c1cc([O-])c2ccccc2c1 ZINC000281889943 1054698367 /nfs/dbraw/zinc/69/83/67/1054698367.db2.gz SVHYLITZIRKZIS-GOSISDBHSA-N -1 3 349.434 4.129 20 0 EIADHM O=C([O-])[C@]12CCC[C@@H]1CN(Cc1cc(C(F)(F)F)ccc1Cl)C2 ZINC000859812595 1054733183 /nfs/dbraw/zinc/73/31/83/1054733183.db2.gz SRZQDMDQQVLUCR-DOMZBBRYSA-N -1 3 347.764 4.046 20 0 EIADHM O=C([O-])[C@]12CCC[C@H]1CN(Cc1cc(C(F)(F)F)ccc1Cl)C2 ZINC000859812597 1054733617 /nfs/dbraw/zinc/73/36/17/1054733617.db2.gz SRZQDMDQQVLUCR-WFASDCNBSA-N -1 3 347.764 4.046 20 0 EIADHM CC(C)Oc1cc(Cl)c(C=C2SC(=O)[N-]C2=O)cc1Cl ZINC000874930270 1054744369 /nfs/dbraw/zinc/74/43/69/1054744369.db2.gz ZLPCTOJXTVPKPR-NYYWCZLTSA-N -1 3 332.208 4.105 20 0 EIADHM Cc1c(C)c(C)c(S(=O)(=O)[N-]c2cccc(O)c2C)c(C)c1C ZINC001201799770 1054909346 /nfs/dbraw/zinc/90/93/46/1054909346.db2.gz NTBFAEAMZJIFJA-UHFFFAOYSA-N -1 3 333.453 4.044 20 0 EIADHM CC[C@@H]1CN(C(=O)c2cc(Oc3ccccc3)ccc2[O-])CCS1 ZINC001137114961 1054984221 /nfs/dbraw/zinc/98/42/21/1054984221.db2.gz VLAGFNVGCCCTLG-MRXNPFEDSA-N -1 3 343.448 4.152 20 0 EIADHM O=C(Nc1ccc([O-])c(Br)c1)Nc1ccccc1Cl ZINC001202063443 1055004299 /nfs/dbraw/zinc/00/42/99/1055004299.db2.gz LBWIONFAOWBTTJ-UHFFFAOYSA-N -1 3 341.592 4.452 20 0 EIADHM COc1ccccc1NC(=O)[N-]c1cc(-c2cccc(F)c2)no1 ZINC001202116849 1055039493 /nfs/dbraw/zinc/03/94/93/1055039493.db2.gz FDPBDGKRQRRKHM-UHFFFAOYSA-N -1 3 327.315 4.133 20 0 EIADHM Cc1cccc(C)c1NC(=O)Nc1cc(Br)ccc1[O-] ZINC001202208869 1055086502 /nfs/dbraw/zinc/08/65/02/1055086502.db2.gz ZSCQXTDGPWGLGN-UHFFFAOYSA-N -1 3 335.201 4.416 20 0 EIADHM CC(=O)c1cccc([O-])c1NC(=O)Nc1cccc(C(F)(F)F)c1 ZINC001202297845 1055129734 /nfs/dbraw/zinc/12/97/34/1055129734.db2.gz ZXHMFASHUNLFGL-UHFFFAOYSA-N -1 3 338.285 4.258 20 0 EIADHM CCOC(=O)c1nc(C2CC2)oc1[N-]C(=O)Nc1ccc(Cl)cc1 ZINC001202367028 1055153482 /nfs/dbraw/zinc/15/34/82/1055153482.db2.gz RKNHBDIMFHNJJZ-UHFFFAOYSA-N -1 3 349.774 4.026 20 0 EIADHM Cc1sc2[n-]c([C@H](C)OC(=O)[C@@H]3CC[C@H](C)C3)nc(=O)c2c1C ZINC000776424836 1055290231 /nfs/dbraw/zinc/29/02/31/1055290231.db2.gz PMRWWNFXDYOYCG-PTOFAABTSA-N -1 3 334.441 4.054 20 0 EIADHM CCCCc1nc(NC(=O)[C@H]2CCCCC2(C)C)c(C(=O)OCC)[n-]1 ZINC001128072952 1055715222 /nfs/dbraw/zinc/71/52/22/1055715222.db2.gz BMAHBHHHNUKLIF-CYBMUJFWSA-N -1 3 349.475 4.084 20 0 EIADHM Cc1ccc(Cl)c(O[C@H](C)C(=O)Nc2cc(Cl)ccc2[O-])c1 ZINC000111210354 1056772836 /nfs/dbraw/zinc/77/28/36/1056772836.db2.gz OLWJCCPFOJOBJK-SNVBAGLBSA-N -1 3 340.206 4.413 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(NCC(CC)(CC)SC)nc2)n1 ZINC000742424702 1058615900 /nfs/dbraw/zinc/61/59/00/1058615900.db2.gz ATMDWELXYXYXGY-UHFFFAOYSA-N -1 3 346.500 4.140 20 0 EIADHM Cc1cc(COC(=O)c2cc(-c3ccccc3)cc(Cl)c2[O-])on1 ZINC000746078320 1060006316 /nfs/dbraw/zinc/00/63/16/1060006316.db2.gz FZFCIAMNVRWXLV-UHFFFAOYSA-N -1 3 343.766 4.366 20 0 EIADHM [O-]c1ccc(Cl)c(Nc2nc(F)c(F)c(Cl)c2F)c1F ZINC001214559029 1060062373 /nfs/dbraw/zinc/06/23/73/1060062373.db2.gz DIRNMIHDWZYIMR-UHFFFAOYSA-N -1 3 327.064 4.394 20 0 EIADHM COc1cccc(Cn2nccc2Nc2ccc(Cl)c([O-])c2)c1 ZINC001212590494 1060831753 /nfs/dbraw/zinc/83/17/53/1060831753.db2.gz OVFBWBFCUVDDNT-UHFFFAOYSA-N -1 3 329.787 4.043 20 0 EIADHM Nc1cc(F)c(Br)cc1Nc1ccc(Cl)c([O-])c1 ZINC001212593411 1060885623 /nfs/dbraw/zinc/88/56/23/1060885623.db2.gz POHKWPVOEWYERV-UHFFFAOYSA-N -1 3 331.572 4.273 20 0 EIADHM COC(=O)c1c(Nc2ccc(Cl)c([O-])c2)ccc2c1OC[C@@H]1C[C@H]21 ZINC001212594324 1060931787 /nfs/dbraw/zinc/93/17/87/1060931787.db2.gz WLXUSQUKTLXWNU-CABZTGNLSA-N -1 3 345.782 4.072 20 0 EIADHM CCc1c(Cl)nc(-c2ccccc2)nc1NCc1ncccc1[O-] ZINC001169730777 1060934636 /nfs/dbraw/zinc/93/46/36/1060934636.db2.gz IBYAJRKZAUHDDH-UHFFFAOYSA-N -1 3 340.814 4.072 20 0 EIADHM Cc1cc(=O)[n-]c(CSCc2nc(-c3ccccc3)cs2)n1 ZINC000766823573 1060972335 /nfs/dbraw/zinc/97/23/35/1060972335.db2.gz XFJSDMXUPHEDQV-UHFFFAOYSA-N -1 3 329.450 4.048 20 0 EIADHM N#CC(=C([O-])C=C(C1CC1)C1CC1)c1nc2ccccc2n1C(F)F ZINC000054466146 1032173970 /nfs/dbraw/zinc/17/39/70/1032173970.db2.gz MGZXGZJLSJXYAK-AWEZNQCLSA-N -1 3 341.361 4.354 20 0 EIADHM O=C(Cc1ccc([O-])c(F)c1)N1CCCC[C@@H]1c1ccc(F)cc1F ZINC000450171948 1032327265 /nfs/dbraw/zinc/32/72/65/1032327265.db2.gz JKXZMUVMIZLENM-QGZVFWFLSA-N -1 3 349.352 4.106 20 0 EIADHM CCOC(=O)c1ccc(OC)c(Nc2ccc(C)c([O-])c2Cl)c1 ZINC001211979249 1032367300 /nfs/dbraw/zinc/36/73/00/1032367300.db2.gz RYSZIIAZDYAXLD-UHFFFAOYSA-N -1 3 335.787 4.283 20 0 EIADHM O=C(Cc1ccc([O-])c(F)c1)N1CCC[C@@H](c2ccc(F)cc2)CC1 ZINC000450465175 1032516579 /nfs/dbraw/zinc/51/65/79/1032516579.db2.gz BLIXLLHBEFXFBQ-OAHLLOKOSA-N -1 3 345.389 4.009 20 0 EIADHM COc1ccc(Br)c(NCc2c(F)ccc([O-])c2F)c1 ZINC000509533125 1032783731 /nfs/dbraw/zinc/78/37/31/1032783731.db2.gz OOOOZURLGWAESZ-UHFFFAOYSA-N -1 3 344.155 4.054 20 0 EIADHM C[C@@H]1CN(C(=O)c2cc([O-])cc(C(F)(F)F)c2)[C@H]1c1ccccc1 ZINC000646878384 1018860439 /nfs/dbraw/zinc/86/04/39/1018860439.db2.gz OEIXJNRTCWCDIT-BDJLRTHQSA-N -1 3 335.325 4.244 20 0 EIADHM CCOc1cc(/C=C2\COc3ccccc3C2=O)cc(Cl)c1[O-] ZINC000003582527 1018900586 /nfs/dbraw/zinc/90/05/86/1018900586.db2.gz RZYKEAVFZMAGFA-KPKJPENVSA-N -1 3 330.767 4.103 20 0 EIADHM CC[C@H](C)c1nc(C)c(CC(=O)Nc2cc(Cl)ccc2[O-])c(C)n1 ZINC000654936560 1019027296 /nfs/dbraw/zinc/02/72/96/1019027296.db2.gz ZRAWGBZOFLBLTD-JTQLQIEISA-N -1 3 347.846 4.147 20 0 EIADHM Cc1cc(F)ccc1S(=O)(=O)[N-]c1cccc(C(F)(F)F)c1C ZINC000471131831 1019054820 /nfs/dbraw/zinc/05/48/20/1019054820.db2.gz FUVHLNBOEGDTNG-UHFFFAOYSA-N -1 3 347.333 4.262 20 0 EIADHM CC[C@@H](C)c1nc(C)c(CC(=O)Nc2ccc(Cl)cc2[O-])c(C)n1 ZINC000654966387 1019065918 /nfs/dbraw/zinc/06/59/18/1019065918.db2.gz XUERCSFWTOUAGN-SNVBAGLBSA-N -1 3 347.846 4.147 20 0 EIADHM COCc1ccc(C(=O)[N-]c2ccccc2SC(F)(F)F)o1 ZINC000097404298 1019427748 /nfs/dbraw/zinc/42/77/48/1019427748.db2.gz MMGWMLQURXVSMX-UHFFFAOYSA-N -1 3 331.315 4.290 20 0 EIADHM CC(C)Cn1ncc(C(=O)Nc2cc(Cl)ccc2[O-])c1C1CC1 ZINC000154500307 1019787645 /nfs/dbraw/zinc/78/76/45/1019787645.db2.gz WSPBNRSIKZEGIT-UHFFFAOYSA-N -1 3 333.819 4.028 20 0 EIADHM COc1cc2nc(C)sc2cc1NC(=O)c1cc([O-])ccc1Cl ZINC000339742596 1019860812 /nfs/dbraw/zinc/86/08/12/1019860812.db2.gz LELLJJJCMMRZRG-UHFFFAOYSA-N -1 3 348.811 4.225 20 0 EIADHM COc1cccc(CN(CC(C)C)C(=O)c2ccc(C)cc2[O-])c1 ZINC001625821485 1019878393 /nfs/dbraw/zinc/87/83/93/1019878393.db2.gz PKUSOUVRKYIDMD-UHFFFAOYSA-N -1 3 327.424 4.008 20 0 EIADHM CCCCCc1nnc([N-]C(=O)c2nc(Cl)ccc2Cl)s1 ZINC000014714726 1019973723 /nfs/dbraw/zinc/97/37/23/1019973723.db2.gz YZYLEWKHWUHHJB-UHFFFAOYSA-N -1 3 345.255 4.225 20 0 EIADHM CCCOCc1nc(=O)c2c([n-]1)sc(C)c2-c1ccc(C)cc1 ZINC000060090497 1020022448 /nfs/dbraw/zinc/02/24/48/1020022448.db2.gz MJEDBBKHMJKDFC-UHFFFAOYSA-N -1 3 328.437 4.195 20 0 EIADHM CCCC(C)(C)[N-]S(=O)(=O)c1ccc(Cl)cc1C(F)(F)F ZINC000065268709 1020242043 /nfs/dbraw/zinc/24/20/43/1020242043.db2.gz TYAMAEHMZJWZSQ-UHFFFAOYSA-N -1 3 343.798 4.216 20 0 EIADHM CCc1ccc([O-])c(C(=O)N(C)CCc2cccc3ccccc32)c1 ZINC000512485218 1032892230 /nfs/dbraw/zinc/89/22/30/1032892230.db2.gz UADUJJQJENCTJR-UHFFFAOYSA-N -1 3 333.431 4.423 20 0 EIADHM O=C([O-])CC1CCN(CCSc2cc(Cl)ccc2Cl)CC1 ZINC000093680667 1020816657 /nfs/dbraw/zinc/81/66/57/1020816657.db2.gz AHZUJUROWSAACM-UHFFFAOYSA-N -1 3 348.295 4.272 20 0 EIADHM O=C([N-]c1cc(-c2ccccc2)on1)c1csc(-c2ccccn2)n1 ZINC000175862272 1021320303 /nfs/dbraw/zinc/32/03/03/1021320303.db2.gz SVVCSZDYQPUYGP-UHFFFAOYSA-N -1 3 348.387 4.112 20 0 EIADHM O=C(N[C@@H]1CC[C@@H](Cc2ccccc2)C1)c1cc(=O)c2ccccc2[n-]1 ZINC000275752257 1021492237 /nfs/dbraw/zinc/49/22/37/1021492237.db2.gz CYDXNMMCRNFMFE-DLBZAZTESA-N -1 3 346.430 4.082 20 0 EIADHM O=C([N-]c1nnc(/C=C\c2ccco2)s1)c1c(F)cccc1Cl ZINC000255148127 1021721748 /nfs/dbraw/zinc/72/17/48/1021721748.db2.gz AWGOHGIDNUMFMR-SREVYHEPSA-N -1 3 349.774 4.346 20 0 EIADHM Nc1cc2c(ccn2-c2cccc([O-])c2Cl)c(Br)c1 ZINC001210859675 1021811923 /nfs/dbraw/zinc/81/19/23/1021811923.db2.gz KAUXKDIWROQYAW-UHFFFAOYSA-N -1 3 337.604 4.334 20 0 EIADHM O=C(Nc1c([O-])cccc1Cl)c1csc(Br)c1 ZINC000580303320 1021830200 /nfs/dbraw/zinc/83/02/00/1021830200.db2.gz RIAKUAYJQGVTSE-UHFFFAOYSA-N -1 3 332.606 4.122 20 0 EIADHM CSc1ccsc1C(=O)[N-]c1nnc(/C=C\c2ccco2)s1 ZINC000255639893 1022322364 /nfs/dbraw/zinc/32/23/64/1022322364.db2.gz RJDQYGVFPVRISS-PLNGDYQASA-N -1 3 349.462 4.337 20 0 EIADHM CN(Cc1coc(-c2ccc(C(=O)[O-])cc2)n1)CC1CCCCC1 ZINC000580652872 1022340697 /nfs/dbraw/zinc/34/06/97/1022340697.db2.gz MHSOOHSUCRQSHY-UHFFFAOYSA-N -1 3 328.412 4.052 20 0 EIADHM CCCc1cc(=O)[n-]c(C(=Cc2nc3c(s2)CCCC3)CC)n1 ZINC000684033000 1022391351 /nfs/dbraw/zinc/39/13/51/1022391351.db2.gz JFLLCVABDSCLIU-ZRDIBKRKSA-N -1 3 329.469 4.421 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1c[nH]cc1-c1ccc(F)cc1 ZINC000175614528 1022406674 /nfs/dbraw/zinc/40/66/74/1022406674.db2.gz QAPJCAGSDXWLOB-UHFFFAOYSA-N -1 3 330.746 4.432 20 0 EIADHM O=C(NCc1cccc(-c2cccnc2)c1)c1cc([O-])ccc1Cl ZINC000378136120 1022414132 /nfs/dbraw/zinc/41/41/32/1022414132.db2.gz LRSPTBYEFNECAL-UHFFFAOYSA-N -1 3 338.794 4.038 20 0 EIADHM O=C(Nc1cc(F)ccc1[O-])c1cc(-c2ccccc2Cl)on1 ZINC000536222134 1022643300 /nfs/dbraw/zinc/64/33/00/1022643300.db2.gz UUHVLKJTFPTUPA-UHFFFAOYSA-N -1 3 332.718 4.092 20 0 EIADHM O=C([N-]c1nnc(C(F)F)s1)c1cc(Cl)c(F)cc1Cl ZINC000339155603 1022708475 /nfs/dbraw/zinc/70/84/75/1022708475.db2.gz YTXKTASTTPBHKQ-UHFFFAOYSA-N -1 3 342.129 4.174 20 0 EIADHM Cc1nc(Cc2nc(=O)c3cc(C(F)(F)F)sc3[n-]2)sc1C ZINC000416409776 1022829033 /nfs/dbraw/zinc/82/90/33/1022829033.db2.gz CSNMJXFJNYZYSB-UHFFFAOYSA-N -1 3 345.371 4.080 20 0 EIADHM O=C(COc1ccccc1-c1ccccc1)Nc1cccc([O-])c1F ZINC000128462366 1022885548 /nfs/dbraw/zinc/88/55/48/1022885548.db2.gz CQJSIMNLSRNOEW-UHFFFAOYSA-N -1 3 337.350 4.216 20 0 EIADHM Cc1cc(C)n(-c2cccc(NC(=O)c3cc([O-])ccc3Cl)c2)n1 ZINC000431914827 1023105566 /nfs/dbraw/zinc/10/55/66/1023105566.db2.gz VUGVFBFMWJANDU-UHFFFAOYSA-N -1 3 341.798 4.100 20 0 EIADHM Cc1csc(-c2cccc(NCc3cc(=O)[n-]c(C4CC4)n3)c2)n1 ZINC000417026622 1023117221 /nfs/dbraw/zinc/11/72/21/1023117221.db2.gz NOTWNAUIJDXTDM-UHFFFAOYSA-N -1 3 338.436 4.104 20 0 EIADHM O=c1cc(CNc2ccc(CCC(F)(F)F)cc2)nc(C2CC2)[n-]1 ZINC000417026170 1023119739 /nfs/dbraw/zinc/11/97/39/1023119739.db2.gz SJTUGZGXWUCVBI-UHFFFAOYSA-N -1 3 337.345 4.167 20 0 EIADHM CS[C@H]1CCCCN([C@@H](C(=O)[O-])c2ccc(Cl)cc2Cl)C1 ZINC000584637769 1023138339 /nfs/dbraw/zinc/13/83/39/1023138339.db2.gz BUZFEGLIFGBYFW-SMDDNHRTSA-N -1 3 348.295 4.337 20 0 EIADHM O=S(=O)([N-]c1ccc(-c2ccccc2)cc1F)c1ccccc1 ZINC000031721663 1023178734 /nfs/dbraw/zinc/17/87/34/1023178734.db2.gz HQRVEXAWPNPYNB-UHFFFAOYSA-N -1 3 327.380 4.294 20 0 EIADHM Cc1cc(C)cc(-c2noc(C=C([O-])c3ccccc3Cl)n2)c1 ZINC001211646814 1023204546 /nfs/dbraw/zinc/20/45/46/1023204546.db2.gz AOUXEWIVFJJBDO-UHFFFAOYSA-N -1 3 326.783 4.432 20 0 EIADHM C[C@H](c1cccnc1)N(C)C(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000179483860 1023215181 /nfs/dbraw/zinc/21/51/81/1023215181.db2.gz CVQNVMWHEKTPRS-OAHLLOKOSA-N -1 3 348.402 4.413 20 0 EIADHM Cc1c(F)cc(-c2noc(C=C([O-])c3ccccc3Cl)n2)cc1F ZINC001211647513 1023225461 /nfs/dbraw/zinc/22/54/61/1023225461.db2.gz SUUWSMOLLXDJAO-UHFFFAOYSA-N -1 3 348.736 4.402 20 0 EIADHM CCc1cccc2cc(CN[C@H]3C[C@H](C(=O)[O-])c4ccccc43)oc21 ZINC000656566367 1023225975 /nfs/dbraw/zinc/22/59/75/1023225975.db2.gz IZYKMRJFDPXQPK-OALUTQOASA-N -1 3 335.403 4.398 20 0 EIADHM [O-]C(=Cc1nc(-c2ccnc3ccccc32)no1)c1ccccc1Cl ZINC001211647563 1023229389 /nfs/dbraw/zinc/22/93/89/1023229389.db2.gz VXAXFOMYFCTUSF-UHFFFAOYSA-N -1 3 349.777 4.364 20 0 EIADHM Cc1ccc2c(c1C)OC[C@H]2NC(=O)c1cc([O-])c2ccccc2c1 ZINC000684272987 1023275099 /nfs/dbraw/zinc/27/50/99/1023275099.db2.gz GTLPMRBVLXFDES-GOSISDBHSA-N -1 3 333.387 4.026 20 0 EIADHM O=C([O-])[C@]12CN(Cc3csc(C4CCCCC4)n3)C[C@H]1CCCC2 ZINC000659800072 1023283476 /nfs/dbraw/zinc/28/34/76/1023283476.db2.gz SARHGUZMDBGNAB-DNVCBOLYSA-N -1 3 348.512 4.268 20 0 EIADHM C[C@@H](C(=O)[O-])[C@@H](NCc1cnc(C2CCCC2)s1)c1ccccc1 ZINC000417559449 1023355054 /nfs/dbraw/zinc/35/50/54/1023355054.db2.gz IGPLPTYFSWTWBF-CXAGYDPISA-N -1 3 344.480 4.352 20 0 EIADHM Cc1nn(C(C)C)cc1CN[C@H](CC(=O)[O-])c1ccc(C(C)C)cc1 ZINC000417572790 1023357439 /nfs/dbraw/zinc/35/74/39/1023357439.db2.gz PHEPQGWVLLFEPJ-LJQANCHMSA-N -1 3 343.471 4.201 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)N(Cc1ccoc1)C1CCCCC1 ZINC000074373212 1023376301 /nfs/dbraw/zinc/37/63/01/1023376301.db2.gz PTYZXKWXSBIWSW-UHFFFAOYSA-N -1 3 346.402 4.169 20 0 EIADHM CC(C)COc1ccccc1CN[C@H]1C[C@H](C(=O)[O-])c2ccccc21 ZINC000417634310 1023384649 /nfs/dbraw/zinc/38/46/49/1023384649.db2.gz VKHQSGXIYRIRMV-OALUTQOASA-N -1 3 339.435 4.124 20 0 EIADHM O=c1cc(CNc2cccc3c2ccn3C(F)F)nc(C2CC2)[n-]1 ZINC000656660405 1023393318 /nfs/dbraw/zinc/39/33/18/1023393318.db2.gz XCNQVIYRBJKPGP-UHFFFAOYSA-N -1 3 330.338 4.022 20 0 EIADHM CC[C@@H](C)C[C@H](C)NC(=O)Nc1ccc(-c2cc(=O)[n-]c(C)n2)cc1 ZINC000341238628 1023426140 /nfs/dbraw/zinc/42/61/40/1023426140.db2.gz AROPHYLVZVVLFH-OLZOCXBDSA-N -1 3 342.443 4.104 20 0 EIADHM Cc1cc(S(=O)(=O)[N-]c2ccc(Cl)cc2C)cc(C)c1F ZINC000460431969 1023533536 /nfs/dbraw/zinc/53/35/36/1023533536.db2.gz AVLGXTHVPOPPGC-UHFFFAOYSA-N -1 3 327.808 4.205 20 0 EIADHM Cc1cc(=O)[n-]c([C@@H](C)N2CCC(F)(c3ccc(Cl)cc3)CC2)n1 ZINC000500140543 1023537704 /nfs/dbraw/zinc/53/77/04/1023537704.db2.gz QBJGKVFFWQNYHT-CYBMUJFWSA-N -1 3 349.837 4.166 20 0 EIADHM [O-]c1ccc(Cl)c(F)c1CN[C@H]1CCCOc2c(F)cccc21 ZINC000191571348 1023559852 /nfs/dbraw/zinc/55/98/52/1023559852.db2.gz MFHGWPHWQAWROK-AWEZNQCLSA-N -1 3 339.769 4.327 20 0 EIADHM CN(CC[C@H](C(=O)[O-])c1ccccc1)Cc1ccc(F)cc1Cl ZINC000565106338 1023608413 /nfs/dbraw/zinc/60/84/13/1023608413.db2.gz XTLMMIQXOKEGNE-INIZCTEOSA-N -1 3 335.806 4.169 20 0 EIADHM O=C([O-])c1ccc(CNCc2ccc(SC(F)(F)F)cc2)cc1 ZINC000756282702 1023615735 /nfs/dbraw/zinc/61/57/35/1023615735.db2.gz OWBUFVWXPBSJJL-UHFFFAOYSA-N -1 3 341.354 4.287 20 0 EIADHM Cc1oc(C(=O)[O-])cc1CN1CCC(c2ccc(Cl)cc2)CC1 ZINC000584535139 1023659366 /nfs/dbraw/zinc/65/93/66/1023659366.db2.gz UAUIBCRGPWWQMO-UHFFFAOYSA-N -1 3 333.815 4.319 20 0 EIADHM CC(=O)c1cc(F)c([N-]C(=O)c2cc(F)cc3cccnc32)c(F)c1 ZINC000341419327 1023736093 /nfs/dbraw/zinc/73/60/93/1023736093.db2.gz HECFYJQIQSJBGM-UHFFFAOYSA-N -1 3 344.292 4.107 20 0 EIADHM O=S(=O)([N-]c1cc(Cl)ccc1F)c1cccc2ccccc21 ZINC000319483963 1023736838 /nfs/dbraw/zinc/73/68/38/1023736838.db2.gz XSHOSECQCYZYKI-UHFFFAOYSA-N -1 3 335.787 4.433 20 0 EIADHM Cc1cc(=O)[n-]c(-c2cccc(OC(=O)C3C[C@H](C)C[C@@H](C)C3)c2)n1 ZINC000780391298 1023766061 /nfs/dbraw/zinc/76/60/61/1023766061.db2.gz UNVFFJQGDKHOIV-CHWSQXEVSA-N -1 3 340.423 4.135 20 0 EIADHM C[C@@H](CC(=O)[N-]OCCC(F)(F)F)c1ccc(C(F)(F)F)cc1 ZINC000162754684 1023789790 /nfs/dbraw/zinc/78/97/90/1023789790.db2.gz CPQXLDRZRFKVRX-VIFPVBQESA-N -1 3 343.267 4.199 20 0 EIADHM CSc1ccc(C(=O)N2CCCC[C@@H]2c2nc(C)cs2)c([O-])c1 ZINC000364468881 1023806242 /nfs/dbraw/zinc/80/62/42/1023806242.db2.gz ULWHMFOPAYHMBZ-CQSZACIVSA-N -1 3 348.493 4.246 20 0 EIADHM CSc1ccc(C(=O)N2CCCC[C@H]2c2nc(C)cs2)c([O-])c1 ZINC000364468880 1023806745 /nfs/dbraw/zinc/80/67/45/1023806745.db2.gz ULWHMFOPAYHMBZ-AWEZNQCLSA-N -1 3 348.493 4.246 20 0 EIADHM CCOc1ccc(S(=O)(=O)[N-]c2ccc(O[C@H](C)CC)cc2)cc1 ZINC000511695418 1023829524 /nfs/dbraw/zinc/82/95/24/1023829524.db2.gz MTPUKICEVIHZGP-CQSZACIVSA-N -1 3 349.452 4.063 20 0 EIADHM CC[C@@H](C)Oc1ccc([N-]S(=O)(=O)c2ccc(C)c(C)c2)cc1 ZINC000511702929 1023834295 /nfs/dbraw/zinc/83/42/95/1023834295.db2.gz ZSHQVGXNSZSIER-OAHLLOKOSA-N -1 3 333.453 4.282 20 0 EIADHM Cc1cc(Br)ccc1NC(=O)c1cc([O-])ccc1Cl ZINC000235736311 1024239097 /nfs/dbraw/zinc/23/90/97/1024239097.db2.gz CQIBWQDMDRYLBJ-UHFFFAOYSA-N -1 3 340.604 4.369 20 0 EIADHM O=C(CCCOc1ccc2c(c1)CCCC2)Nc1cccc([O-])c1F ZINC000535657085 1024368118 /nfs/dbraw/zinc/36/81/18/1024368118.db2.gz AFTFLTZWSRRHBA-UHFFFAOYSA-N -1 3 343.398 4.208 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2cc(Cl)ccc2F)cc1Cl ZINC000048653655 1024676195 /nfs/dbraw/zinc/67/61/95/1024676195.db2.gz RACRKIYRELINLS-UHFFFAOYSA-N -1 3 334.199 4.242 20 0 EIADHM Cc1c(Cl)cccc1S(=O)(=O)[N-]c1cc(Cl)ccc1F ZINC000048653646 1024676423 /nfs/dbraw/zinc/67/64/23/1024676423.db2.gz DTWJRKSVBUSAHZ-UHFFFAOYSA-N -1 3 334.199 4.242 20 0 EIADHM CC(C)C[C@H](CNCc1csc(-c2cccs2)n1)CC(=O)[O-] ZINC000276927605 1024794042 /nfs/dbraw/zinc/79/40/42/1024794042.db2.gz AYDBXGDFDWLPDR-LBPRGKRZSA-N -1 3 338.498 4.098 20 0 EIADHM O=C([O-])c1cccc(Cl)c1CN(CCc1cccc(F)c1)C1CC1 ZINC000652414684 1024822302 /nfs/dbraw/zinc/82/23/02/1024822302.db2.gz NJHPNLNTHRFBJN-UHFFFAOYSA-N -1 3 347.817 4.384 20 0 EIADHM CC[C@]1(C)CCCN(Cc2c(Br)cccc2C(=O)[O-])C1 ZINC000652416523 1024824204 /nfs/dbraw/zinc/82/42/04/1024824204.db2.gz MTHRIKGICWVUHM-MRXNPFEDSA-N -1 3 340.261 4.159 20 0 EIADHM CCCCN(C)c1ccc([N-]S(=O)(=O)c2cccc(C)c2)cc1 ZINC000244419726 1024836326 /nfs/dbraw/zinc/83/63/26/1024836326.db2.gz YSVWTRGHLYOYFA-UHFFFAOYSA-N -1 3 332.469 4.032 20 0 EIADHM CCc1ccc(-c2nc(CN3CCC[C@](C)(C(=O)[O-])C3)cs2)cc1 ZINC000652483427 1024849826 /nfs/dbraw/zinc/84/98/26/1024849826.db2.gz YWWVMJAXYRQNLD-IBGZPJMESA-N -1 3 344.480 4.059 20 0 EIADHM O=C(Nc1ncccc1[O-])c1cc(C2CC2)nc2ccc(Cl)cc21 ZINC000341903027 1024979149 /nfs/dbraw/zinc/97/91/49/1024979149.db2.gz PXXBHJPGDJSKQE-UHFFFAOYSA-N -1 3 339.782 4.119 20 0 EIADHM CC1(C)C[C@@H](Sc2nnc([N-]c3ccccc3F)s2)CO1 ZINC000657228222 1025308726 /nfs/dbraw/zinc/30/87/26/1025308726.db2.gz OTHFWXBXPOSSMD-SECBINFHSA-N -1 3 325.434 4.080 20 0 EIADHM C[C@@H]1CCc2ccccc2N1Cc1nc2c3ccccc3oc2c(=O)[n-]1 ZINC000006996456 1025309019 /nfs/dbraw/zinc/30/90/19/1025309019.db2.gz ONHGOOBEFWFNSK-CYBMUJFWSA-N -1 3 345.402 4.011 20 0 EIADHM Cc1ccc(-c2noc(-c3cc(Cl)n[n-]3)n2)cc1C(F)(F)F ZINC001213498701 1033276670 /nfs/dbraw/zinc/27/66/70/1033276670.db2.gz RCVXGHJPPCKBHZ-UHFFFAOYSA-N -1 3 328.681 4.107 20 0 EIADHM C[C@@H]1SCCN(Cc2c(C(=O)[O-])sc3cccc(F)c32)[C@H]1C ZINC000317238056 1025843819 /nfs/dbraw/zinc/84/38/19/1025843819.db2.gz VXAKGLRJEZMYJT-UWVGGRQHSA-N -1 3 339.457 4.064 20 0 EIADHM CC(C)c1ccc(C(=O)N2CCC3(CC2)C(F)(F)C3(F)F)c([O-])c1 ZINC000652751404 1025898679 /nfs/dbraw/zinc/89/86/79/1025898679.db2.gz AXFUONUXJWCGRT-UHFFFAOYSA-N -1 3 345.336 4.022 20 0 EIADHM CC(C)(C)Nc1ccccc1NCc1nc(C(F)(F)F)cc(=O)[n-]1 ZINC000277448774 1026051344 /nfs/dbraw/zinc/05/13/44/1026051344.db2.gz HSJHXBNIQMBZGZ-UHFFFAOYSA-N -1 3 340.349 4.024 20 0 EIADHM O=C(N=c1cc(-c2ccccc2)[n-][nH]1)c1cc(F)ccc1-c1ccoc1 ZINC000473672236 1026108697 /nfs/dbraw/zinc/10/86/97/1026108697.db2.gz BRTDTWJYRPOTAC-UHFFFAOYSA-N -1 3 347.349 4.150 20 0 EIADHM C[C@@H](c1ccc(C(=O)[O-])o1)N1CCC(OC2CCC(C)CC2)CC1 ZINC000563278204 1026320961 /nfs/dbraw/zinc/32/09/61/1026320961.db2.gz SDDFOVQKOOBUDN-SLTAFYQDSA-N -1 3 335.444 4.099 20 0 EIADHM CC(C)c1ccc2c(c1)[C@H](NC(=O)c1c[n-]c3ccccc3c1=O)CC2 ZINC000187251457 1026362517 /nfs/dbraw/zinc/36/25/17/1026362517.db2.gz CRMLIIWKSVOQOL-HXUWFJFHSA-N -1 3 346.430 4.069 20 0 EIADHM O=C([O-])c1ccc(CNCc2ccc(Cl)c(C(F)(F)F)c2)cc1 ZINC000426706182 1026503673 /nfs/dbraw/zinc/50/36/73/1026503673.db2.gz RSLCLSVWOZUOJM-UHFFFAOYSA-N -1 3 343.732 4.347 20 0 EIADHM O=C([O-])[C@@H](NCc1cc(Cl)cc(Cl)c1)c1ccc(F)cc1 ZINC000426773287 1026553702 /nfs/dbraw/zinc/55/37/02/1026553702.db2.gz JFQNFJIAHSKADH-AWEZNQCLSA-N -1 3 328.170 4.048 20 0 EIADHM COc1cccc([C@@H](CC(=O)[O-])NCc2ccc(CC(C)C)cc2)c1 ZINC000426790071 1026565235 /nfs/dbraw/zinc/56/52/35/1026565235.db2.gz AEWPHTXLUCGSLY-HXUWFJFHSA-N -1 3 341.451 4.199 20 0 EIADHM O=C([O-])C[C@@H](NCc1cc(F)cc(Cl)c1)c1cccc(Cl)c1 ZINC000426809679 1026573331 /nfs/dbraw/zinc/57/33/31/1026573331.db2.gz WGZPIRNURVZFGW-OAHLLOKOSA-N -1 3 342.197 4.438 20 0 EIADHM O=C([O-])[C@H]1CCCN([C@H](c2ccc(F)cc2)c2ccc(Cl)cc2)C1 ZINC000107840379 1026575014 /nfs/dbraw/zinc/57/50/14/1026575014.db2.gz XLMZGOFPMDJNNY-YJBOKZPZSA-N -1 3 347.817 4.365 20 0 EIADHM COc1ccc([C@H](NCc2ccc(C(C)(C)C)cc2)C(=O)[O-])cc1F ZINC000426823977 1026581652 /nfs/dbraw/zinc/58/16/52/1026581652.db2.gz KUOXXQRWCNRPTQ-SFHVURJKSA-N -1 3 345.414 4.047 20 0 EIADHM Cc1cccc(C(=O)Nc2ccccc2-c2ncc3n2CCCC3)c1[O-] ZINC000684865347 1026611511 /nfs/dbraw/zinc/61/15/11/1026611511.db2.gz YAZITXSSFAUHOZ-UHFFFAOYSA-N -1 3 347.418 4.153 20 0 EIADHM COc1ccc([C@H]2CCCN2Cc2cccc([O-])c2Cl)cc1OC ZINC000507081491 1026633258 /nfs/dbraw/zinc/63/32/58/1026633258.db2.gz JXYCYJJMDZDIFY-OAHLLOKOSA-N -1 3 347.842 4.400 20 0 EIADHM O=C(Nc1ccc(Cl)cc1[O-])c1ccc([C@@H]2CCCOC2)cc1 ZINC000507086549 1026636668 /nfs/dbraw/zinc/63/66/68/1026636668.db2.gz HPDIAPGQSKTDCB-CQSZACIVSA-N -1 3 331.799 4.192 20 0 EIADHM [O-]c1ccc(F)c(CN2CCn3cccc3[C@H]2c2ccccc2)c1F ZINC000507295951 1026733252 /nfs/dbraw/zinc/73/32/52/1026733252.db2.gz QUHVRTLRZLOGMS-HXUWFJFHSA-N -1 3 340.373 4.077 20 0 EIADHM CN(Cc1cc(Br)cs1)Cc1c(F)ccc([O-])c1F ZINC000507531428 1026829561 /nfs/dbraw/zinc/82/95/61/1026829561.db2.gz KCNJJPIJMNQSJL-UHFFFAOYSA-N -1 3 348.212 4.126 20 0 EIADHM O=C([O-])[C@H]1C[C@H](NCc2c(Cl)cccc2Oc2ccccc2)C1 ZINC000563432532 1026936478 /nfs/dbraw/zinc/93/64/78/1026936478.db2.gz HTYYZCNAKDRXGS-JOCQHMNTSA-N -1 3 331.799 4.085 20 0 EIADHM [O-]c1c(F)cc(Nc2c(Cl)c(F)nc(F)c2Cl)cc1F ZINC001213371081 1027051299 /nfs/dbraw/zinc/05/12/99/1027051299.db2.gz VVTHTOPKFJZEJE-UHFFFAOYSA-N -1 3 327.064 4.394 20 0 EIADHM O=C(Cn1ccc2ccccc21)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000440987443 1027183497 /nfs/dbraw/zinc/18/34/97/1027183497.db2.gz KHAGTXQCTPEBMP-UHFFFAOYSA-N -1 3 334.297 4.004 20 0 EIADHM O=C(c1ccc(O)cc1[O-])N1CCC[C@H]1c1cccc2ccccc21 ZINC000034777352 1027301664 /nfs/dbraw/zinc/30/16/64/1027301664.db2.gz DBGMFYKYOBLITL-IBGZPJMESA-N -1 3 333.387 4.228 20 0 EIADHM COC(=O)c1oc2cc(F)ccc2c1Nc1cc(F)c([O-])c(F)c1 ZINC001213374871 1027498761 /nfs/dbraw/zinc/49/87/61/1027498761.db2.gz CTPUAPPGDGMLCB-UHFFFAOYSA-N -1 3 337.253 4.086 20 0 EIADHM CCc1cccc(C(=O)N2CCC(=Cc3ccccc3F)CC2)c1[O-] ZINC000532312329 1027555956 /nfs/dbraw/zinc/55/59/56/1027555956.db2.gz KVJFEMOUACTIQY-UHFFFAOYSA-N -1 3 339.410 4.413 20 0 EIADHM Cc1ccc(-c2nnc([N-]C(=O)c3cccc(F)c3F)s2)c(C)c1 ZINC000102242442 1027568077 /nfs/dbraw/zinc/56/80/77/1027568077.db2.gz FLCVXAGLYMDJQM-UHFFFAOYSA-N -1 3 345.374 4.352 20 0 EIADHM CC(C)(C)Sc1ccc(NC(=O)c2cccc3n[n-]nc32)cc1 ZINC000783596577 1027580482 /nfs/dbraw/zinc/58/04/82/1027580482.db2.gz MCEWXZIHYXXNNJ-UHFFFAOYSA-N -1 3 326.425 4.101 20 0 EIADHM CC(C)(C)[C@@H]1CCC[C@@H](NC(=O)c2cc(=O)c3ccccc3[n-]2)CC1 ZINC000444438200 1027744987 /nfs/dbraw/zinc/74/49/87/1027744987.db2.gz RGBLKXQWROLJTA-HUUCEWRRSA-N -1 3 340.467 4.253 20 0 EIADHM CC(C)CC(=O)Nc1ccc(NC(=O)c2cc([O-])ccc2Cl)cc1 ZINC000431512093 1027817185 /nfs/dbraw/zinc/81/71/85/1027817185.db2.gz DAIPOKPYRYBNRH-UHFFFAOYSA-N -1 3 346.814 4.283 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2cccc(Cl)c2F)c(Cl)c1 ZINC000022514048 1027864293 /nfs/dbraw/zinc/86/42/93/1027864293.db2.gz VNLKPMROWWTQBI-UHFFFAOYSA-N -1 3 334.199 4.242 20 0 EIADHM COc1cccc(C(=O)N2C[C@@H](C(C)(C)C)c3ccccc32)c1[O-] ZINC000443869800 1028023336 /nfs/dbraw/zinc/02/33/36/1028023336.db2.gz QPKPGQDSNACCGX-OAHLLOKOSA-N -1 3 325.408 4.191 20 0 EIADHM O=C(Nc1ncccc1[O-])c1cnn(C2CCCC2)c1-c1ccccc1 ZINC000583137459 1028069193 /nfs/dbraw/zinc/06/91/93/1028069193.db2.gz LPSYEUBBYKWUTH-UHFFFAOYSA-N -1 3 348.406 4.018 20 0 EIADHM CC[C@H](NC(=O)NCc1ccc([O-])c(F)c1)c1ccc(Cl)s1 ZINC000523468474 1028136520 /nfs/dbraw/zinc/13/65/20/1028136520.db2.gz KDSXYAIZXSGUAR-NSHDSACASA-N -1 3 342.823 4.197 20 0 EIADHM CCc1ccc([O-])c(C(=O)N2CC3(CCC3)c3c2cccc3F)c1 ZINC000523612662 1028264236 /nfs/dbraw/zinc/26/42/36/1028264236.db2.gz RIVBEPCSQIWNLA-UHFFFAOYSA-N -1 3 325.383 4.176 20 0 EIADHM [O-]c1cc(Cl)cnc1O[C@H]1CCc2c1cccc2Br ZINC001227981236 1028699279 /nfs/dbraw/zinc/69/92/79/1028699279.db2.gz UWUSXCDOIMVCHD-ZDUSSCGKSA-N -1 3 340.604 4.269 20 0 EIADHM CC(=O)c1cccc(NC(=O)[C@@H](c2ccc(F)cc2)C(C)C)c1[O-] ZINC000583442527 1028735983 /nfs/dbraw/zinc/73/59/83/1028735983.db2.gz GXBKURBTINYTTQ-QGZVFWFLSA-N -1 3 329.371 4.112 20 0 EIADHM O=S(=O)([N-][C@@H](c1cccc(Cl)c1)C1CCCC1)c1ccco1 ZINC000445739917 1028867716 /nfs/dbraw/zinc/86/77/16/1028867716.db2.gz LNXULBIMHRTFNJ-MRXNPFEDSA-N -1 3 339.844 4.143 20 0 EIADHM Cc1c2cc(C)ccc2sc1C(=O)Nc1n[n-]c(-c2ccco2)n1 ZINC000446090441 1029128640 /nfs/dbraw/zinc/12/86/40/1029128640.db2.gz LQCXQMGJQAJDQC-UHFFFAOYSA-N -1 3 338.392 4.149 20 0 EIADHM CCCOc1ccc(CN[C@@H](CC(=O)[O-])c2cccc(Cl)c2)cc1 ZINC000583788841 1029178078 /nfs/dbraw/zinc/17/80/78/1029178078.db2.gz RVZLJDCGRKUPMZ-SFHVURJKSA-N -1 3 347.842 4.434 20 0 EIADHM CCC[C@H]([N-]S(=O)(=O)c1cccc(Cl)c1Cl)C(C)(C)C ZINC001211894527 1029312112 /nfs/dbraw/zinc/31/21/12/1029312112.db2.gz RONDVBTZSYMIKM-LBPRGKRZSA-N -1 3 338.300 4.487 20 0 EIADHM CCSc1cccc(F)c1[N-]S(=O)(=O)Cc1ccc(C)cc1 ZINC000583879469 1029313894 /nfs/dbraw/zinc/31/38/94/1029313894.db2.gz AIHLEVMKXNQXHU-UHFFFAOYSA-N -1 3 339.457 4.188 20 0 EIADHM Cc1cc(=O)[n-]c([C@@H](C)N[C@@H](C)c2cc(F)c(Cl)cc2Cl)n1 ZINC000192722487 1029369838 /nfs/dbraw/zinc/36/98/38/1029369838.db2.gz KEXBONLPGMTERJ-DTWKUNHWSA-N -1 3 344.217 4.348 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2ccc(OC(C)(C)C)cc2)cc1C ZINC000525013010 1029389718 /nfs/dbraw/zinc/38/97/18/1029389718.db2.gz LXNFWYKLGWTQFV-UHFFFAOYSA-N -1 3 333.453 4.282 20 0 EIADHM CCc1ccc(-c2nc(Cc3ccc4ccccc4n3)no2)c([O-])c1 ZINC000685238041 1029411882 /nfs/dbraw/zinc/41/18/82/1029411882.db2.gz BWTDKBLVIYPWRZ-UHFFFAOYSA-N -1 3 331.375 4.144 20 0 EIADHM COc1cc(C)cc(C)c1S(=O)(=O)[N-]c1c(C)cccc1Cl ZINC000446754305 1029559129 /nfs/dbraw/zinc/55/91/29/1029559129.db2.gz VWWSCZGRBTVGTI-UHFFFAOYSA-N -1 3 339.844 4.075 20 0 EIADHM CCN(Cc1cccc(F)c1)C(=O)CCCc1ccc([O-])c(F)c1 ZINC000468366147 1029562015 /nfs/dbraw/zinc/56/20/15/1029562015.db2.gz DTFWMHRKYVYBJL-UHFFFAOYSA-N -1 3 333.378 4.042 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N3CCC[C@H](CC(C)C)C3)nc2)n1 ZINC000301661016 1029782981 /nfs/dbraw/zinc/78/29/81/1029782981.db2.gz XMFUXOFPXZFSBQ-OAHLLOKOSA-N -1 3 340.471 4.069 20 0 EIADHM CC[C@H](c1ccncc1)N(C)Cc1nc2c3ccccc3oc2c(=O)[n-]1 ZINC000092225192 1029893511 /nfs/dbraw/zinc/89/35/11/1029893511.db2.gz QCWOXMPQQZYWKP-OAHLLOKOSA-N -1 3 348.406 4.060 20 0 EIADHM CCc1cccc(C(=O)N2CCCCC[C@@H]2[C@@H]2CCCCC2=O)c1[O-] ZINC000092429853 1029909238 /nfs/dbraw/zinc/90/92/38/1029909238.db2.gz YBBZURBJLVSSCQ-FUHWJXTLSA-N -1 3 343.467 4.099 20 0 EIADHM Cn1ccc(C(=O)Nc2ccc([O-])c(-c3nc4ccccc4s3)c2)c1 ZINC000093094880 1029965643 /nfs/dbraw/zinc/96/56/43/1029965643.db2.gz LFWORVUTYXTATK-UHFFFAOYSA-N -1 3 349.415 4.260 20 0 EIADHM COC(=O)CCN(Cc1c(Cl)cc([O-])cc1Cl)C1CCCC1 ZINC001142115084 1029995934 /nfs/dbraw/zinc/99/59/34/1029995934.db2.gz WLIPQPSSZWSOKC-UHFFFAOYSA-N -1 3 346.254 4.007 20 0 EIADHM Cc1cc(C)c([N-]S(=O)(=O)c2ccc(OC(C)C)cc2)c(C)c1 ZINC000096659343 1030018701 /nfs/dbraw/zinc/01/87/01/1030018701.db2.gz CFNPBVWPVDGNHU-UHFFFAOYSA-N -1 3 333.453 4.200 20 0 EIADHM C[C@@H]1C[C@@H](C(=O)[O-])C[C@H](C)N1Cc1cc(-c2ccccc2Cl)on1 ZINC000530173081 1030191194 /nfs/dbraw/zinc/19/11/94/1030191194.db2.gz CDJNMVBGMWHBGR-CLLJXQQHSA-N -1 3 348.830 4.069 20 0 EIADHM C[C@@H]1C[C@@H](C(=O)[O-])C[C@H](C)N1CCc1cccc(Cl)c1Cl ZINC000530178122 1030201284 /nfs/dbraw/zinc/20/12/84/1030201284.db2.gz YNXDKCYWRUFMBH-PTEHBNRSSA-N -1 3 330.255 4.110 20 0 EIADHM O=C(Nc1ccc(SC2CCCC2)cc1)c1cccc2n[n-]nc21 ZINC000526119148 1030288852 /nfs/dbraw/zinc/28/88/52/1030288852.db2.gz IJENVAZDWMPZPU-UHFFFAOYSA-N -1 3 338.436 4.245 20 0 EIADHM Cc1ccc(-c2csc3ncnc(NCc4ncccc4[O-])c23)cc1 ZINC000530431514 1030404922 /nfs/dbraw/zinc/40/49/22/1030404922.db2.gz JPGIOYSYNJZTEQ-UHFFFAOYSA-N -1 3 348.431 4.379 20 0 EIADHM Cc1cc(=O)[n-]c([C@@H](C)N[C@H](c2ccc(F)c(Cl)c2)C2CC2)n1 ZINC000451354028 1030430577 /nfs/dbraw/zinc/43/05/77/1030430577.db2.gz MBLQQMPQPLYUAA-HWPZZCPQSA-N -1 3 335.810 4.085 20 0 EIADHM Cc1ccc2[nH]c3c(c2c1)CN(C(=O)c1cc([O-])ccc1Cl)CC3 ZINC000685601561 1030557413 /nfs/dbraw/zinc/55/74/13/1030557413.db2.gz HMFPXZWWXXMLJS-UHFFFAOYSA-N -1 3 340.810 4.034 20 0 EIADHM O=C(c1cc(=O)c2ccccc2[n-]1)N1CCC[C@H]1CC1CCCCC1 ZINC000145928067 1030692339 /nfs/dbraw/zinc/69/23/39/1030692339.db2.gz BVFLYULPASGIAA-INIZCTEOSA-N -1 3 338.451 4.103 20 0 EIADHM CSc1ccccc1[N-]S(=O)(=O)Cc1ccccc1Cl ZINC000039975119 1030768454 /nfs/dbraw/zinc/76/84/54/1030768454.db2.gz XNQHVPPWIBTVHA-UHFFFAOYSA-N -1 3 327.858 4.004 20 0 EIADHM O=C(Nc1cc(F)ccc1[O-])c1cc2c(cccc2Br)[nH]1 ZINC000531135575 1030895817 /nfs/dbraw/zinc/89/58/17/1030895817.db2.gz XKWYJWJGKPFSSF-UHFFFAOYSA-N -1 3 349.159 4.027 20 0 EIADHM CCCC[C@H](CC)CN1C[C@H]2C[C@@H](C1)N2C(=O)c1ccccc1[S-] ZINC001272014243 1031037638 /nfs/dbraw/zinc/03/76/38/1031037638.db2.gz YSKJCBMUCGXPTG-YESZJQIVSA-N -1 3 346.540 4.090 20 0 EIADHM CCc1ccc(C(=O)N2[C@H](C)[C@@H](CC(F)(F)F)C[C@@H]2C)c([O-])c1 ZINC000452666923 1031245609 /nfs/dbraw/zinc/24/56/09/1031245609.db2.gz ULZSCDANTMXOPY-DMDPSCGWSA-N -1 3 329.362 4.146 20 0 EIADHM O=C([N-]c1nc(-c2ccsc2)ns1)c1cc(Cl)ccc1F ZINC000109111016 1031296001 /nfs/dbraw/zinc/29/60/01/1031296001.db2.gz XQHQMCAZHREEMB-UHFFFAOYSA-N -1 3 339.804 4.311 20 0 EIADHM COc1cccc(-c2nc(-c3ccccc3OC3CCC3)no2)c1[O-] ZINC000528258934 1031307840 /nfs/dbraw/zinc/30/78/40/1031307840.db2.gz OQJRITAUIAGNIA-UHFFFAOYSA-N -1 3 338.363 4.049 20 0 EIADHM CC(C)c1ccc(C(=O)N2CCC(F)(c3cccnc3)CC2)c([O-])c1 ZINC000375893999 1031458366 /nfs/dbraw/zinc/45/83/66/1031458366.db2.gz BMEURXYPMMXMAO-UHFFFAOYSA-N -1 3 342.414 4.012 20 0 EIADHM CCCc1nnc([N-]C(=O)c2nc(C)sc2-c2ccccc2)s1 ZINC000040326566 1031458333 /nfs/dbraw/zinc/45/83/33/1031458333.db2.gz DGNBUJOOMFWXFG-UHFFFAOYSA-N -1 3 344.465 4.175 20 0 EIADHM Cc1ccc(-c2nc(CC(=O)Nc3cccc([O-])c3F)cs2)cc1 ZINC000129461009 1031797486 /nfs/dbraw/zinc/79/74/86/1031797486.db2.gz RXUKNSOIEGJEER-UHFFFAOYSA-N -1 3 342.395 4.144 20 0 EIADHM COc1c(C)cc(S(=O)(=O)[N-]c2ccccc2C(C)C)cc1C ZINC000512580596 1033430091 /nfs/dbraw/zinc/43/00/91/1033430091.db2.gz CEIXSKNGRTWLQA-UHFFFAOYSA-N -1 3 333.453 4.236 20 0 EIADHM CCCCOc1cccc(F)c1Nc1cccc(C(=O)N(C)C)c1[O-] ZINC001211796856 1033944358 /nfs/dbraw/zinc/94/43/58/1033944358.db2.gz OEFNLBCNDXJSIR-UHFFFAOYSA-N -1 3 346.402 4.156 20 0 EIADHM O=C(c1cc([O-])ccc1Cl)N1CCCCC[C@H]1[C@@H]1CCCCC1=O ZINC000433367138 1034280790 /nfs/dbraw/zinc/28/07/90/1034280790.db2.gz PVLQGTNSFVLHLY-YOEHRIQHSA-N -1 3 349.858 4.190 20 0 EIADHM Cc1c(Cl)cc(F)c([N-]C(=O)c2noc3c2C[C@@H](C)CC3)c1F ZINC000433858245 1034967954 /nfs/dbraw/zinc/96/79/54/1034967954.db2.gz IUSVIKHJRAFOQN-ZETCQYMHSA-N -1 3 340.757 4.292 20 0 EIADHM CC[C@H](c1ccccc1)N(CC)C(=O)c1cc(=O)c2ccccc2[n-]1 ZINC000345843404 1035314478 /nfs/dbraw/zinc/31/44/78/1035314478.db2.gz UZIXDANEKOVOGT-LJQANCHMSA-N -1 3 334.419 4.142 20 0 EIADHM Cc1ccc([O-])c(NC(=O)c2occc2CSc2ccccc2)n1 ZINC000345926306 1035332706 /nfs/dbraw/zinc/33/27/06/1035332706.db2.gz BOXJFRROWDORCL-UHFFFAOYSA-N -1 3 340.404 4.233 20 0 EIADHM O=C(NC1(Cc2cccc(F)c2)CCC1)c1cc([O-])ccc1Cl ZINC000501320565 1035418977 /nfs/dbraw/zinc/41/89/77/1035418977.db2.gz QAMKDCJVAPWLFU-UHFFFAOYSA-N -1 3 333.790 4.080 20 0 EIADHM CC(C)(C)[C@@H]1OCCC[C@H]1CNC(=O)c1cc([O-])c2ccccc2c1 ZINC000575222427 1035730823 /nfs/dbraw/zinc/73/08/23/1035730823.db2.gz AEHRSXXTLITWMA-HNAYVOBHSA-N -1 3 341.451 4.117 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1cccc(F)c1Br ZINC000485497510 1035952679 /nfs/dbraw/zinc/95/26/79/1035952679.db2.gz BNLLCUBQBWZYSK-UHFFFAOYSA-N -1 3 344.567 4.200 20 0 EIADHM [O-]c1c(Cl)cc(CN2C[C@H]3CCCC[C@@H]3C2)cc1Br ZINC001231745635 1036057712 /nfs/dbraw/zinc/05/77/12/1036057712.db2.gz GLTRMMMICDVBJR-VXGBXAGGSA-N -1 3 344.680 4.430 20 0 EIADHM CCC[C@H](C)CC(=O)Nc1cccc(-c2nc(CC)cc(=O)[n-]2)c1 ZINC000498508238 1036375685 /nfs/dbraw/zinc/37/56/85/1036375685.db2.gz SQFQWCOFJHTSIE-ZDUSSCGKSA-N -1 3 327.428 4.176 20 0 EIADHM CCC[C@@]1(C)CCCN(CCOc2ccc(C(=O)[O-])cc2Cl)C1 ZINC000572008735 1036407706 /nfs/dbraw/zinc/40/77/06/1036407706.db2.gz YZXGXRQNHRTQRM-SFHVURJKSA-N -1 3 339.863 4.319 20 0 EIADHM Cc1ccccc1-c1cc(=NC(=O)C[C@H](C)c2ccccc2F)[nH][n-]1 ZINC000588698917 1036414886 /nfs/dbraw/zinc/41/48/86/1036414886.db2.gz HQENZTWLYQTSFB-AWEZNQCLSA-N -1 3 337.398 4.078 20 0 EIADHM CCCCOc1ccc(C=Cc2cc(=O)[n-]c(-c3ccncc3)n2)cc1 ZINC000486056030 1036460990 /nfs/dbraw/zinc/46/09/90/1036460990.db2.gz UYYHRURTRJTLCI-QPJJXVBHSA-N -1 3 347.418 4.181 20 0 EIADHM CCC[C@@H]1CCCC[C@H]1C[N-]S(=O)(=O)c1cc(F)ccc1Cl ZINC001212163372 1037054128 /nfs/dbraw/zinc/05/41/28/1037054128.db2.gz VKMRCDQXLHJIPX-OLZOCXBDSA-N -1 3 347.883 4.364 20 0 EIADHM O=C([N-][C@@H](c1nccs1)c1ccccc1)C(F)(F)c1ccccc1 ZINC000171495601 1037436907 /nfs/dbraw/zinc/43/69/07/1037436907.db2.gz QOEDDCVCMTULKB-OAHLLOKOSA-N -1 3 344.386 4.141 20 0 EIADHM COc1ccccc1[C@@H]1CCCCN1C(=O)c1ccc(C)cc1[O-] ZINC000591980280 1037703049 /nfs/dbraw/zinc/70/30/49/1037703049.db2.gz KUGSRCUEKCBNSZ-KRWDZBQOSA-N -1 3 325.408 4.077 20 0 EIADHM O=c1cc(CSCc2ncc(-c3ccccc3)o2)nc(C2CC2)[n-]1 ZINC000573906325 1037718918 /nfs/dbraw/zinc/71/89/18/1037718918.db2.gz MWSHBFTZXWXFPS-UHFFFAOYSA-N -1 3 339.420 4.148 20 0 EIADHM O=C(Nc1ccc(Br)cc1[O-])c1cc2occc2s1 ZINC000605502509 1037809551 /nfs/dbraw/zinc/80/95/51/1037809551.db2.gz SDCIQSDSTCQPRB-UHFFFAOYSA-N -1 3 338.182 4.215 20 0 EIADHM Cc1cc(SC(C)(C)C)ccc1NC([O-])=NO[C@H]1CCCCO1 ZINC000155959081 1037814273 /nfs/dbraw/zinc/81/42/73/1037814273.db2.gz GLUYTDTZIVXOEV-HNNXBMFYSA-N -1 3 338.473 4.465 20 0 EIADHM Cc1cc(SC(C)(C)C)ccc1NC(=O)[N-]O[C@H]1CCCCO1 ZINC000155959081 1037814275 /nfs/dbraw/zinc/81/42/75/1037814275.db2.gz GLUYTDTZIVXOEV-HNNXBMFYSA-N -1 3 338.473 4.465 20 0 EIADHM CC(C)c1ccc([C@H](C)CC(=O)Nc2n[n-]c(-c3ccco3)n2)cc1 ZINC000606365249 1038037491 /nfs/dbraw/zinc/03/74/91/1038037491.db2.gz WDOGSBWRWSRXPP-CYBMUJFWSA-N -1 3 338.411 4.320 20 0 EIADHM CC(C)c1ccc(CCCNC(=O)NCc2ccc([O-])c(F)c2)cc1 ZINC000606693216 1038213577 /nfs/dbraw/zinc/21/35/77/1038213577.db2.gz YEKHVMXTQPXYLJ-UHFFFAOYSA-N -1 3 344.430 4.087 20 0 EIADHM COc1cc(/C=C2\COc3c(C)cccc3C2=O)cc(Cl)c1[O-] ZINC000063411595 1038310715 /nfs/dbraw/zinc/31/07/15/1038310715.db2.gz WXZFCEABTLWNAK-WUXMJOGZSA-N -1 3 330.767 4.021 20 0 EIADHM Cc1c(Cl)c(CN2CCC[C@@H](CCC(=O)[O-])C2)nc2ccccc12 ZINC000261894047 1038380854 /nfs/dbraw/zinc/38/08/54/1038380854.db2.gz ODGQDQSITKKDIM-AWEZNQCLSA-N -1 3 346.858 4.273 20 0 EIADHM O=C(Nc1ccc(Cl)cc1[O-])C1(Oc2ccc(Cl)cc2)CC1 ZINC000550715142 1038801038 /nfs/dbraw/zinc/80/10/38/1038801038.db2.gz ICDMWDGRSJBKIF-UHFFFAOYSA-N -1 3 338.190 4.249 20 0 EIADHM Cc1ccc(Cl)c(S(=O)(=O)[N-][C@@H]2C[C@H]2CC(C)C)c1Cl ZINC001212113128 1038833933 /nfs/dbraw/zinc/83/39/33/1038833933.db2.gz BQORLVUQPFQBST-ZYHUDNBSSA-N -1 3 336.284 4.015 20 0 EIADHM CCC[C@@H](CC)Sc1nc2c(cnn2-c2ccccc2)c(=O)[n-]1 ZINC000480854026 1038845198 /nfs/dbraw/zinc/84/51/98/1038845198.db2.gz RWDYDEXTFJKFQE-CYBMUJFWSA-N -1 3 328.441 4.192 20 0 EIADHM CCCCCc1nnc([N-]C(=O)c2ccc(F)c(Cl)c2F)s1 ZINC000539369856 1039013420 /nfs/dbraw/zinc/01/34/20/1039013420.db2.gz QDKGXCMLSQRWFX-UHFFFAOYSA-N -1 3 345.802 4.455 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N3CCCC(CC)(CC)C3)nc2)n1 ZINC000664409203 1039233897 /nfs/dbraw/zinc/23/38/97/1039233897.db2.gz OHOQWRUTKRJUFD-UHFFFAOYSA-N -1 3 340.471 4.213 20 0 EIADHM CC(C)c1cc(C(=O)[N-]c2cc(F)cc(Br)c2F)no1 ZINC000555528665 1039347457 /nfs/dbraw/zinc/34/74/57/1039347457.db2.gz MAAKYHXPBUSBCG-UHFFFAOYSA-N -1 3 345.143 4.091 20 0 EIADHM CSc1ccc(S(=O)(=O)[N-]c2cccc(Cl)c2F)cc1 ZINC000064474791 1039385611 /nfs/dbraw/zinc/38/56/11/1039385611.db2.gz NVFOMCMCULZVSY-UHFFFAOYSA-N -1 3 331.821 4.002 20 0 EIADHM C[C@H](Oc1ccc(F)cc1Cl)C(=O)Nc1c([O-])cccc1Cl ZINC000552434685 1039512835 /nfs/dbraw/zinc/51/28/35/1039512835.db2.gz VVQMVADIDASNPG-QMMMGPOBSA-N -1 3 344.169 4.244 20 0 EIADHM O=C(CCCOc1ccc(Cl)cc1)Nc1c([O-])cccc1Cl ZINC000552434612 1039514227 /nfs/dbraw/zinc/51/42/27/1039514227.db2.gz RLIYHKKNKWXGKD-UHFFFAOYSA-N -1 3 340.206 4.497 20 0 EIADHM COc1ccc(CCCC(=O)Nc2cc(Cl)ccc2[O-])c(OC)c1 ZINC000514068297 1039546924 /nfs/dbraw/zinc/54/69/24/1039546924.db2.gz GOUUESOHQQIQMN-UHFFFAOYSA-N -1 3 349.814 4.024 20 0 EIADHM CC(C)[C@@H](c1ccc(F)cc1)N(C)Cc1nc(=O)c2sccc2[n-]1 ZINC000434612066 1039711066 /nfs/dbraw/zinc/71/10/66/1039711066.db2.gz NVAKMHFZGJSQKN-INIZCTEOSA-N -1 3 345.443 4.365 20 0 EIADHM Cc1cc(OCC(=O)Nc2c([O-])cccc2Cl)ccc1C(C)C ZINC000552782577 1039817608 /nfs/dbraw/zinc/81/76/08/1039817608.db2.gz UOFNXFAZMULWKB-UHFFFAOYSA-N -1 3 333.815 4.495 20 0 EIADHM CO[C@H](c1noc(-c2cc(Cc3ccccc3)ccc2[O-])n1)C(C)C ZINC000556011627 1039861546 /nfs/dbraw/zinc/86/15/46/1039861546.db2.gz PGPBRAOQBYHECC-SFHVURJKSA-N -1 3 338.407 4.377 20 0 EIADHM O=C(Nc1cccc(CC(F)(F)F)c1)c1cc([O-])ccc1Cl ZINC000551195431 1040054975 /nfs/dbraw/zinc/05/49/75/1040054975.db2.gz GAUGGLFNQQTACU-UHFFFAOYSA-N -1 3 329.705 4.403 20 0 EIADHM O=C(c1ccccc1[O-])N1CCC[C@@H](c2nc3ccccc3s2)C1 ZINC000514717060 1040175171 /nfs/dbraw/zinc/17/51/71/1040175171.db2.gz VSHXXTFTBLEFPD-CYBMUJFWSA-N -1 3 338.432 4.022 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)Nc1nc2c(cccc2Cl)[nH]1 ZINC000553430886 1040214511 /nfs/dbraw/zinc/21/45/11/1040214511.db2.gz AOFOCKKJKJSXHJ-UHFFFAOYSA-N -1 3 347.777 4.022 20 0 EIADHM O=S(=O)([N-]c1ccccc1F)c1ccc2c(c1)Cc1ccccc1-2 ZINC000514804714 1040250396 /nfs/dbraw/zinc/25/03/96/1040250396.db2.gz RFCKHPYJJHXXAH-UHFFFAOYSA-N -1 3 339.391 4.198 20 0 EIADHM CCCc1cc(=O)[n-]c(C(=Cc2ccc(OCC3CC3)cc2)CC)n1 ZINC000435340319 1040294175 /nfs/dbraw/zinc/29/41/75/1040294175.db2.gz GJEMFAPSYDUXPT-SFQUDFHCSA-N -1 3 338.451 4.462 20 0 EIADHM CCc1ccc(CNCc2cccc([O-])c2Br)s1 ZINC000315319179 1040303262 /nfs/dbraw/zinc/30/32/62/1040303262.db2.gz HIVGVSLRDOWTKT-UHFFFAOYSA-N -1 3 326.259 4.068 20 0 EIADHM COc1ccc(NC(=O)CCCc2ccc([O-])c(F)c2)cc1SC ZINC000457896142 1040336202 /nfs/dbraw/zinc/33/62/02/1040336202.db2.gz CHCWGOIMQKLGMV-UHFFFAOYSA-N -1 3 349.427 4.223 20 0 EIADHM CCc1cc(=O)[n-]c(CSCc2ccc(Br)s2)n1 ZINC000477364823 1040450438 /nfs/dbraw/zinc/45/04/38/1040450438.db2.gz ZISYETSVFWQEFD-UHFFFAOYSA-N -1 3 345.287 4.002 20 0 EIADHM CC(C)c1cnc(-c2ccc(NC([O-])=NO[C@@H]3CCCCO3)cc2)o1 ZINC000160464683 1040531990 /nfs/dbraw/zinc/53/19/90/1040531990.db2.gz YKBWRHGRCIMXPD-MRXNPFEDSA-N -1 3 345.399 4.045 20 0 EIADHM CC(C)c1cnc(-c2ccc(NC(=O)[N-]O[C@@H]3CCCCO3)cc2)o1 ZINC000160464683 1040532006 /nfs/dbraw/zinc/53/20/06/1040532006.db2.gz YKBWRHGRCIMXPD-MRXNPFEDSA-N -1 3 345.399 4.045 20 0 EIADHM O=C(N=c1cc(-c2ccccc2)o[n-]1)c1occc1-c1ccccc1 ZINC000479838643 1040699721 /nfs/dbraw/zinc/69/97/21/1040699721.db2.gz PUOAQMYFQXJWHJ-UHFFFAOYSA-N -1 3 330.343 4.276 20 0 EIADHM COc1ccc([O-])c(C(=O)Nc2ccc(CNc3ccccc3)cc2)c1 ZINC000480038633 1040880422 /nfs/dbraw/zinc/88/04/22/1040880422.db2.gz LDSHOEGBLFNKPM-UHFFFAOYSA-N -1 3 348.402 4.265 20 0 EIADHM Cc1ccc(Cl)c(S(=O)(=O)[N-]c2c(C)cccc2Cl)c1 ZINC000461110151 1041226564 /nfs/dbraw/zinc/22/65/64/1041226564.db2.gz GFJPRAJJCGQZCO-UHFFFAOYSA-N -1 3 330.236 4.411 20 0 EIADHM Cc1cccc(S(=O)(=O)[N-]c2c(C)cccc2Cl)c1Cl ZINC000461114066 1041246373 /nfs/dbraw/zinc/24/63/73/1041246373.db2.gz RGRLSOOFJJLCKA-UHFFFAOYSA-N -1 3 330.236 4.411 20 0 EIADHM O=C(Nc1ccc([O-])c(C(F)(F)F)c1)[C@H]1C[C@@H]1c1ccc(F)cc1 ZINC000540202964 1041260695 /nfs/dbraw/zinc/26/06/95/1041260695.db2.gz SOTHJEYPHRNURK-OLZOCXBDSA-N -1 3 339.288 4.292 20 0 EIADHM Cc1ccc(C(=O)N2CCS[C@H](C)[C@@H]2c2ccccc2)c([O-])c1 ZINC000436526888 1041309800 /nfs/dbraw/zinc/30/98/00/1041309800.db2.gz FRFQDPCRFZZPIB-RDTXWAMCSA-N -1 3 327.449 4.019 20 0 EIADHM COc1ccc(CCN(CC(C)(C)C)C(=O)c2ccccc2[O-])cc1 ZINC000436549412 1041325332 /nfs/dbraw/zinc/32/53/32/1041325332.db2.gz PYMMRLQBCYUKJW-UHFFFAOYSA-N -1 3 341.451 4.132 20 0 EIADHM CCN(Cc1ccncc1)C(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436541467 1041336200 /nfs/dbraw/zinc/33/62/00/1041336200.db2.gz VLMMYDGZNXANJS-UHFFFAOYSA-N -1 3 348.402 4.242 20 0 EIADHM CC(C)c1ccc(C(=O)N2CCC[C@@H](C(F)(F)F)[C@@H]2C)c([O-])c1 ZINC000436544799 1041338370 /nfs/dbraw/zinc/33/83/70/1041338370.db2.gz KSGMVTBCVDLJGT-SMDDNHRTSA-N -1 3 329.362 4.319 20 0 EIADHM CC(C)c1ccc(C(=O)N2CCC[C@H](C(F)(F)F)[C@H]2C)c([O-])c1 ZINC000436544796 1041339183 /nfs/dbraw/zinc/33/91/83/1041339183.db2.gz KSGMVTBCVDLJGT-RISCZKNCSA-N -1 3 329.362 4.319 20 0 EIADHM Cc1cccc(C(=O)N2CCCc3cc(Br)ccc32)c1[O-] ZINC000436566003 1041344808 /nfs/dbraw/zinc/34/48/08/1041344808.db2.gz STWXOTPFRCPJHQ-UHFFFAOYSA-N -1 3 346.224 4.056 20 0 EIADHM Cc1ccc(C(=O)Nc2c(F)cccc2N2CCCC2)c([O-])c1C ZINC000436569921 1041346861 /nfs/dbraw/zinc/34/68/61/1041346861.db2.gz KJRSNTJXCGVTEJ-UHFFFAOYSA-N -1 3 328.387 4.001 20 0 EIADHM CC(C)c1ccc(C(=O)N2CC[C@H](c3cccc(F)c3)C2)c([O-])c1 ZINC000436571813 1041350064 /nfs/dbraw/zinc/35/00/64/1041350064.db2.gz WYTNDVLXBMZHPX-INIZCTEOSA-N -1 3 327.399 4.284 20 0 EIADHM O=C(C[C@@H]1CCCCCN1C(=O)c1ccccc1[O-])c1ccccc1 ZINC000436581124 1041359856 /nfs/dbraw/zinc/35/98/56/1041359856.db2.gz YSKNWBMLWCAYMU-KRWDZBQOSA-N -1 3 337.419 4.050 20 0 EIADHM O=C(c1cc(Cc2ccccc2)ccc1[O-])N1CCc2ccccc21 ZINC000436581891 1041360699 /nfs/dbraw/zinc/36/06/99/1041360699.db2.gz GTASKIZMHXXCCN-UHFFFAOYSA-N -1 3 329.399 4.186 20 0 EIADHM CC(C)c1ccc(C(=O)NCc2ncoc2-c2ccccc2)c([O-])c1 ZINC000436583094 1041361745 /nfs/dbraw/zinc/36/17/45/1041361745.db2.gz NDBNZBKEEHPWII-UHFFFAOYSA-N -1 3 336.391 4.101 20 0 EIADHM CC(C)c1ccc(C(=O)N2CCC[C@@H](Nc3ccccc3)C2)c([O-])c1 ZINC000436600172 1041365803 /nfs/dbraw/zinc/36/58/03/1041365803.db2.gz DKZJJXQIYVXWGN-GOSISDBHSA-N -1 3 338.451 4.232 20 0 EIADHM CC(C)OCC(=O)Nc1ccc([O-])c(-c2nc3ccccc3s2)c1 ZINC000436601931 1041367301 /nfs/dbraw/zinc/36/73/01/1041367301.db2.gz JCKAYNXDXQACPT-UHFFFAOYSA-N -1 3 342.420 4.032 20 0 EIADHM CCCNc1ccccc1NC(=O)CCCc1ccc([O-])c(F)c1 ZINC000480539337 1041372271 /nfs/dbraw/zinc/37/22/71/1041372271.db2.gz KRZYSTSNKPZMEM-UHFFFAOYSA-N -1 3 330.403 4.315 20 0 EIADHM Cc1ccc([C@@H]2[C@H](C)CCCN2C(=O)c2ccc(O)cc2[O-])cc1 ZINC000436617633 1041374910 /nfs/dbraw/zinc/37/49/10/1041374910.db2.gz ISRRKBOTDNMBER-KUHUBIRLSA-N -1 3 325.408 4.020 20 0 EIADHM Cc1ccc([C@@H]2[C@@H](C)CCCN2C(=O)c2ccc(O)cc2[O-])cc1 ZINC000436617634 1041375063 /nfs/dbraw/zinc/37/50/63/1041375063.db2.gz ISRRKBOTDNMBER-LIRRHRJNSA-N -1 3 325.408 4.020 20 0 EIADHM Cc1ccc([C@H]2[C@@H](C)CCCN2C(=O)c2ccc(O)cc2[O-])cc1 ZINC000436617632 1041375822 /nfs/dbraw/zinc/37/58/22/1041375822.db2.gz ISRRKBOTDNMBER-IFXJQAMLSA-N -1 3 325.408 4.020 20 0 EIADHM Cc1nccc(-c2cccc(NC(=O)c3ccc(C)c(C)c3[O-])c2)n1 ZINC000436638846 1041388525 /nfs/dbraw/zinc/38/85/25/1041388525.db2.gz HNNUBSDZMROURP-UHFFFAOYSA-N -1 3 333.391 4.027 20 0 EIADHM Cc1ccc(C(=O)Nc2ccc(Cc3ccncc3)cc2)c([O-])c1C ZINC000436623414 1041390489 /nfs/dbraw/zinc/39/04/89/1041390489.db2.gz FJUMJPPYVIBPCR-UHFFFAOYSA-N -1 3 332.403 4.247 20 0 EIADHM CC(C)c1cnc(CSCc2cc(=O)[n-]c(-c3ccccc3)n2)o1 ZINC000842193872 1041393129 /nfs/dbraw/zinc/39/31/29/1041393129.db2.gz FUGCYYVXSBTYKL-UHFFFAOYSA-N -1 3 341.436 4.394 20 0 EIADHM CC(=O)c1ccc(C(=O)N2CC3(CCCC3)c3ccccc32)cc1[O-] ZINC000436654433 1041398547 /nfs/dbraw/zinc/39/85/47/1041398547.db2.gz JBUBAEVCKOQCRV-UHFFFAOYSA-N -1 3 335.403 4.067 20 0 EIADHM Cc1cccc([C@@H]2CCCCN2C(=O)c2ccc(O)cc2[O-])c1C ZINC000436669475 1041408190 /nfs/dbraw/zinc/40/81/90/1041408190.db2.gz LYBTXKNSEZXOOU-SFHVURJKSA-N -1 3 325.408 4.082 20 0 EIADHM Cc1ccc(C(=O)N2CCc3c(Cl)c(Cl)ccc3C2)c([O-])c1 ZINC000436696369 1041429682 /nfs/dbraw/zinc/42/96/82/1041429682.db2.gz IFZZDRZEFNAKID-UHFFFAOYSA-N -1 3 336.218 4.206 20 0 EIADHM Cc1ccc(C(=O)Nc2cc(F)ccc2OCC(F)(F)F)c([O-])c1 ZINC000436754697 1041466826 /nfs/dbraw/zinc/46/68/26/1041466826.db2.gz JMJAPGISARYHTD-UHFFFAOYSA-N -1 3 343.276 4.033 20 0 EIADHM CSCCCN(C)C(=O)c1cc(CCc2ccccc2)ccc1[O-] ZINC000436783103 1041479044 /nfs/dbraw/zinc/47/90/44/1041479044.db2.gz QISNXMFWHQTCPL-UHFFFAOYSA-N -1 3 343.492 4.003 20 0 EIADHM CN(CC(C)(C)C)C(=O)c1cc(CCc2ccccc2)ccc1[O-] ZINC000436782975 1041479312 /nfs/dbraw/zinc/47/93/12/1041479312.db2.gz DZWPLPJODWSCTR-UHFFFAOYSA-N -1 3 325.452 4.296 20 0 EIADHM CCSc1cccc(-c2noc(-c3cccc(OC)c3[O-])n2)c1 ZINC000436786293 1041481050 /nfs/dbraw/zinc/48/10/50/1041481050.db2.gz CXGBYVDETMPRHZ-UHFFFAOYSA-N -1 3 328.393 4.230 20 0 EIADHM C[C@@H]1CCN(C(=O)c2cc(Oc3ccccc3)ccc2[O-])CCS1 ZINC000436811604 1041490590 /nfs/dbraw/zinc/49/05/90/1041490590.db2.gz BIMDYPKTOUIYOU-CQSZACIVSA-N -1 3 343.448 4.152 20 0 EIADHM Cc1ccc(C(=O)N2CCC(=Cc3ccc(F)c(F)c3)CC2)c([O-])c1 ZINC000436813957 1041493248 /nfs/dbraw/zinc/49/32/48/1041493248.db2.gz JKXIDYKDTOKMPO-UHFFFAOYSA-N -1 3 343.373 4.298 20 0 EIADHM CCc1ccc(C(=O)N2CCC(c3c[nH]c4ccccc43)CC2)c([O-])c1 ZINC000436814012 1041493265 /nfs/dbraw/zinc/49/32/65/1041493265.db2.gz PYVKITOGFJSNJD-UHFFFAOYSA-N -1 3 348.446 4.456 20 0 EIADHM CC[C@H](CSC)N(C)C(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436812963 1041494192 /nfs/dbraw/zinc/49/41/92/1041494192.db2.gz GFKSBAIRZWUJHB-QGZVFWFLSA-N -1 3 343.492 4.197 20 0 EIADHM O=C([O-])[C@@H]1CCCN(Cc2ccc(Oc3ccccc3F)c(F)c2)C1 ZINC000463334626 1041510710 /nfs/dbraw/zinc/51/07/10/1041510710.db2.gz JJCKLNDVLSZGSN-CQSZACIVSA-N -1 3 347.361 4.054 20 0 EIADHM CC(=O)c1ccc(C(=O)Nc2nc3c(cc(C)cc3C)s2)cc1[O-] ZINC000436859384 1041519975 /nfs/dbraw/zinc/51/99/75/1041519975.db2.gz BHCDTEDQGXSAOZ-UHFFFAOYSA-N -1 3 340.404 4.074 20 0 EIADHM CCSc1cccc(F)c1[N-]C(=O)c1cc(C)n(C(C)(C)C)n1 ZINC000484926498 1041524684 /nfs/dbraw/zinc/52/46/84/1041524684.db2.gz LNBFSIVLKMDLLM-UHFFFAOYSA-N -1 3 335.448 4.450 20 0 EIADHM CCc1ccc(-c2nc([C@@H]3CSc4ccccc4O3)no2)c([O-])c1 ZINC000436879328 1041537707 /nfs/dbraw/zinc/53/77/07/1041537707.db2.gz GFJQAVHBADWRAQ-HNNXBMFYSA-N -1 3 340.404 4.230 20 0 EIADHM Cc1ccc(-c2nc(-c3ccc(N4CCCCC4)cc3)no2)c([O-])c1 ZINC000436888444 1041543433 /nfs/dbraw/zinc/54/34/33/1041543433.db2.gz SBLMCKRWBAKYGM-UHFFFAOYSA-N -1 3 335.407 4.408 20 0 EIADHM COc1ccc([O-])c(-c2nc(-c3ccc4[nH]c(C)c(C)c4c3)no2)c1 ZINC000436911821 1041550613 /nfs/dbraw/zinc/55/06/13/1041550613.db2.gz RJMFINNFYHAECP-UHFFFAOYSA-N -1 3 335.363 4.216 20 0 EIADHM [O-]c1ccccc1-c1nc(CSCc2c(F)cccc2F)no1 ZINC000436900788 1041553322 /nfs/dbraw/zinc/55/33/22/1041553322.db2.gz OQNAXNNGHRQRMC-UHFFFAOYSA-N -1 3 334.347 4.154 20 0 EIADHM Cc1cc([O-])ccc1-c1nc(=O)c2c3c(sc2[nH]1)C[C@@H](C)CC3 ZINC000436920508 1041559138 /nfs/dbraw/zinc/55/91/38/1041559138.db2.gz PRYPENNVRKYDGA-VIFPVBQESA-N -1 3 326.421 4.203 20 0 EIADHM COc1cccc(C(=O)Nc2cccc(Cl)c2OC(C)C)c1[O-] ZINC000436926992 1041562269 /nfs/dbraw/zinc/56/22/69/1041562269.db2.gz PXGCYZYBCKBSAQ-UHFFFAOYSA-N -1 3 335.787 4.094 20 0 EIADHM CC(C)c1ccc(-c2nc(-c3cccc(-n4ccnc4)c3)no2)c([O-])c1 ZINC000436939917 1041567621 /nfs/dbraw/zinc/56/76/21/1041567621.db2.gz RZBQAJULQYNPLM-UHFFFAOYSA-N -1 3 346.390 4.418 20 0 EIADHM COc1ccc([O-])c(-c2nc(-c3ccc(C(C)(F)F)cc3)no2)c1 ZINC000436957898 1041574776 /nfs/dbraw/zinc/57/47/76/1041574776.db2.gz XZOLPDHABWSKDD-UHFFFAOYSA-N -1 3 332.306 4.230 20 0 EIADHM [O-]c1ccc(CNc2ncnc3oc(-c4ccccc4)cc32)cc1F ZINC000506130407 1041913806 /nfs/dbraw/zinc/91/38/06/1041913806.db2.gz GGUYUGDLBQLPMB-UHFFFAOYSA-N -1 3 335.338 4.347 20 0 EIADHM CC[C@H]1CCc2c(sc3[nH]c(-c4ccc([O-])cc4)nc(=O)c23)C1 ZINC000301762877 1041992234 /nfs/dbraw/zinc/99/22/34/1041992234.db2.gz NQMSNUMFFIDMOI-JTQLQIEISA-N -1 3 326.421 4.284 20 0 EIADHM C[C@H]1CO[C@@H](c2cccc(Cl)c2)CN1Cc1cc([O-])cc(F)c1 ZINC000438545707 1042232478 /nfs/dbraw/zinc/23/24/78/1042232478.db2.gz KKVKUFRPQVZTJD-KPZWWZAWSA-N -1 3 335.806 4.147 20 0 EIADHM C[C@H]1C[C@@H](c2ccccc2)CCN1C(=O)NCc1ccc([O-])c(F)c1 ZINC000542184830 1042324458 /nfs/dbraw/zinc/32/44/58/1042324458.db2.gz FTXRKAJAJSWZGJ-YOEHRIQHSA-N -1 3 342.414 4.009 20 0 EIADHM Cc1c(Br)cccc1C(=O)Nc1cc(Cl)ccc1[O-] ZINC000439097750 1042502251 /nfs/dbraw/zinc/50/22/51/1042502251.db2.gz MVSOMVUCDTZDTD-UHFFFAOYSA-N -1 3 340.604 4.369 20 0 EIADHM O=C(NN=c1[n-]c(Cl)c(Cl)cc1Cl)NC1CCCCC1 ZINC000048644308 1042803889 /nfs/dbraw/zinc/80/38/89/1042803889.db2.gz SMENPNKBLYVQFH-UHFFFAOYSA-N -1 3 337.638 4.001 20 0 EIADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)[C@H](C)C(CC)CC)c2)n1 ZINC000536411168 1042841119 /nfs/dbraw/zinc/84/11/19/1042841119.db2.gz OLMQJQIMIFMQSG-CYBMUJFWSA-N -1 3 341.455 4.422 20 0 EIADHM O=C(Nc1ccc(Br)cc1[O-])[C@H]1[C@@H]2CCCCCC[C@@H]21 ZINC001141622220 1042892625 /nfs/dbraw/zinc/89/26/25/1042892625.db2.gz HPVLQBCXXNWYCP-JYAVWHMHSA-N -1 3 338.245 4.310 20 0 EIADHM CCCCN(CC)c1ccc(C(=O)Nc2cccc([O-])c2F)cc1 ZINC000536462863 1043028242 /nfs/dbraw/zinc/02/82/42/1043028242.db2.gz HGLFGQXOCOVPDU-UHFFFAOYSA-N -1 3 330.403 4.410 20 0 EIADHM Cc1ccc(-c2nc(CN3CCCC[C@H]3CCC(=O)[O-])cs2)cc1 ZINC000324239436 1043060938 /nfs/dbraw/zinc/06/09/38/1043060938.db2.gz AQYRPHXYBMEQFT-KRWDZBQOSA-N -1 3 344.480 4.338 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2ccc(-c3ccncc3)c(C)c2)cc1 ZINC000427641696 1043084850 /nfs/dbraw/zinc/08/48/50/1043084850.db2.gz JSIDFRRWGHOVJU-UHFFFAOYSA-N -1 3 338.432 4.166 20 0 EIADHM O=C(Oc1cccc(OCC(F)(F)F)c1)c1cc2ccsc2[n-]1 ZINC000727053864 1043124927 /nfs/dbraw/zinc/12/49/27/1043124927.db2.gz LHIAWHGQAPHQCB-UHFFFAOYSA-N -1 3 341.310 4.390 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N1Cc2ccccc2C2(CC2)C1 ZINC000355919384 1043128544 /nfs/dbraw/zinc/12/85/44/1043128544.db2.gz MJLIPXSWNAAJHO-UHFFFAOYSA-N -1 3 329.399 4.233 20 0 EIADHM Cc1c2cccc(Cl)c2oc1C(=O)NCc1ccc([O-])c(F)c1 ZINC000132725399 1043189459 /nfs/dbraw/zinc/18/94/59/1043189459.db2.gz CVOHXCAYPXFEMG-UHFFFAOYSA-N -1 3 333.746 4.169 20 0 EIADHM O=C(Nc1ccc([O-])c(Cl)c1)[C@H]1CCCCN1Cc1ccccc1 ZINC000509178111 1043201507 /nfs/dbraw/zinc/20/15/07/1043201507.db2.gz KQOTUCROSHSWAU-QGZVFWFLSA-N -1 3 344.842 4.039 20 0 EIADHM CCc1cc(=O)[n-]c(CSC[C@@H](OC(C)C)c2ccccc2)n1 ZINC000427825543 1043218277 /nfs/dbraw/zinc/21/82/77/1043218277.db2.gz KAIIIHBXPCTXRG-MRXNPFEDSA-N -1 3 332.469 4.144 20 0 EIADHM O=C(NC1(c2nccs2)CCCC1)c1cc([O-])c2ccccc2c1 ZINC000280783010 1043234151 /nfs/dbraw/zinc/23/41/51/1043234151.db2.gz FCQWNNVPWXJZHX-UHFFFAOYSA-N -1 3 338.432 4.201 20 0 EIADHM O=C(N[C@H]1CCO[C@@H](c2ccccc2)C1)c1cc([O-])c2ccccc2c1 ZINC000526924224 1043245008 /nfs/dbraw/zinc/24/50/08/1043245008.db2.gz CMVQPHPTKPPJOI-GHTZIAJQSA-N -1 3 347.414 4.196 20 0 EIADHM CN(CCCCNC(=O)c1cc([O-])c2ccccc2c1)c1ccccc1 ZINC000527160604 1043251021 /nfs/dbraw/zinc/25/10/21/1043251021.db2.gz DDYPWRFITOSZSS-UHFFFAOYSA-N -1 3 348.446 4.192 20 0 EIADHM C[C@H]1CN(C(=O)c2cc([O-])c3ccccc3c2)[C@@H](c2ccccc2)CO1 ZINC000527467086 1043262606 /nfs/dbraw/zinc/26/26/06/1043262606.db2.gz CLGBJWCFUCWNSZ-MGPUTAFESA-N -1 3 347.414 4.148 20 0 EIADHM O=C(Nc1cc(F)ccc1[O-])c1cccnc1Sc1ccccc1 ZINC000674015459 1043304095 /nfs/dbraw/zinc/30/40/95/1043304095.db2.gz OFVIXBFSZXROPY-UHFFFAOYSA-N -1 3 340.379 4.330 20 0 EIADHM COc1ccc(C(=O)N2CCC[C@@H]2c2ccc(Cl)cc2)c([O-])c1 ZINC000220313524 1043306991 /nfs/dbraw/zinc/30/69/91/1043306991.db2.gz GMUDPQZBHZANJI-MRXNPFEDSA-N -1 3 331.799 4.032 20 0 EIADHM C[C@H](CCC(C)(C)C)C(=O)NCc1ccc([O-])c(Br)c1 ZINC000543580155 1043373478 /nfs/dbraw/zinc/37/34/78/1043373478.db2.gz LRKXCHWHQBNKHQ-LLVKDONJSA-N -1 3 342.277 4.233 20 0 EIADHM O=C(CCC1CCCCC1)[N-]OCc1cc(F)cc2cccnc21 ZINC000730100837 1043447472 /nfs/dbraw/zinc/44/74/72/1043447472.db2.gz ZMVHCSHODZKIOZ-UHFFFAOYSA-N -1 3 330.403 4.282 20 0 EIADHM C[C@H](CS(=O)(=O)[N-]c1cc(Cl)ccc1F)c1ccccc1 ZINC000494486155 1043514915 /nfs/dbraw/zinc/51/49/15/1043514915.db2.gz TZDHUFDKGQBJFM-LLVKDONJSA-N -1 3 327.808 4.025 20 0 EIADHM CS[C@@H]1CCCCN([C@@H](C(=O)[O-])c2ccc(Cl)c(Cl)c2)C1 ZINC000521257582 1043670138 /nfs/dbraw/zinc/67/01/38/1043670138.db2.gz MORSJIKHDANULL-BXUZGUMPSA-N -1 3 348.295 4.337 20 0 EIADHM Cc1ccc(C(=O)Nc2ccccc2NC(=O)OC(C)(C)C)c([O-])c1 ZINC000730965046 1043670036 /nfs/dbraw/zinc/67/00/36/1043670036.db2.gz LYUVJEBXKQFTFF-UHFFFAOYSA-N -1 3 342.395 4.300 20 0 EIADHM CCc1cnc(CSc2nnc([N-]c3ccccc3F)s2)o1 ZINC000078929630 1043813526 /nfs/dbraw/zinc/81/35/26/1043813526.db2.gz QZIQNOQMCMCVNM-UHFFFAOYSA-N -1 3 336.417 4.264 20 0 EIADHM O=C(Nc1cc(Br)ccc1[O-])c1ccc(C(F)F)cc1 ZINC000674744286 1043858542 /nfs/dbraw/zinc/85/85/42/1043858542.db2.gz CEUNJIYKGGATLE-UHFFFAOYSA-N -1 3 342.139 4.345 20 0 EIADHM C[C@@H](NC(=O)c1nnc2ccccc2c1[O-])c1cc2ccccc2s1 ZINC000732289984 1043894567 /nfs/dbraw/zinc/89/45/67/1043894567.db2.gz OAMZWCKWBDBKMR-LLVKDONJSA-N -1 3 349.415 4.041 20 0 EIADHM Cc1ccc(C(=O)[N-]c2c3ccccc3oc2C(=O)c2ccco2)o1 ZINC000192819651 1043973698 /nfs/dbraw/zinc/97/36/98/1043973698.db2.gz ZQTFRPAASOZHBM-UHFFFAOYSA-N -1 3 335.315 4.411 20 0 EIADHM O=C(Oc1ccc(Br)c(F)c1)c1cc2ccsc2[n-]1 ZINC000732906603 1044029433 /nfs/dbraw/zinc/02/94/33/1044029433.db2.gz VFLKLGDSMRWGNO-UHFFFAOYSA-N -1 3 340.173 4.350 20 0 EIADHM COc1ccc2oc(C(=O)[N-]c3nc(C(C)(C)C)ns3)c(C)c2c1 ZINC000068074516 1044123650 /nfs/dbraw/zinc/12/36/50/1044123650.db2.gz ILPBFQHWCDETCP-UHFFFAOYSA-N -1 3 345.424 4.151 20 0 EIADHM [O-]c1ccc(CNCc2ccc(Br)cc2F)cc1Cl ZINC000733328369 1044193465 /nfs/dbraw/zinc/19/34/65/1044193465.db2.gz SDCJKSRMICPIBX-UHFFFAOYSA-N -1 3 344.611 4.237 20 0 EIADHM Cc1ccc2oc(SCc3noc(-c4ccccc4[O-])n3)nc2c1 ZINC000113777379 1044260305 /nfs/dbraw/zinc/26/03/05/1044260305.db2.gz PMCSXJDKJDKYOV-UHFFFAOYSA-N -1 3 339.376 4.184 20 0 EIADHM COc1ccccc1-c1ccccc1-c1noc(-c2ccc([O-])cn2)n1 ZINC001212559062 1044309887 /nfs/dbraw/zinc/30/98/87/1044309887.db2.gz UBNGCRRYFHHCAD-UHFFFAOYSA-N -1 3 345.358 4.180 20 0 EIADHM COc1ccc(-c2ccc(-c3noc(-c4ccc([O-])cn4)n3)cc2)cc1 ZINC001212559070 1044311222 /nfs/dbraw/zinc/31/12/22/1044311222.db2.gz URXGORHNBSNXRA-UHFFFAOYSA-N -1 3 345.358 4.180 20 0 EIADHM Cc1nc(Br)ccc1Nc1nc2c(cccc2[O-])s1 ZINC001212561214 1044324944 /nfs/dbraw/zinc/32/49/44/1044324944.db2.gz DYTZCTAPTJXFKF-UHFFFAOYSA-N -1 3 336.214 4.211 20 0 EIADHM O=C(CCC1CCCCC1)[N-]OCc1cc(-c2ccccc2)no1 ZINC000733998319 1044459685 /nfs/dbraw/zinc/45/96/85/1044459685.db2.gz SCDKWQHIAROYDI-UHFFFAOYSA-N -1 3 328.412 4.250 20 0 EIADHM Cc1cc(=O)[n-]c([C@@H](C)Sc2nccn2-c2cccc(Cl)c2)n1 ZINC000469804287 1044817375 /nfs/dbraw/zinc/81/73/75/1044817375.db2.gz MCOGFNFZBALWFR-LLVKDONJSA-N -1 3 346.843 4.183 20 0 EIADHM O=C([N-]c1ccccc1SCC(F)(F)F)c1cc(C2CC2)on1 ZINC000073474867 1044849350 /nfs/dbraw/zinc/84/93/50/1044849350.db2.gz YRZCKCXYYATINU-UHFFFAOYSA-N -1 3 342.342 4.459 20 0 EIADHM Cc1ccc(C(=O)[C@@H](C)OC(=O)c2cc3ccsc3[n-]2)cc1C ZINC000914891872 1044852690 /nfs/dbraw/zinc/85/26/90/1044852690.db2.gz QMVMBNAEGUWBOS-GFCCVEGCSA-N -1 3 327.405 4.274 20 0 EIADHM [O-]c1ccc(F)c(CNc2ccccc2OCC(F)(F)F)c1F ZINC000509275798 1044887601 /nfs/dbraw/zinc/88/76/01/1044887601.db2.gz HAXNXBBXDOWHHP-UHFFFAOYSA-N -1 3 333.256 4.224 20 0 EIADHM COc1cccc(Cc2noc(-c3cc4ccccc4cc3[O-])n2)c1 ZINC000327425027 1044916158 /nfs/dbraw/zinc/91/61/58/1044916158.db2.gz NCSZXBJZJFJHTL-UHFFFAOYSA-N -1 3 332.359 4.195 20 0 EIADHM O=C(CCC1CCCCC1)[N-]OCc1ncccc1C(F)(F)F ZINC000762206249 1045064432 /nfs/dbraw/zinc/06/44/32/1045064432.db2.gz HGTRTJASLUOMMH-UHFFFAOYSA-N -1 3 330.350 4.009 20 0 EIADHM Cc1sc2[n-]c([C@H](C)OC(=O)CCC(C)(C)C)nc(=O)c2c1C ZINC000738800220 1045091490 /nfs/dbraw/zinc/09/14/90/1045091490.db2.gz SJUYLPTTWQLPLW-JTQLQIEISA-N -1 3 336.457 4.444 20 0 EIADHM CCN(c1ccc(NC(=O)NCc2ccc([O-])c(F)c2)cc1)C(C)C ZINC000738885516 1045097158 /nfs/dbraw/zinc/09/71/58/1045097158.db2.gz XQBOJWBZSMORFE-UHFFFAOYSA-N -1 3 345.418 4.088 20 0 EIADHM Cc1noc2nc(C(C)C)cc(C(=O)Nc3ccc(Cl)cc3[O-])c12 ZINC000533618598 1045639655 /nfs/dbraw/zinc/63/96/55/1045639655.db2.gz VYUVNULPPJBXIU-UHFFFAOYSA-N -1 3 345.786 4.266 20 0 EIADHM O=c1ccnc(C=Cc2cn(-c3ccccc3)nc2-c2cccs2)[n-]1 ZINC000742219627 1045640832 /nfs/dbraw/zinc/64/08/32/1045640832.db2.gz CZLOQENQWUEFEL-HJWRWDBZSA-N -1 3 346.415 4.267 20 0 EIADHM CCOc1ccc(SCC(=O)Nc2ccc(Cl)cc2[O-])cc1 ZINC000533618619 1045641337 /nfs/dbraw/zinc/64/13/37/1045641337.db2.gz XEEVXCGRPPHGQB-UHFFFAOYSA-N -1 3 337.828 4.175 20 0 EIADHM CC(C)Oc1ccc(CNC(=O)c2cc3sccc3c([O-])c2)cc1 ZINC000791313798 1045727527 /nfs/dbraw/zinc/72/75/27/1045727527.db2.gz MFZVNWXMNRUVFS-UHFFFAOYSA-N -1 3 341.432 4.324 20 0 EIADHM O=C(N[C@@H]1CCOC2(CCCCC2)C1)c1cc2sccc2c([O-])c1 ZINC000791383080 1045728568 /nfs/dbraw/zinc/72/85/68/1045728568.db2.gz AMJVMALQRSDHSZ-CQSZACIVSA-N -1 3 345.464 4.219 20 0 EIADHM Cc1cccnc1[C@H](NC(=O)c1cc2sccc2c([O-])c1)C(C)C ZINC000791365703 1045731579 /nfs/dbraw/zinc/73/15/79/1045731579.db2.gz CLXMGEJPKMIZDN-QGZVFWFLSA-N -1 3 340.448 4.437 20 0 EIADHM O=S(=O)([N-]c1cccc(Cl)c1F)c1cc(F)cc(Cl)c1 ZINC000533689978 1045732692 /nfs/dbraw/zinc/73/26/92/1045732692.db2.gz QBUPZIGFHWNDAZ-UHFFFAOYSA-N -1 3 338.162 4.072 20 0 EIADHM O=c1nc(CN2CCC[C@@H](c3ccccc3)CC2)[n-]c2ccsc21 ZINC000066898674 1045733838 /nfs/dbraw/zinc/73/38/38/1045733838.db2.gz QRMRTECCBWZSKB-OAHLLOKOSA-N -1 3 339.464 4.167 20 0 EIADHM Cc1cc(=O)[n-]c(CS[C@@H](C)c2ccc(Br)cc2)n1 ZINC000763207913 1045741190 /nfs/dbraw/zinc/74/11/90/1045741190.db2.gz FKGZQWMSMWMQJB-JTQLQIEISA-N -1 3 339.258 4.248 20 0 EIADHM Cc1cc(=O)[n-]c(CSCc2csc(C3CCCCC3)n2)n1 ZINC000763210095 1045751079 /nfs/dbraw/zinc/75/10/79/1045751079.db2.gz JURJVOCNBFYVKA-UHFFFAOYSA-N -1 3 335.498 4.428 20 0 EIADHM C/C(=C\c1c(Cl)cccc1Cl)C(=O)[N-]OCC(F)(F)F ZINC000768274986 1045775153 /nfs/dbraw/zinc/77/51/53/1045775153.db2.gz HQASUFUTWUJDTI-FNORWQNLSA-N -1 3 328.117 4.007 20 0 EIADHM C/C(=C/c1c(Cl)cccc1Cl)C(=O)[N-]OCC(F)(F)F ZINC000768274985 1045775729 /nfs/dbraw/zinc/77/57/29/1045775729.db2.gz HQASUFUTWUJDTI-ALCCZGGFSA-N -1 3 328.117 4.007 20 0 EIADHM [O-]c1ccc(Nc2cn3cc(C(F)(F)F)ccc3n2)c(F)c1F ZINC001212005360 1045825848 /nfs/dbraw/zinc/82/58/48/1045825848.db2.gz INZXVBWWJICADW-UHFFFAOYSA-N -1 3 329.228 4.081 20 0 EIADHM CCOC(=O)c1ccc(Nc2ccc([O-])c(F)c2F)c(Cl)c1 ZINC001212010874 1045831355 /nfs/dbraw/zinc/83/13/55/1045831355.db2.gz DSQWQURRIHKBRN-UHFFFAOYSA-N -1 3 327.714 4.244 20 0 EIADHM CC(=O)c1ccc(Nc2ccc([O-])c(F)c2F)c(Br)c1 ZINC001212009884 1045832008 /nfs/dbraw/zinc/83/20/08/1045832008.db2.gz WNSOIHFXTBLYNE-UHFFFAOYSA-N -1 3 342.139 4.379 20 0 EIADHM [O-]c1ccc(Nc2ccc(F)c(Br)c2F)c(F)c1F ZINC001212014086 1045835190 /nfs/dbraw/zinc/83/51/90/1045835190.db2.gz YXRMLPYIBGQPIW-UHFFFAOYSA-N -1 3 336.082 4.455 20 0 EIADHM CC(C)(C)OC(=O)c1ccc(Nc2ccc([O-])c(F)c2F)c(O)c1 ZINC001212016149 1045839802 /nfs/dbraw/zinc/83/98/02/1045839802.db2.gz AGOCUGCWYCCJAQ-UHFFFAOYSA-N -1 3 337.322 4.075 20 0 EIADHM C[C@@H](NC(=O)c1cc([O-])c2ccccc2c1)c1ccc(F)c(F)c1 ZINC000792025115 1045850856 /nfs/dbraw/zinc/85/08/56/1045850856.db2.gz SHWRZFWRJKXVGD-LLVKDONJSA-N -1 3 327.330 4.315 20 0 EIADHM Cc1ccccc1CC1CN(C(=O)c2cc([O-])c3ccccc3c2)C1 ZINC000792213638 1045881563 /nfs/dbraw/zinc/88/15/63/1045881563.db2.gz WVSUPSCSVSLVIU-UHFFFAOYSA-N -1 3 331.415 4.169 20 0 EIADHM Cc1ccc2c(c1)O[C@H](C)CN2C(=O)c1cc([O-])c2ccccc2c1 ZINC000792212689 1045881929 /nfs/dbraw/zinc/88/19/29/1045881929.db2.gz BXDPOPSWNHWZEU-CQSZACIVSA-N -1 3 333.387 4.282 20 0 EIADHM O=C(OCc1nc(C(F)(F)F)cs1)c1cc(Cl)c(Cl)[n-]1 ZINC000179173511 1045924682 /nfs/dbraw/zinc/92/46/82/1045924682.db2.gz MIQRIUMQDLBQGY-UHFFFAOYSA-N -1 3 345.129 4.154 20 0 EIADHM CSc1ccc([O-])c(C(=O)N2CCC[C@H]2CCc2ccccc2)c1 ZINC001626112989 1045982767 /nfs/dbraw/zinc/98/27/67/1045982767.db2.gz IDGRDXDRVWDWEG-INIZCTEOSA-N -1 3 341.476 4.352 20 0 EIADHM Cc1cc(F)cc2c(=O)c(C(=O)Nc3ccccc3C(C)C)c[n-]c12 ZINC000161604253 1046020289 /nfs/dbraw/zinc/02/02/89/1046020289.db2.gz DBPJFBGVAXHQGO-UHFFFAOYSA-N -1 3 338.382 4.351 20 0 EIADHM Cc1ccc(C(=O)N2CC=C(c3c[nH]c4ccccc43)CC2)c([O-])c1 ZINC000078301760 1046025832 /nfs/dbraw/zinc/02/58/32/1046025832.db2.gz YBHADFIKMJIPGK-UHFFFAOYSA-N -1 3 332.403 4.111 20 0 EIADHM CC(C)Sc1cccc(Cl)c1CN1C[C@@H](C)C[C@H](C(=O)[O-])C1 ZINC000263092158 1046250473 /nfs/dbraw/zinc/25/04/73/1046250473.db2.gz UNQRBAJDPJIYSQ-STQMWFEESA-N -1 3 341.904 4.383 20 0 EIADHM O=C(c1ccc(F)cc1)[C@H]1CCCN(Cc2cccc([O-])c2Cl)C1 ZINC000508709726 1046365317 /nfs/dbraw/zinc/36/53/17/1046365317.db2.gz OPGZETHZOMTUCB-HNNXBMFYSA-N -1 3 347.817 4.280 20 0 EIADHM O=C([N-]c1ccnc(Cl)c1F)c1cc(-c2ccccc2)ns1 ZINC001129621106 1046604805 /nfs/dbraw/zinc/60/48/05/1046604805.db2.gz NWMCVPLSTGIBII-UHFFFAOYSA-N -1 3 333.775 4.250 20 0 EIADHM O=C([N-]c1ccc(F)c(F)c1F)c1cc(-c2ccc(F)cc2)on1 ZINC000127342621 1046651442 /nfs/dbraw/zinc/65/14/42/1046651442.db2.gz YHOQTEHBBIEMOD-UHFFFAOYSA-N -1 3 336.244 4.150 20 0 EIADHM CC[C@@](C)(NCc1cccc([O-])c1Br)c1nccs1 ZINC000459441177 1046673090 /nfs/dbraw/zinc/67/30/90/1046673090.db2.gz HDLLVUABQLGUAF-CQSZACIVSA-N -1 3 341.274 4.026 20 0 EIADHM CCc1nc([C@H](C)NCc2cccc([O-])c2Br)cs1 ZINC000459447306 1046679126 /nfs/dbraw/zinc/67/91/26/1046679126.db2.gz QEDVJMWYZXDBLW-VIFPVBQESA-N -1 3 341.274 4.024 20 0 EIADHM CCc1ccc([O-])c(C(=O)N(Cc2ccco2)Cc2cccs2)c1 ZINC000536693401 1046683326 /nfs/dbraw/zinc/68/33/26/1046683326.db2.gz REIDNWLAJNARQX-UHFFFAOYSA-N -1 3 341.432 4.452 20 0 EIADHM Cc1ccc([O-])c(C(=O)Nc2cc(F)ccc2OCC(F)(F)F)c1 ZINC000536733610 1046729713 /nfs/dbraw/zinc/72/97/13/1046729713.db2.gz GFJWQHBQVLTRDK-UHFFFAOYSA-N -1 3 343.276 4.033 20 0 EIADHM [O-]c1cccc(CN[C@@H]2CCCc3c(O)cccc32)c1Br ZINC000459537114 1046751334 /nfs/dbraw/zinc/75/13/34/1046751334.db2.gz ZFJRPHUOEPGDSX-CQSZACIVSA-N -1 3 348.240 4.028 20 0 EIADHM CSCc1ccc(CNC(=O)c2cc3sccc3c([O-])c2)cc1 ZINC000804702216 1046771747 /nfs/dbraw/zinc/77/17/47/1046771747.db2.gz UNNJRGUWTWVZCM-UHFFFAOYSA-N -1 3 343.473 4.400 20 0 EIADHM CCOc1cc(CN2CC(C)(C)[C@H]2c2ccncc2)cc(Cl)c1[O-] ZINC000459592870 1046803559 /nfs/dbraw/zinc/80/35/59/1046803559.db2.gz PMPFJWUCKAOIEN-GOSISDBHSA-N -1 3 346.858 4.422 20 0 EIADHM O=C(OCc1ncc(-c2ccc(Cl)cc2)o1)c1cc2occc2[n-]1 ZINC000786034205 1046803922 /nfs/dbraw/zinc/80/39/22/1046803922.db2.gz XWHRBEQXBKAAEQ-UHFFFAOYSA-N -1 3 342.738 4.426 20 0 EIADHM O=C(OCc1csc(Cc2ccccc2)n1)c1cc2occc2[n-]1 ZINC000786029923 1046804094 /nfs/dbraw/zinc/80/40/94/1046804094.db2.gz JJPUHFTYWJBIQE-UHFFFAOYSA-N -1 3 338.388 4.165 20 0 EIADHM O=C(CCc1ccccc1OC(F)(F)F)Nc1cccc([O-])c1F ZINC000128389443 1046848354 /nfs/dbraw/zinc/84/83/54/1046848354.db2.gz YWDWKQQFXPOXLF-UHFFFAOYSA-N -1 3 343.276 4.001 20 0 EIADHM O=C(Nc1cccc([O-])c1F)c1cc(Cl)cc(Br)c1 ZINC000128448575 1046872901 /nfs/dbraw/zinc/87/29/01/1046872901.db2.gz ZMLKHCGAEDZFFN-UHFFFAOYSA-N -1 3 344.567 4.200 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)Nc1ccnn1C1CCCCC1 ZINC000786867983 1046876996 /nfs/dbraw/zinc/87/69/96/1046876996.db2.gz GBRIVQDFWGDZJG-UHFFFAOYSA-N -1 3 345.418 4.194 20 0 EIADHM CC(C)(C)c1cnc(C[N-]C(=O)C(F)(F)c2cccc(Cl)c2)o1 ZINC000746624674 1046900572 /nfs/dbraw/zinc/90/05/72/1046900572.db2.gz LFPWAXYRWHFLBT-UHFFFAOYSA-N -1 3 342.773 4.034 20 0 EIADHM O=C([N-][C@H](c1ccccc1)c1ccc(Cl)c(Cl)c1)C(F)F ZINC000787099349 1046913481 /nfs/dbraw/zinc/91/34/81/1046913481.db2.gz HCDHQPFMRJWEDG-CYBMUJFWSA-N -1 3 330.161 4.464 20 0 EIADHM CSc1cc(F)ccc1[N-]C(=O)c1cc(C)c(Br)o1 ZINC001130294102 1046949121 /nfs/dbraw/zinc/94/91/21/1046949121.db2.gz WUTZGOHALCLRRT-UHFFFAOYSA-N -1 3 344.205 4.464 20 0 EIADHM CC(C)(C)CCCCC(=O)OCc1noc(-c2ccccc2[O-])n1 ZINC000805584041 1046932989 /nfs/dbraw/zinc/93/29/89/1046932989.db2.gz YENYDAOEKNLWPL-UHFFFAOYSA-N -1 3 332.400 4.092 20 0 EIADHM CC(C)c1ccc(C(=O)NC[C@H](C)c2nc3ccccc3o2)c([O-])c1 ZINC000746700702 1047035775 /nfs/dbraw/zinc/03/57/75/1047035775.db2.gz ATHHJVVJVOYDEJ-ZDUSSCGKSA-N -1 3 338.407 4.190 20 0 EIADHM CC[C@@H](OC(=O)CCCc1ccc([O-])c(F)c1)C(=O)c1ccccc1 ZINC000787847375 1047058263 /nfs/dbraw/zinc/05/82/63/1047058263.db2.gz DRBUPVWQGRCLHH-GOSISDBHSA-N -1 3 344.382 4.059 20 0 EIADHM O=C(N[C@H]1CCc2cc(F)ccc21)c1cc2sccc2c([O-])c1 ZINC000788286500 1047156348 /nfs/dbraw/zinc/15/63/48/1047156348.db2.gz DPQDCPWFWURGLN-HNNXBMFYSA-N -1 3 327.380 4.163 20 0 EIADHM O=C(CCOc1ccc(Cl)cc1Cl)[N-]OCc1ccccc1 ZINC000917937145 1047224040 /nfs/dbraw/zinc/22/40/40/1047224040.db2.gz AANSAUQGSCKKQT-UHFFFAOYSA-N -1 3 340.206 4.010 20 0 EIADHM Cc1ccc(Cl)cc1S(=O)(=O)[N-]c1cccc(Cl)c1F ZINC000031666789 1047240604 /nfs/dbraw/zinc/24/06/04/1047240604.db2.gz ZRYAJSFXDQZXLA-UHFFFAOYSA-N -1 3 334.199 4.242 20 0 EIADHM Cc1nc(-c2cccs2)sc1C(=O)Nc1cccc([O-])c1F ZINC000129038728 1047250427 /nfs/dbraw/zinc/25/04/27/1047250427.db2.gz IJINCAWUHMUFER-UHFFFAOYSA-N -1 3 334.397 4.277 20 0 EIADHM CSc1ccc(C)c([N-]S(=O)(=O)c2ccc(OC3CC3)cc2)c1 ZINC000829902550 1047315695 /nfs/dbraw/zinc/31/56/95/1047315695.db2.gz JGCYDZFPRJWVOR-UHFFFAOYSA-N -1 3 349.477 4.059 20 0 EIADHM O=C(Nc1cccc([O-])c1F)[C@H]1C[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000129262012 1047341183 /nfs/dbraw/zinc/34/11/83/1047341183.db2.gz SMTMGXIKERQVKC-NEPJUHHUSA-N -1 3 339.288 4.292 20 0 EIADHM O=C(Nc1cccc([O-])c1F)[C@H]1C[C@@H]1c1ccccc1C(F)(F)F ZINC000129262855 1047341850 /nfs/dbraw/zinc/34/18/50/1047341850.db2.gz JXQCNCSHLSGSTR-MNOVXSKESA-N -1 3 339.288 4.292 20 0 EIADHM CCCc1nc(C)c(C(=O)Nc2ccc([O-])c(C(F)(F)F)c2)s1 ZINC000476127859 1047347871 /nfs/dbraw/zinc/34/78/71/1047347871.db2.gz BEJIQYDNHQWRGB-UHFFFAOYSA-N -1 3 344.358 4.381 20 0 EIADHM CCC(C)(C)[C@H]1CCc2nc(NC([O-])=NOCC(F)F)sc2C1 ZINC000806749505 1047360760 /nfs/dbraw/zinc/36/07/60/1047360760.db2.gz CUAXIXQWLSDKCL-VIFPVBQESA-N -1 3 347.431 4.002 20 0 EIADHM CCC(C)(C)[C@H]1CCc2nc(NC(=O)[N-]OCC(F)F)sc2C1 ZINC000806749505 1047360769 /nfs/dbraw/zinc/36/07/69/1047360769.db2.gz CUAXIXQWLSDKCL-VIFPVBQESA-N -1 3 347.431 4.002 20 0 EIADHM O=C(Nc1ccc([O-])c(-c2nc3ccccc3s2)c1)c1ccc[nH]1 ZINC000129503617 1047410115 /nfs/dbraw/zinc/41/01/15/1047410115.db2.gz PNDHIJDCEGMAMG-UHFFFAOYSA-N -1 3 335.388 4.249 20 0 EIADHM CSc1cc(Cl)ccc1[N-]C(=O)c1ncnc2ccsc21 ZINC001130851543 1047422164 /nfs/dbraw/zinc/42/21/64/1047422164.db2.gz NQHFYNZECGSNFK-UHFFFAOYSA-N -1 3 335.841 4.319 20 0 EIADHM O=C(C[C@@H](c1ccccc1)C(F)(F)F)Nc1cccc([O-])c1F ZINC000129551777 1047426242 /nfs/dbraw/zinc/42/62/42/1047426242.db2.gz KOZLGGQUPATFLK-NSHDSACASA-N -1 3 327.277 4.206 20 0 EIADHM Cc1onc(-c2ccccc2Cl)c1C(=O)Nc1cccc([O-])c1F ZINC000129671101 1047461902 /nfs/dbraw/zinc/46/19/02/1047461902.db2.gz QQPJNNKEHNSOGF-UHFFFAOYSA-N -1 3 346.745 4.400 20 0 EIADHM CCNc1ccc(Cl)cc1NC(=O)c1cc([O-])ccc1Cl ZINC000498333117 1047555883 /nfs/dbraw/zinc/55/58/83/1047555883.db2.gz MNQKLYQASNPRCB-UHFFFAOYSA-N -1 3 325.195 4.383 20 0 EIADHM O=C(N[C@H]1C[C@@H]1c1c(F)cccc1Cl)c1cc([O-])ccc1Cl ZINC000556306120 1047668325 /nfs/dbraw/zinc/66/83/25/1047668325.db2.gz PMVPAKUGQKVRMF-HZMBPMFUSA-N -1 3 340.181 4.124 20 0 EIADHM O=S(=O)([N-]c1ccc(F)cc1-c1nc2ccccc2s1)C1CC1 ZINC000106723810 1047697968 /nfs/dbraw/zinc/69/79/68/1047697968.db2.gz QHKOLOVZZIIDBV-UHFFFAOYSA-N -1 3 348.424 4.007 20 0 EIADHM O=C(Nc1ccc([O-])c(C(F)(F)F)c1)c1cc2[nH]ccc2s1 ZINC000476416523 1047799892 /nfs/dbraw/zinc/79/98/92/1047799892.db2.gz SSCBPLAWMMYVFM-UHFFFAOYSA-N -1 3 326.299 4.206 20 0 EIADHM CCc1ccc(C(=O)N[C@H](C)[C@@H](OC)c2ccc(Cl)cc2)c([O-])c1 ZINC001136846343 1047854677 /nfs/dbraw/zinc/85/46/77/1047854677.db2.gz AWKYRFXXWJZMGP-KZULUSFZSA-N -1 3 347.842 4.114 20 0 EIADHM O=C([N-]c1cccc(Cl)c1SC(F)F)c1cccnc1F ZINC000808345661 1047870705 /nfs/dbraw/zinc/87/07/05/1047870705.db2.gz CFUOSYNWPVNUQU-UHFFFAOYSA-N -1 3 332.734 4.441 20 0 EIADHM COc1ccc(C(=O)N[C@@H](C)c2cccc(Cl)c2Cl)c([O-])c1 ZINC001136884844 1047875488 /nfs/dbraw/zinc/87/54/88/1047875488.db2.gz VNHQMVVTZMHUFU-VIFPVBQESA-N -1 3 340.206 4.199 20 0 EIADHM Cc1ccc(C(=O)NC(c2cccs2)c2cccs2)c([O-])c1 ZINC001136924264 1047900486 /nfs/dbraw/zinc/90/04/86/1047900486.db2.gz UJRYGDAGJKLQEQ-UHFFFAOYSA-N -1 3 329.446 4.343 20 0 EIADHM Cc1ccc(Cl)c([N-]S(=O)(=O)c2ccc(Cl)nc2C)c1C ZINC000808560741 1048016344 /nfs/dbraw/zinc/01/63/44/1048016344.db2.gz BJWZQYRJERHJOV-UHFFFAOYSA-N -1 3 345.251 4.114 20 0 EIADHM CC(=O)c1cccc(NC(=O)[C@@H](C)Oc2cccc(C(C)C)c2)c1[O-] ZINC000556894099 1048118609 /nfs/dbraw/zinc/11/86/09/1048118609.db2.gz MGHARFXGNRQYEF-CQSZACIVSA-N -1 3 341.407 4.124 20 0 EIADHM Cc1ccc(NC(=O)c2c(C)nc(C(C)C)[n-]c2=O)c(Cl)c1C ZINC000843967521 1048165561 /nfs/dbraw/zinc/16/55/61/1048165561.db2.gz YRHQBQPRTHKXDK-UHFFFAOYSA-N -1 3 333.819 4.137 20 0 EIADHM CC(C)c1ccc(C(=O)N2C[C@@H](C)OC3(CCCCC3)C2)c([O-])c1 ZINC001144260722 1048540769 /nfs/dbraw/zinc/54/07/69/1048540769.db2.gz UZODGVUTQSOVDP-OAHLLOKOSA-N -1 3 331.456 4.079 20 0 EIADHM CCCC(C)=CC(=O)Nc1cccc(-c2nc(CC)cc(=O)[n-]2)c1 ZINC000920223042 1048597845 /nfs/dbraw/zinc/59/78/45/1048597845.db2.gz ZDXYCPNTYQASJM-JLHYYAGUSA-N -1 3 325.412 4.097 20 0 EIADHM Cc1ncsc1C(=O)[N-]c1nc(Sc2ccc(C)cc2)ns1 ZINC000075178654 1048693734 /nfs/dbraw/zinc/69/37/34/1048693734.db2.gz XVNZBEGNHFFAPP-UHFFFAOYSA-N -1 3 348.478 4.015 20 0 EIADHM C[C@H](c1cccc2ccccc21)N(C)C(=O)Cc1ccc([O-])c(F)c1 ZINC001144629029 1048764902 /nfs/dbraw/zinc/76/49/02/1048764902.db2.gz QZPBCBOGNMPPFH-CQSZACIVSA-N -1 3 337.394 4.447 20 0 EIADHM CN(Cc1sccc1C(=O)[O-])Cc1ccccc1C(F)(F)F ZINC001144678227 1048799038 /nfs/dbraw/zinc/79/90/38/1048799038.db2.gz RNRQANQEWTZAIL-UHFFFAOYSA-N -1 3 329.343 4.097 20 0 EIADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)C3(F)CCCCC3)c2)n1 ZINC000810570862 1048821329 /nfs/dbraw/zinc/82/13/29/1048821329.db2.gz SXZNZRKRCUBSHV-UHFFFAOYSA-N -1 3 343.402 4.023 20 0 EIADHM C[C@@H](OC(=O)c1cc2cc(Cl)sc2[n-]1)C(=O)Nc1ccccc1 ZINC000810626148 1048829086 /nfs/dbraw/zinc/82/90/86/1048829086.db2.gz VPLYJMROKCOLTM-SECBINFHSA-N -1 3 348.811 4.067 20 0 EIADHM CC(C)(C)Oc1ccccc1[N-]S(=O)(=O)/C=C\c1ccc(F)cc1 ZINC000747616572 1048831778 /nfs/dbraw/zinc/83/17/78/1048831778.db2.gz DVUQCVBZYNAVGJ-SEYXRHQNSA-N -1 3 349.427 4.416 20 0 EIADHM O=C([O-])[C@H](c1ccc(Cl)c(Cl)c1)N1CCC2(CCCC2)C1 ZINC000846244207 1048846963 /nfs/dbraw/zinc/84/69/63/1048846963.db2.gz GHBZOBHAGDVJFO-AWEZNQCLSA-N -1 3 328.239 4.385 20 0 EIADHM O=C([O-])[C@@H](c1cc(Cl)cc(Cl)c1)N1CCC2(CCCC2)C1 ZINC000846244228 1048847361 /nfs/dbraw/zinc/84/73/61/1048847361.db2.gz GYZSEZPVHYUGOF-CQSZACIVSA-N -1 3 328.239 4.385 20 0 EIADHM CC(C)(C(=O)[O-])[C@H]1CCCN(Cc2ncc(-c3ccccc3)s2)C1 ZINC000846286248 1048853319 /nfs/dbraw/zinc/85/33/19/1048853319.db2.gz YWRCLRLOSCIPQO-HNNXBMFYSA-N -1 3 344.480 4.133 20 0 EIADHM O=C(CCc1ncc(-c2ccc(Cl)cc2)o1)[N-]Oc1ccccc1 ZINC000816684787 1048853620 /nfs/dbraw/zinc/85/36/20/1048853620.db2.gz PUVYSRIBTZIALV-UHFFFAOYSA-N -1 3 342.782 4.038 20 0 EIADHM C[C@@]1(CCNC(=O)c2cc3sccc3c([O-])c2)C[C@@]1(F)Cl ZINC000846401268 1048860973 /nfs/dbraw/zinc/86/09/73/1048860973.db2.gz SOOIIRLUSUNRRK-CABCVRRESA-N -1 3 327.808 4.041 20 0 EIADHM CCc1cc(CCCOC(=O)c2cc3cc(Cl)sc3[n-]2)on1 ZINC000810873251 1048881185 /nfs/dbraw/zinc/88/11/85/1048881185.db2.gz KWVOTNNTXGBEDI-UHFFFAOYSA-N -1 3 338.816 4.223 20 0 EIADHM CCO[C@H](C(=O)Nc1ccc([O-])c(C(F)(F)F)c1)c1ccccc1 ZINC000134123289 1048885682 /nfs/dbraw/zinc/88/56/82/1048885682.db2.gz DPJHIZTXIAVWEZ-HNNXBMFYSA-N -1 3 339.313 4.127 20 0 EIADHM O=C(CCCOc1cccc(Cl)c1Cl)[N-]OCCC1CC1 ZINC000817379644 1048952858 /nfs/dbraw/zinc/95/28/58/1048952858.db2.gz WDCACYXZVGDJIT-UHFFFAOYSA-N -1 3 332.227 4.000 20 0 EIADHM CC(=O)c1ccc(-c2nc(=O)c3c(CC(C)C)csc3[n-]2)s1 ZINC000134471857 1048962801 /nfs/dbraw/zinc/96/28/01/1048962801.db2.gz ORTGEHTUBLBXQJ-UHFFFAOYSA-N -1 3 332.450 4.114 20 0 EIADHM CC(F)(F)c1ccc(C[N-]C(=O)C(F)(F)c2ccc(F)cc2)cc1 ZINC000817467735 1048985103 /nfs/dbraw/zinc/98/51/03/1048985103.db2.gz VKMJDWCBTWEKIJ-UHFFFAOYSA-N -1 3 343.295 4.346 20 0 EIADHM Cc1ccc(-c2cc(C(=O)O[C@H](C)c3ncc(C(C)(C)C)o3)n[n-]2)o1 ZINC000747690452 1049005312 /nfs/dbraw/zinc/00/53/12/1049005312.db2.gz LRYVVHCKTJFNRN-LLVKDONJSA-N -1 3 343.383 4.182 20 0 EIADHM Cc1ccc(-c2cc(C(=O)O[C@H](C)c3ncc(C(C)(C)C)o3)[n-]n2)o1 ZINC000747690452 1049005323 /nfs/dbraw/zinc/00/53/23/1049005323.db2.gz LRYVVHCKTJFNRN-LLVKDONJSA-N -1 3 343.383 4.182 20 0 EIADHM O=C(Nc1ncc(Cl)s1)c1cc(Cc2ccccc2)ccc1[O-] ZINC001146516333 1049031979 /nfs/dbraw/zinc/03/19/79/1049031979.db2.gz BFMMXBUSAGINDN-UHFFFAOYSA-N -1 3 344.823 4.345 20 0 EIADHM O=C(COC(=O)c1cc2cc(Cl)sc2[n-]1)C1CCCCC1 ZINC000811396389 1049053408 /nfs/dbraw/zinc/05/34/08/1049053408.db2.gz ONVGPXGUOUPWPB-UHFFFAOYSA-N -1 3 325.817 4.189 20 0 EIADHM CCOc1ccc(COC(=O)c2cc3cc(Cl)sc3[n-]2)nc1 ZINC000811396761 1049053796 /nfs/dbraw/zinc/05/37/96/1049053796.db2.gz SDLOUXLMWJFSCT-UHFFFAOYSA-N -1 3 336.800 4.034 20 0 EIADHM CCc1ccc([O-])c(C(=O)Nc2ccc3c(c2)nc2n3CCCCC2)c1 ZINC001136093558 1049087234 /nfs/dbraw/zinc/08/72/34/1049087234.db2.gz XAZZCGRWPAPDIP-UHFFFAOYSA-N -1 3 349.434 4.283 20 0 EIADHM CCCC[C@H](C)N(CCCC)C(=O)c1nnc2ccccc2c1[O-] ZINC000818925067 1049221776 /nfs/dbraw/zinc/22/17/76/1049221776.db2.gz UUZVVTIFRUYMGY-AWEZNQCLSA-N -1 3 329.444 4.156 20 0 EIADHM [O-]c1ccc(F)c(CNc2nnc(C3CCCCC3)s2)c1F ZINC000811835332 1049284467 /nfs/dbraw/zinc/28/44/67/1049284467.db2.gz RYTGFUMUWNVSQX-UHFFFAOYSA-N -1 3 325.384 4.182 20 0 EIADHM C[C@H]1CCC[C@@H](NC(=O)c2cc(CCc3ccccc3)ccc2[O-])C1 ZINC001136204255 1049292714 /nfs/dbraw/zinc/29/27/14/1049292714.db2.gz ISLMRSDLNDAYDL-QFBILLFUSA-N -1 3 337.463 4.486 20 0 EIADHM CCO[C@H]1C[C@H](NC(=O)c2cc3sccc3c([O-])c2)C12CCCC2 ZINC001148552721 1049330815 /nfs/dbraw/zinc/33/08/15/1049330815.db2.gz DOMOOGDKDGSAPZ-IRXDYDNUSA-N -1 3 345.464 4.075 20 0 EIADHM CC(=O)c1cc(C(=O)Nc2ccc(-c3cccc(O)c3)cc2)ccc1[O-] ZINC001148663748 1049356411 /nfs/dbraw/zinc/35/64/11/1049356411.db2.gz FKFGSFFKAHUDJN-UHFFFAOYSA-N -1 3 347.370 4.220 20 0 EIADHM CC(=O)c1cc(C(=O)Nc2ccc(-c3ccc(N)cc3)cc2)ccc1[O-] ZINC001148663269 1049357061 /nfs/dbraw/zinc/35/70/61/1049357061.db2.gz YBIDXKGZRSZLNM-UHFFFAOYSA-N -1 3 346.386 4.096 20 0 EIADHM CC(=O)c1cc(C(=O)NC2(c3cccc4ccccc43)CC2)ccc1[O-] ZINC001148671511 1049359062 /nfs/dbraw/zinc/35/90/62/1049359062.db2.gz WDKWXILBZGDNGK-UHFFFAOYSA-N -1 3 345.398 4.167 20 0 EIADHM Cc1cc([C@H](C)NCc2nc3c4ccccc4oc3c(=O)[n-]2)c(C)o1 ZINC000348099913 1049420590 /nfs/dbraw/zinc/42/05/90/1049420590.db2.gz XPJHQERNAQWDFS-NSHDSACASA-N -1 3 337.379 4.142 20 0 EIADHM O=S(=O)(/C=C\c1cccc(Cl)c1)[N-]c1cc2c(cn1)CCCC2 ZINC000812333463 1049443719 /nfs/dbraw/zinc/44/37/19/1049443719.db2.gz OMJLZVVREMTSEW-HJWRWDBZSA-N -1 3 348.855 4.026 20 0 EIADHM CC[C@@H]1CCc2nc(NC(=O)c3ccc(C)c(C)c3[O-])sc2C1 ZINC001136324088 1049474538 /nfs/dbraw/zinc/47/45/38/1049474538.db2.gz VRJKEAVDGYUZKH-GFCCVEGCSA-N -1 3 330.453 4.233 20 0 EIADHM O=S(=O)([N-]Cc1csc2ccccc12)c1ccc(Cl)s1 ZINC000615245783 1049574297 /nfs/dbraw/zinc/57/42/97/1049574297.db2.gz QUWCYRUDDPPHRA-UHFFFAOYSA-N -1 3 343.882 4.095 20 0 EIADHM COc1ccccc1C(C)(C)CNC(=O)c1cc([O-])c2ccccc2c1 ZINC001136482675 1049670243 /nfs/dbraw/zinc/67/02/43/1049670243.db2.gz JTJUERRPSADPHS-UHFFFAOYSA-N -1 3 349.430 4.262 20 0 EIADHM O=C(NC1(c2ccc(Cl)cc2)CCCCC1)c1ccc(O)cc1[O-] ZINC001136543159 1049738175 /nfs/dbraw/zinc/73/81/75/1049738175.db2.gz IAHBEWLDDPIQFW-UHFFFAOYSA-N -1 3 345.826 4.341 20 0 EIADHM O=C(Cc1csc(C2CCCC2)n1)Nc1c([O-])cccc1Cl ZINC000823161271 1049827773 /nfs/dbraw/zinc/82/77/73/1049827773.db2.gz QGEDVNJCIDUIBK-UHFFFAOYSA-N -1 3 336.844 4.341 20 0 EIADHM CC(C)c1ccc(C(=O)NCCc2nc(C(C)(C)C)cs2)c([O-])c1 ZINC001136718710 1049848324 /nfs/dbraw/zinc/84/83/24/1049848324.db2.gz CBRYHZHQZINTKF-UHFFFAOYSA-N -1 3 346.496 4.242 20 0 EIADHM CCc1ccc(C(=O)N2CCS[C@@H](C)[C@@H]2c2ccccc2)c([O-])c1 ZINC001136790733 1049884435 /nfs/dbraw/zinc/88/44/35/1049884435.db2.gz DDWMMTPNLWTKMP-IFXJQAMLSA-N -1 3 341.476 4.273 20 0 EIADHM CCC[C@H]1SCCN1C(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC001136820247 1049896529 /nfs/dbraw/zinc/89/65/29/1049896529.db2.gz PRKSFSAVKLFDRW-LJQANCHMSA-N -1 3 341.476 4.298 20 0 EIADHM Cc1ccccc1C(F)(F)C(=O)[N-][C@H](C)c1ccc(F)c(F)c1 ZINC001136834766 1049902743 /nfs/dbraw/zinc/90/27/43/1049902743.db2.gz BVFZHQDAVORAOG-LLVKDONJSA-N -1 3 325.305 4.242 20 0 EIADHM CCc1onc(C)c1[N-]C(=O)c1csc(-c2ccccc2F)n1 ZINC000089392132 1050116975 /nfs/dbraw/zinc/11/69/75/1050116975.db2.gz KCSVPAOHSBINCI-UHFFFAOYSA-N -1 3 331.372 4.060 20 0 EIADHM [O-]c1cncc(-c2nc(-c3ccc(C(F)(F)F)cc3Cl)no2)c1 ZINC001212708384 1050329195 /nfs/dbraw/zinc/32/91/95/1050329195.db2.gz GYVAHIMMFCIIMT-UHFFFAOYSA-N -1 3 341.676 4.176 20 0 EIADHM CC(=O)OCc1cccc(Cl)c1Nc1c(F)cc([O-])cc1F ZINC001212778493 1050339739 /nfs/dbraw/zinc/33/97/39/1050339739.db2.gz VSMQXDLSLWIHDH-UHFFFAOYSA-N -1 3 327.714 4.131 20 0 EIADHM Cc1sc2[n-]c([C@H](C)OC(=O)[C@H]3C[C@]3(C)C(C)C)nc(=O)c2c1C ZINC000775071702 1050463004 /nfs/dbraw/zinc/46/30/04/1050463004.db2.gz KDUHINWYHXEKLD-GLUANWCPSA-N -1 3 348.468 4.300 20 0 EIADHM CC1(C)CO[C@@H](c2cccc(Cl)c2)CN1C(=O)c1ccccc1[O-] ZINC000618784149 1050522559 /nfs/dbraw/zinc/52/25/59/1050522559.db2.gz OHWMSDCVWBAMTI-QGZVFWFLSA-N -1 3 345.826 4.038 20 0 EIADHM O=S(=O)(CCc1cccc2ccccc21)[N-]c1cccc(F)c1F ZINC001187608091 1050579763 /nfs/dbraw/zinc/57/97/63/1050579763.db2.gz MXRHZZQIIFZJMA-UHFFFAOYSA-N -1 3 347.386 4.102 20 0 EIADHM O=C(Nc1cc(=O)[n-]n1C1CCCC1)Nc1ccc(F)c(Cl)c1 ZINC001187670743 1050591410 /nfs/dbraw/zinc/59/14/10/1050591410.db2.gz IALDAQMZSJSCAZ-UHFFFAOYSA-N -1 3 338.770 4.140 20 0 EIADHM Cc1cc(S(=O)(=O)[N-]c2cccc(-c3ccccc3)c2)ccc1N ZINC001173911273 1050622932 /nfs/dbraw/zinc/62/29/32/1050622932.db2.gz GKUQSHBYWOEATP-UHFFFAOYSA-N -1 3 338.432 4.045 20 0 EIADHM COc1ccc(Cl)cc1NC(=O)[N-]c1cc(-c2ccncc2)no1 ZINC001187904823 1050641481 /nfs/dbraw/zinc/64/14/81/1050641481.db2.gz VCFLHATYRQMZAV-UHFFFAOYSA-N -1 3 344.758 4.043 20 0 EIADHM O=C(c1ccc(Nc2cccc(Cl)c2[O-])cc1)N1CCCCC1 ZINC001174072396 1050745675 /nfs/dbraw/zinc/74/56/75/1050745675.db2.gz MWSLUYCQWHZBIV-UHFFFAOYSA-N -1 3 330.815 4.415 20 0 EIADHM CC(C)CNC(=O)c1ccc(Nc2nc3c(cccc3[O-])s2)cc1 ZINC001174078423 1050752141 /nfs/dbraw/zinc/75/21/41/1050752141.db2.gz ZDTRYUISHCDJDZ-UHFFFAOYSA-N -1 3 341.436 4.131 20 0 EIADHM O=S(=O)([N-]c1ccccc1F)c1ccc(-c2ccc(F)cc2)cc1 ZINC001188419407 1050762812 /nfs/dbraw/zinc/76/28/12/1050762812.db2.gz DFUSMQBOZGWUPY-UHFFFAOYSA-N -1 3 345.370 4.433 20 0 EIADHM CCCCOc1c(NC(=O)c2c(C)cccc2[O-])ccc(F)c1F ZINC001188649256 1050813025 /nfs/dbraw/zinc/81/30/25/1050813025.db2.gz WOQRYKRTYFAZDB-UHFFFAOYSA-N -1 3 335.350 4.410 20 0 EIADHM Cc1ccc(Nc2cccc(C(=O)NCC(C)C)c2)c(Cl)c1[O-] ZINC001174194091 1050830594 /nfs/dbraw/zinc/83/05/94/1050830594.db2.gz UOSHURWLDXQJAK-UHFFFAOYSA-N -1 3 332.831 4.483 20 0 EIADHM [O-]c1ccccc1-c1nnc(CSc2ccnc3ccccc32)o1 ZINC001188752105 1050830487 /nfs/dbraw/zinc/83/04/87/1050830487.db2.gz TWRNTDXEWXSVIF-UHFFFAOYSA-N -1 3 335.388 4.283 20 0 EIADHM O=C(NC1CCCC1)c1cccc(Nc2cc(F)c([O-])c(F)c2)c1 ZINC001174198545 1050834068 /nfs/dbraw/zinc/83/40/68/1050834068.db2.gz ICWLUCOLZQMNNJ-UHFFFAOYSA-N -1 3 332.350 4.086 20 0 EIADHM O=C(NCc1ccco1)c1cccc(Nc2cccc([O-])c2Cl)c1 ZINC001174200786 1050836561 /nfs/dbraw/zinc/83/65/61/1050836561.db2.gz CFKMZELYJUFOFX-UHFFFAOYSA-N -1 3 342.782 4.312 20 0 EIADHM Cc1nc(-c2cccc(C(=O)Nc3ccc(F)c([O-])c3)c2)cs1 ZINC001188838495 1050846580 /nfs/dbraw/zinc/84/65/80/1050846580.db2.gz VOMWLIGONMSPPZ-UHFFFAOYSA-N -1 3 328.368 4.216 20 0 EIADHM COc1cc(Nc2ncc(F)cc2[O-])ccc1OCc1ccccc1 ZINC001174443031 1050974543 /nfs/dbraw/zinc/97/45/43/1050974543.db2.gz JPYYUPRLTRXZOW-UHFFFAOYSA-N -1 3 340.354 4.258 20 0 EIADHM Cc1ccc2cccc([N-]S(=O)(=O)Cc3cccc(F)c3F)c2c1 ZINC001189455447 1050996286 /nfs/dbraw/zinc/99/62/86/1050996286.db2.gz GSBZSNMZUSNMNC-UHFFFAOYSA-N -1 3 347.386 4.368 20 0 EIADHM COc1cc(Cl)ccc1[N-]S(=O)(=O)/C=C/c1ccc(C)cc1 ZINC000775294940 1051041541 /nfs/dbraw/zinc/04/15/41/1051041541.db2.gz ITVQBWLBAHRLQX-MDZDMXLPSA-N -1 3 337.828 4.070 20 0 EIADHM Cc1ccc(C(C)(C)C(=O)Nc2cc(Br)ccc2[O-])cc1 ZINC001180605640 1051049962 /nfs/dbraw/zinc/04/99/62/1051049962.db2.gz DMYPLPMULHJLMW-UHFFFAOYSA-N -1 3 348.240 4.379 20 0 EIADHM CC[C@@H](CC(=O)Nc1n[n-]c(SCc2ccc(C)cc2)n1)C(C)C ZINC001180832371 1051084876 /nfs/dbraw/zinc/08/48/76/1051084876.db2.gz IFIDMEJGHZHSAL-HNNXBMFYSA-N -1 3 346.500 4.416 20 0 EIADHM CC(C)(C)[C@@H]1CCN1C(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC001181282072 1051197018 /nfs/dbraw/zinc/19/70/18/1051197018.db2.gz NIVSYQHJNHNUGJ-SFHVURJKSA-N -1 3 325.408 4.445 20 0 EIADHM CC(=O)c1cccc([O-])c1NC(=O)c1csc(-c2cccs2)n1 ZINC001190574928 1051220875 /nfs/dbraw/zinc/22/08/75/1051220875.db2.gz MOVCIQYKPCSDAR-UHFFFAOYSA-N -1 3 344.417 4.032 20 0 EIADHM Cc1ccc([N-]S(=O)(=O)c2ccc(N)c(Cl)c2)c2ccccc12 ZINC001174986397 1051306433 /nfs/dbraw/zinc/30/64/33/1051306433.db2.gz CZDQENMLJXQMRM-UHFFFAOYSA-N -1 3 346.839 4.185 20 0 EIADHM COC(=O)c1ccc(C(F)(F)F)c(Nc2c(F)cc([O-])cc2F)c1 ZINC001175099348 1051345513 /nfs/dbraw/zinc/34/55/13/1051345513.db2.gz BMOIVTIVPNMNQL-UHFFFAOYSA-N -1 3 347.239 4.219 20 0 EIADHM COc1c(Br)cccc1Nc1c(F)cc([O-])cc1F ZINC001175099610 1051346105 /nfs/dbraw/zinc/34/61/05/1051346105.db2.gz PAWGFNKPMPERPC-UHFFFAOYSA-N -1 3 330.128 4.185 20 0 EIADHM CCOC(=O)CCc1ccc(Nc2c(F)cc([O-])cc2F)cc1F ZINC001175102498 1051349405 /nfs/dbraw/zinc/34/94/05/1051349405.db2.gz MTHLKIOVVBWNKM-UHFFFAOYSA-N -1 3 339.313 4.049 20 0 EIADHM CC(C)(C)OC(=O)c1ccc(Nc2c(F)cc([O-])cc2F)cc1O ZINC001175102490 1051350660 /nfs/dbraw/zinc/35/06/60/1051350660.db2.gz MOTUWYWBIAPAKD-UHFFFAOYSA-N -1 3 337.322 4.075 20 0 EIADHM CC(=O)c1cccc([O-])c1NC(=O)C1c2ccccc2-c2ccccc21 ZINC001181915758 1051353187 /nfs/dbraw/zinc/35/31/87/1051353187.db2.gz SHLRIUJBQOPESZ-UHFFFAOYSA-N -1 3 343.382 4.346 20 0 EIADHM CCCCc1ccc(S(=O)(=O)[N-]c2ccnc(Cl)c2F)cc1 ZINC001191232706 1051403694 /nfs/dbraw/zinc/40/36/94/1051403694.db2.gz DMJRVCUPDOXIRI-UHFFFAOYSA-N -1 3 342.823 4.018 20 0 EIADHM Cc1cc(F)c(S(=O)(=O)[N-]CC2(C)CCC(C)(C)CC2)cc1F ZINC001191396168 1051438994 /nfs/dbraw/zinc/43/89/94/1051438994.db2.gz RVZZHCFRTWXXBW-UHFFFAOYSA-N -1 3 345.455 4.158 20 0 EIADHM CC(C)(C)COc1cccc(F)c1[N-]S(=O)(=O)CC1CCCC1 ZINC001191535349 1051476466 /nfs/dbraw/zinc/47/64/66/1051476466.db2.gz JNMOODJVEPSUDL-UHFFFAOYSA-N -1 3 343.464 4.183 20 0 EIADHM [O-]c1ccc(F)c(Nc2c(Cl)c(F)nc(F)c2Cl)c1F ZINC001175262540 1051500684 /nfs/dbraw/zinc/50/06/84/1051500684.db2.gz JHMNIVUBCJXKOL-UHFFFAOYSA-N -1 3 327.064 4.394 20 0 EIADHM [O-]c1ccc(F)c(Nc2cc(F)c(F)cc2Br)c1F ZINC001175266354 1051503020 /nfs/dbraw/zinc/50/30/20/1051503020.db2.gz XWAUDMQUSHOLLW-UHFFFAOYSA-N -1 3 336.082 4.455 20 0 EIADHM [O-]c1ccc(F)c(Nc2cc(F)c(F)c(Br)c2)c1F ZINC001175270030 1051506217 /nfs/dbraw/zinc/50/62/17/1051506217.db2.gz SNAFSMRUDNQSGP-UHFFFAOYSA-N -1 3 336.082 4.455 20 0 EIADHM CCOC(=O)c1cnc2cccc(Nc3c(F)ccc([O-])c3F)c2c1 ZINC001175269091 1051507221 /nfs/dbraw/zinc/50/72/21/1051507221.db2.gz BBTPUNMISMVLDU-UHFFFAOYSA-N -1 3 344.317 4.139 20 0 EIADHM Cc1cc([O-])c(NC(=O)N[C@H]2CC[C@H](C)CC2)cc1Br ZINC001191825003 1051563025 /nfs/dbraw/zinc/56/30/25/1051563025.db2.gz VYBOINZETFVXSZ-HOMQSWHASA-N -1 3 341.249 4.163 20 0 EIADHM FC(F)(F)Sc1cccc(Nc2ccc(-c3nn[n-]n3)cc2)c1 ZINC001175429601 1051588557 /nfs/dbraw/zinc/58/85/57/1051588557.db2.gz KZNZUBFKSCBDHX-UHFFFAOYSA-N -1 3 337.330 4.222 20 0 EIADHM COc1ccc2cc(S(=O)(=O)[N-]c3cccc(C)c3F)ccc2c1 ZINC001191963440 1051602381 /nfs/dbraw/zinc/60/23/81/1051602381.db2.gz PQEKCSQAPUUXED-UHFFFAOYSA-N -1 3 345.395 4.097 20 0 EIADHM O=C(Nc1cc([O-])cc(Cl)c1)c1ccc(Oc2ccccc2)nc1 ZINC001192081954 1051622857 /nfs/dbraw/zinc/62/28/57/1051622857.db2.gz ZHPAACVEWFOMRF-UHFFFAOYSA-N -1 3 340.766 4.485 20 0 EIADHM CCCCOc1ccc(C(=O)N[C@@H](C)CCc2ccc(C)o2)c([O-])c1 ZINC001182822999 1051719205 /nfs/dbraw/zinc/71/92/05/1051719205.db2.gz MLQWHYZEPHHLDU-AWEZNQCLSA-N -1 3 345.439 4.224 20 0 EIADHM O=C(Nc1cc2ccccc2cc1[O-])C(=O)c1ccc(Cl)cc1 ZINC001182896221 1051736507 /nfs/dbraw/zinc/73/65/07/1051736507.db2.gz PQIXLMKKOZVRHI-UHFFFAOYSA-N -1 3 325.751 4.020 20 0 EIADHM COC(=O)c1ccc([O-])cc1NC(=O)Nc1ccc2sccc2c1 ZINC001192454469 1051738429 /nfs/dbraw/zinc/73/84/29/1051738429.db2.gz GPHUWKREQUMWHH-UHFFFAOYSA-N -1 3 342.376 4.038 20 0 EIADHM CCCCCSc1ncccc1C(=O)Nc1ccc(F)c([O-])c1 ZINC001192588539 1051771033 /nfs/dbraw/zinc/77/10/33/1051771033.db2.gz GIRPBDAPGVBKGV-UHFFFAOYSA-N -1 3 334.416 4.461 20 0 EIADHM C[C@@H](NC(=O)Nc1ccc(C(F)(F)F)cc1[O-])c1ccc(F)cc1 ZINC001193143075 1051879133 /nfs/dbraw/zinc/87/91/33/1051879133.db2.gz QAZLQWJDIYUEDM-SECBINFHSA-N -1 3 342.292 4.433 20 0 EIADHM CCN(CC)C(=O)c1ccc(F)c(Nc2ccc([O-])c(Cl)c2)c1 ZINC001176068493 1051904431 /nfs/dbraw/zinc/90/44/31/1051904431.db2.gz GXWFAVYAYGLWFO-UHFFFAOYSA-N -1 3 336.794 4.410 20 0 EIADHM COCOc1ccc(Nc2cccc([O-])c2Br)cc1F ZINC001176191246 1051937450 /nfs/dbraw/zinc/93/74/50/1051937450.db2.gz UCSYMHIBDXZECJ-UHFFFAOYSA-N -1 3 342.164 4.020 20 0 EIADHM CCc1cccc(C(=O)Nc2ccc(-c3nc(C)c(C)[nH]3)cc2)c1[O-] ZINC001176211400 1051955853 /nfs/dbraw/zinc/95/58/53/1051955853.db2.gz QLXMMOIIAFDMGS-UHFFFAOYSA-N -1 3 335.407 4.214 20 0 EIADHM C[C@H]1CN(C(=O)c2ccc([O-])cc2C(F)(F)F)Cc2ccccc21 ZINC001193735523 1051977153 /nfs/dbraw/zinc/97/71/53/1051977153.db2.gz OFQHLBYAEWMXIV-NSHDSACASA-N -1 3 335.325 4.171 20 0 EIADHM Cc1c(CSC(C)C)cccc1NC(=O)c1cccc2n[n-]nc21 ZINC000163636171 1051999792 /nfs/dbraw/zinc/99/97/92/1051999792.db2.gz VVRQNFVYMQPYDX-UHFFFAOYSA-N -1 3 340.452 4.160 20 0 EIADHM Cc1nc(NC(=O)c2ccccc2-c2cccc(Cl)c2)cc(=O)[n-]1 ZINC001193803471 1052000763 /nfs/dbraw/zinc/00/07/63/1052000763.db2.gz LZHUBWJSXIVNQH-UHFFFAOYSA-N -1 3 339.782 4.063 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2ccc(N(C)C)cc2)c2ccccc12 ZINC001193824389 1052004098 /nfs/dbraw/zinc/00/40/98/1052004098.db2.gz GULHEUKROPNDPS-UHFFFAOYSA-N -1 3 340.448 4.015 20 0 EIADHM COc1ccc([N-]S(=O)(=O)c2ccc(C)c3ccccc32)c(F)c1 ZINC001193825461 1052004494 /nfs/dbraw/zinc/00/44/94/1052004494.db2.gz XGVHRQXVUGILLD-UHFFFAOYSA-N -1 3 345.395 4.097 20 0 EIADHM CCN(CC)C(=O)c1cc(F)cc(Nc2cccc([O-])c2Cl)c1 ZINC001176299168 1052004895 /nfs/dbraw/zinc/00/48/95/1052004895.db2.gz KHHHEBHVQGZIRP-UHFFFAOYSA-N -1 3 336.794 4.410 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2c(C)ccnc2Cl)c2ccccc12 ZINC001193834103 1052008129 /nfs/dbraw/zinc/00/81/29/1052008129.db2.gz SJBTWFZXMLPRSW-UHFFFAOYSA-N -1 3 346.839 4.306 20 0 EIADHM COc1c(Cl)cc([N-]c2nnc(-c3ccco3)o2)cc1Cl ZINC001176307219 1052012243 /nfs/dbraw/zinc/01/22/43/1052012243.db2.gz GFZRQJINNZENBY-UHFFFAOYSA-N -1 3 326.139 4.389 20 0 EIADHM Cc1ccc(S(=O)(=O)Nc2cccc([O-])c2Cl)c2ccccc12 ZINC001193864048 1052018864 /nfs/dbraw/zinc/01/88/64/1052018864.db2.gz NWEBJSMJJGGDPJ-UHFFFAOYSA-N -1 3 347.823 4.308 20 0 EIADHM [O-]c1cc(Nc2cccc3c2cnn3[C@H]2CCCCO2)c(F)cc1F ZINC001176314953 1052019335 /nfs/dbraw/zinc/01/93/35/1052019335.db2.gz CNJNNTKKXHKSHH-GOSISDBHSA-N -1 3 345.349 4.463 20 0 EIADHM CCN(CC)C(=O)c1cc(Nc2ccc([O-])c(F)c2F)ccc1F ZINC001176518971 1052107383 /nfs/dbraw/zinc/10/73/83/1052107383.db2.gz YETHNKOKYWFHPM-UHFFFAOYSA-N -1 3 338.329 4.035 20 0 EIADHM O=c1cc(Nc2ccc(OC(F)(F)F)cc2)n(C2CCCC2)[n-]1 ZINC001176640123 1052148773 /nfs/dbraw/zinc/14/87/73/1052148773.db2.gz LUDRKKMOMDLZAW-UHFFFAOYSA-N -1 3 327.306 4.346 20 0 EIADHM CCc1ccc(-c2nc(C(=O)[N-]c3csnc3OC)cs2)cc1 ZINC001176764325 1052193090 /nfs/dbraw/zinc/19/30/90/1052193090.db2.gz UISNUUGMFAKJTP-UHFFFAOYSA-N -1 3 345.449 4.090 20 0 EIADHM CC(C)(C)[C@@H]1CCCC[C@@H]1[N-]S(=O)(=O)c1cc(F)ccc1Cl ZINC001185319352 1052209002 /nfs/dbraw/zinc/20/90/02/1052209002.db2.gz XRMBTNFIEQJBNF-OCCSQVGLSA-N -1 3 347.883 4.362 20 0 EIADHM CCc1ccc(C(=O)N2CCC(Cc3ccc(F)cc3)CC2)c([O-])c1 ZINC000622343088 1052209818 /nfs/dbraw/zinc/20/98/18/1052209818.db2.gz PLAYTCARWVUXQP-UHFFFAOYSA-N -1 3 341.426 4.189 20 0 EIADHM CCc1ccc([O-])c(C(=O)N(CC(C)C)c2ccc(OC)cc2)c1 ZINC000622334922 1052213058 /nfs/dbraw/zinc/21/30/58/1052213058.db2.gz HRBBMFUPFZUTHB-UHFFFAOYSA-N -1 3 327.424 4.266 20 0 EIADHM Cc1cccc([C@@H](NC(=O)Cc2ccc([O-])c(F)c2)C(C)(C)C)c1 ZINC000622415220 1052254531 /nfs/dbraw/zinc/25/45/31/1052254531.db2.gz XIPPPTQQCSJVFU-LJQANCHMSA-N -1 3 329.415 4.286 20 0 EIADHM Cc1cc(S(=O)(=O)[N-]c2ccc(C)c(F)c2F)ccc1Cl ZINC001185525357 1052256101 /nfs/dbraw/zinc/25/61/01/1052256101.db2.gz ZLIDDDWKUNDHMC-UHFFFAOYSA-N -1 3 331.771 4.036 20 0 EIADHM O=C(Nc1cc(C(F)(F)F)ccc1F)Nc1ncc([O-])cc1Cl ZINC001185595348 1052270224 /nfs/dbraw/zinc/27/02/24/1052270224.db2.gz BATUQVUWZWVREX-UHFFFAOYSA-N -1 3 349.671 4.243 20 0 EIADHM O=C(Cc1ccc([O-])c(F)c1)NC1(c2cccc(Cl)c2)CCCC1 ZINC000622445804 1052279040 /nfs/dbraw/zinc/27/90/40/1052279040.db2.gz HDIPHFKXGPIGLU-UHFFFAOYSA-N -1 3 347.817 4.313 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)Nc1cc(F)cc(Cl)c1 ZINC000622444803 1052279137 /nfs/dbraw/zinc/27/91/37/1052279137.db2.gz VERBHOOJRUBJLK-UHFFFAOYSA-N -1 3 325.742 4.285 20 0 EIADHM C[C@H](C1CCCCC1)N(C)C(=O)c1cc([O-])cc(C(F)(F)F)c1 ZINC000622586687 1052339144 /nfs/dbraw/zinc/33/91/44/1052339144.db2.gz IXXGYUZKSUUQKL-LLVKDONJSA-N -1 3 329.362 4.452 20 0 EIADHM CCOc1ncccc1CN[C@@H](C)c1ccc(Cl)c(Cl)c1[O-] ZINC000184985955 1052345588 /nfs/dbraw/zinc/34/55/88/1052345588.db2.gz KSOHSHVHOFICTK-JTQLQIEISA-N -1 3 341.238 4.344 20 0 EIADHM COc1ccc2c(c1)C[C@@H](C(C)C)CN2C(=O)c1cc(C)ccc1[O-] ZINC000622728525 1052396167 /nfs/dbraw/zinc/39/61/67/1052396167.db2.gz DUHOFWRRMPFHMA-MRXNPFEDSA-N -1 3 339.435 4.184 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)N[C@@H](C1CCC1)C1CCCC1 ZINC000622736378 1052401676 /nfs/dbraw/zinc/40/16/76/1052401676.db2.gz ANCMADSBUXOUQI-HXUWFJFHSA-N -1 3 333.447 4.329 20 0 EIADHM CN(Cc1nc2c3ccccc3oc2c(=O)[n-]1)C(C)(C)c1ccccc1 ZINC000671246847 1052529696 /nfs/dbraw/zinc/52/96/96/1052529696.db2.gz ZXIRGLYMVCKEMP-UHFFFAOYSA-N -1 3 347.418 4.449 20 0 EIADHM CC[C@@]1(C(=O)[O-])CCCN(Cc2ncc(-c3cccc(Cl)c3)o2)C1 ZINC000325066607 1052638836 /nfs/dbraw/zinc/63/88/36/1052638836.db2.gz ZFTLXOJRTLMFLM-GOSISDBHSA-N -1 3 348.830 4.072 20 0 EIADHM Cc1nc(-c2ccccc2)c(C(=O)Nc2cccc([O-])c2F)s1 ZINC000179149246 1052724452 /nfs/dbraw/zinc/72/44/52/1052724452.db2.gz QZDFHEYFGNHXIJ-UHFFFAOYSA-N -1 3 328.368 4.216 20 0 EIADHM C[C@H](NCc1ccccc1[N+](=O)[O-])c1ccc(Cl)c(Cl)c1[O-] ZINC000185935686 1052828254 /nfs/dbraw/zinc/82/82/54/1052828254.db2.gz XUGRURGCIYILFW-VIFPVBQESA-N -1 3 341.194 4.458 20 0 EIADHM O=c1ccnc(C=Cc2csc(COc3ccc(Cl)cc3)n2)[n-]1 ZINC000764441718 1053106076 /nfs/dbraw/zinc/10/60/76/1053106076.db2.gz JSVLIYVLFAZYNQ-UTCJRWHESA-N -1 3 345.811 4.042 20 0 EIADHM Cc1cc(Oc2ccccc2)ccc1NC([O-])=NO[C@H]1CCCCO1 ZINC000775615114 1053113063 /nfs/dbraw/zinc/11/30/63/1053113063.db2.gz TYQSPFRMGBTFQG-SFHVURJKSA-N -1 3 342.395 4.367 20 0 EIADHM Cc1cc(Oc2ccccc2)ccc1NC(=O)[N-]O[C@H]1CCCCO1 ZINC000775615114 1053113086 /nfs/dbraw/zinc/11/30/86/1053113086.db2.gz TYQSPFRMGBTFQG-SFHVURJKSA-N -1 3 342.395 4.367 20 0 EIADHM CCOc1cc(CNc2ccc(OC)cc2F)cc(Cl)c1[O-] ZINC000864042504 1053187698 /nfs/dbraw/zinc/18/76/98/1053187698.db2.gz PAIQVYMYIAVLAB-UHFFFAOYSA-N -1 3 325.767 4.204 20 0 EIADHM COc1cc(C)c([N-]S(=O)(=O)c2cccc(C(C)C)c2)c(C)c1 ZINC001195156448 1053310324 /nfs/dbraw/zinc/31/03/24/1053310324.db2.gz MTHAPVSREYQLAQ-UHFFFAOYSA-N -1 3 333.453 4.236 20 0 EIADHM CSc1ccc([N-]S(=O)(=O)c2cccc(C(C)C)c2)c(F)c1 ZINC001195168921 1053313373 /nfs/dbraw/zinc/31/33/73/1053313373.db2.gz BYJRBVPKSWOHRU-UHFFFAOYSA-N -1 3 339.457 4.472 20 0 EIADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)[C@@H]3C[C@H]3C(C)(C)C)c2)n1 ZINC000864901477 1053380926 /nfs/dbraw/zinc/38/09/26/1053380926.db2.gz HRYDBPJPNLTSFZ-HZPDHXFCSA-N -1 3 339.439 4.032 20 0 EIADHM C[C@@H](NCc1cc(=O)oc2cc([O-])ccc12)c1ccccc1Cl ZINC000008172830 1053545045 /nfs/dbraw/zinc/54/50/45/1053545045.db2.gz KTLZJBYCKIBNCZ-LLVKDONJSA-N -1 3 329.783 4.003 20 0 EIADHM CCC[C@H](CCCCNCc1cscc1Br)C(=O)[O-] ZINC000417643076 1053550501 /nfs/dbraw/zinc/55/05/01/1053550501.db2.gz YRHIWXCOFXQJPN-LLVKDONJSA-N -1 3 348.306 4.271 20 0 EIADHM Cc1ccc([O-])c(NC(=O)c2cnc(-c3ccc(Cl)cc3)s2)n1 ZINC001196422593 1053669805 /nfs/dbraw/zinc/66/98/05/1053669805.db2.gz XTFQSXFQTPQXOG-UHFFFAOYSA-N -1 3 345.811 4.125 20 0 EIADHM [O-]c1ccc(CNCc2sccc2Br)cc1Cl ZINC000083552465 1053682736 /nfs/dbraw/zinc/68/27/36/1053682736.db2.gz RWTKLKZKLIDFNX-UHFFFAOYSA-N -1 3 332.650 4.159 20 0 EIADHM [O-]c1cccc(F)c1NC(=S)Nc1ccccc1C(F)(F)F ZINC001197257778 1053863146 /nfs/dbraw/zinc/86/31/46/1053863146.db2.gz FLSGCNBZYLQEDX-UHFFFAOYSA-N -1 3 330.306 4.359 20 0 EIADHM O[C@H](CSc1nnc([N-]c2ccccc2F)s1)c1ccccc1 ZINC000010428185 1053957932 /nfs/dbraw/zinc/95/79/32/1053957932.db2.gz HKPONUKSBQUMBI-CQSZACIVSA-N -1 3 347.440 4.247 20 0 EIADHM COc1c(C)ccc([N-]S(=O)(=O)c2ccc(C(C)C)cc2)c1C ZINC000031722667 1054077504 /nfs/dbraw/zinc/07/75/04/1054077504.db2.gz UTGHCQYAMNHYCK-UHFFFAOYSA-N -1 3 333.453 4.236 20 0 EIADHM Cc1ccc([O-])c(C(=O)Nc2cccc(C3SCCS3)c2)c1 ZINC000018216276 1054103946 /nfs/dbraw/zinc/10/39/46/1054103946.db2.gz CADZICVSCVLUQS-UHFFFAOYSA-N -1 3 331.462 4.432 20 0 EIADHM O=C(CC1CCC(C(F)(F)F)CC1)[N-]OCCCC(F)(F)F ZINC000871214442 1054169825 /nfs/dbraw/zinc/16/98/25/1054169825.db2.gz FTYFCNAEBZLFPU-UHFFFAOYSA-N -1 3 335.288 4.136 20 0 EIADHM Cc1ccc(OCCCC(=O)[N-]OCc2ccccc2)c(Cl)c1 ZINC000857432500 1054235490 /nfs/dbraw/zinc/23/54/90/1054235490.db2.gz CRCHPDLLIAMRCS-UHFFFAOYSA-N -1 3 333.815 4.055 20 0 EIADHM C[C@@H](CNC(=O)c1cc([O-])c2ccccc2c1)Sc1ccccc1 ZINC000472203485 1054247417 /nfs/dbraw/zinc/24/74/17/1054247417.db2.gz BZVYITUJIHIADF-AWEZNQCLSA-N -1 3 337.444 4.456 20 0 EIADHM CC[C@@](C)(NC(=O)c1cc([O-])c2ccccc2c1)c1nccs1 ZINC000472203294 1054247710 /nfs/dbraw/zinc/24/77/10/1054247710.db2.gz FONOYKKSLBFKCR-GOSISDBHSA-N -1 3 326.421 4.057 20 0 EIADHM O=C([N-]Cc1cccc(O)c1)C(F)(F)c1cc(Cl)ccc1Cl ZINC000857452303 1054249948 /nfs/dbraw/zinc/24/99/48/1054249948.db2.gz VJSWYGUPGQHQBR-UHFFFAOYSA-N -1 3 346.160 4.107 20 0 EIADHM CCc1ccc(CC(=O)[N-]OCc2ccc(C(F)(F)F)cc2)cc1 ZINC000857473463 1054266395 /nfs/dbraw/zinc/26/63/95/1054266395.db2.gz QFVLEPXUXRRWGL-UHFFFAOYSA-N -1 3 337.341 4.058 20 0 EIADHM C[C@@H](CC(=O)[N-]OCc1ccc(F)cc1)Cc1ccc(Cl)cc1 ZINC000857484338 1054271973 /nfs/dbraw/zinc/27/19/73/1054271973.db2.gz BURDRBHMHHBQBL-CYBMUJFWSA-N -1 3 335.806 4.296 20 0 EIADHM CC(C)(C)Oc1ccncc1NC(=O)c1cc([O-])c2ccccc2c1 ZINC000472416820 1054313854 /nfs/dbraw/zinc/31/38/54/1054313854.db2.gz CJULCHJIDIBHBE-UHFFFAOYSA-N -1 3 336.391 4.370 20 0 EIADHM O=C(COC(=O)c1cc(Cl)c(Cl)[n-]1)c1ccc(Cl)s1 ZINC000011809047 1054322180 /nfs/dbraw/zinc/32/21/80/1054322180.db2.gz TZYRZQYAKSNEEY-UHFFFAOYSA-N -1 3 338.599 4.076 20 0 EIADHM C[C@@H](NCc1cccnc1OC1CCCC1)c1cccc([O-])c1F ZINC000872023259 1054336704 /nfs/dbraw/zinc/33/67/04/1054336704.db2.gz QVFRXUUSZIUMAG-CYBMUJFWSA-N -1 3 330.403 4.099 20 0 EIADHM O=C(OCc1coc(-c2ccccc2)n1)c1cccc(Cl)c1[O-] ZINC000775934309 1054338253 /nfs/dbraw/zinc/33/82/53/1054338253.db2.gz MEDVFEZJRGHTKZ-UHFFFAOYSA-N -1 3 329.739 4.058 20 0 EIADHM COc1cc(C)c([C@H](C)N[C@@H](C)c2cccc([O-])c2F)cc1OC ZINC000872022894 1054339231 /nfs/dbraw/zinc/33/92/31/1054339231.db2.gz MTMDLQBREFYGTO-STQMWFEESA-N -1 3 333.403 4.269 20 0 EIADHM CCn1c2ccccc2nc1[C@@H](C)N[C@@H](C)c1cccc([O-])c1F ZINC000872045218 1054359178 /nfs/dbraw/zinc/35/91/78/1054359178.db2.gz KAMBYJLDTMYXSJ-QWHCGFSZSA-N -1 3 327.403 4.313 20 0 EIADHM C[C@@H](Nc1ccc(OC[C@H]2CCCO2)cc1)c1cccc([O-])c1F ZINC000872055816 1054366966 /nfs/dbraw/zinc/36/69/66/1054366966.db2.gz LHBTWPCLQUBBLG-CZUORRHYSA-N -1 3 331.387 4.262 20 0 EIADHM C[C@@H](N[C@@H](C)c1ccc(C(F)(F)F)nc1)c1cccc([O-])c1F ZINC000872130825 1054406673 /nfs/dbraw/zinc/40/66/73/1054406673.db2.gz SKLPTQDQZCGNLZ-VHSXEESVSA-N -1 3 328.309 4.357 20 0 EIADHM Cc1cc(CN2CCC(Cc3ccccc3Cl)CC2)oc1C(=O)[O-] ZINC000872165001 1054415831 /nfs/dbraw/zinc/41/58/31/1054415831.db2.gz YKZXBUCRZATRRH-UHFFFAOYSA-N -1 3 347.842 4.394 20 0 EIADHM Cc1cc(CN2CCC(Cc3ccc(Cl)cc3)CC2)oc1C(=O)[O-] ZINC000872163467 1054416397 /nfs/dbraw/zinc/41/63/97/1054416397.db2.gz HQBFKIHTWBOJBU-UHFFFAOYSA-N -1 3 347.842 4.394 20 0 EIADHM [O-]c1cc(C(F)(F)F)ccc1NC(=S)NCC1CCCCC1 ZINC001199927116 1054498058 /nfs/dbraw/zinc/49/80/58/1054498058.db2.gz OEXTYUCIVDWNKW-UHFFFAOYSA-N -1 3 332.391 4.278 20 0 EIADHM [O-]c1ccc(Br)cc1NC(=S)NC1CCCCCC1 ZINC001199968012 1054506033 /nfs/dbraw/zinc/50/60/33/1054506033.db2.gz KRIVNFIEJIXJHV-UHFFFAOYSA-N -1 3 343.290 4.164 20 0 EIADHM O=C([N-]c1nnc(C2CCCCC2)s1)c1coc(C(F)F)c1 ZINC000858693426 1054549441 /nfs/dbraw/zinc/54/94/41/1054549441.db2.gz OEUWEVPXQKGYJO-UHFFFAOYSA-N -1 3 327.356 4.369 20 0 EIADHM CCCCCCNC(=S)Nc1cc(Br)ccc1[O-] ZINC001200952345 1054603203 /nfs/dbraw/zinc/60/32/03/1054603203.db2.gz FBVQNHMANICTHH-UHFFFAOYSA-N -1 3 331.279 4.021 20 0 EIADHM CC(C)C[C@@H](NC(=O)c1cc(=O)c2ccccc2[n-]1)c1ccccc1 ZINC000061225340 1054748428 /nfs/dbraw/zinc/74/84/28/1054748428.db2.gz OSWCUJHZZNJZOM-GOSISDBHSA-N -1 3 334.419 4.045 20 0 EIADHM CN(Cc1csc2ccccc12)C(=O)c1cc(=O)c2ccccc2[n-]1 ZINC000065780528 1054959514 /nfs/dbraw/zinc/95/95/14/1054959514.db2.gz PTVKXMGQTVGGSY-UHFFFAOYSA-N -1 3 348.427 4.015 20 0 EIADHM O=C([N-]c1cc(-c2ccco2)no1)Nc1ccccc1Br ZINC001201968038 1054972106 /nfs/dbraw/zinc/97/21/06/1054972106.db2.gz RFOWLOOUWMYVBP-UHFFFAOYSA-N -1 3 348.156 4.341 20 0 EIADHM COc1ccc(NC(=O)c2ccc(C)cc2[O-])cc1OC1CCCC1 ZINC000031387846 1054992168 /nfs/dbraw/zinc/99/21/68/1054992168.db2.gz IAMQVIISEHQLDM-UHFFFAOYSA-N -1 3 341.407 4.283 20 0 EIADHM Cc1ccccc1-c1nc(C(=O)[N-]c2nnc(C3CC3)s2)cs1 ZINC000066269512 1054992633 /nfs/dbraw/zinc/99/26/33/1054992633.db2.gz DIVKTMVFKGWTJW-UHFFFAOYSA-N -1 3 342.449 4.100 20 0 EIADHM O=C(Nc1ccc(Br)cc1[O-])Nc1ccccc1Cl ZINC001202063697 1055005330 /nfs/dbraw/zinc/00/53/30/1055005330.db2.gz RXTNXBBWVBADPD-UHFFFAOYSA-N -1 3 341.592 4.452 20 0 EIADHM Cc1ccccc1NC(=O)Nc1ccc(C(=O)OC(C)(C)C)cc1[O-] ZINC001202187051 1055073707 /nfs/dbraw/zinc/07/37/07/1055073707.db2.gz ROTIRXDMIAUYQL-UHFFFAOYSA-N -1 3 342.395 4.300 20 0 EIADHM COC(=O)c1cc(Cl)cc(NC(=O)Nc2c(C)cccc2C)c1[O-] ZINC001202209010 1055086441 /nfs/dbraw/zinc/08/64/41/1055086441.db2.gz AKLCINYHFHAPOV-UHFFFAOYSA-N -1 3 348.786 4.093 20 0 EIADHM O=C(c1cc2sccc2c([O-])c1)N1C[C@@H]2C[C@@H](c3ccccc3)[C@@H]2C1 ZINC000863239802 1055170618 /nfs/dbraw/zinc/17/06/18/1055170618.db2.gz IXPPTNBEXHFTTE-RYQLBKOJSA-N -1 3 349.455 4.483 20 0 EIADHM O=c1cc(CNc2cccc(SC(F)(F)F)c2)nc(C2CC2)[n-]1 ZINC000863364978 1055193238 /nfs/dbraw/zinc/19/32/38/1055193238.db2.gz BIGNOTRPENDUFC-UHFFFAOYSA-N -1 3 341.358 4.284 20 0 EIADHM [O-]c1ccccc1-c1nnc(CN(C2CC2)[C@@H]2CCc3ccccc32)o1 ZINC000878216886 1055210073 /nfs/dbraw/zinc/21/00/73/1055210073.db2.gz QGQPXLKNUPJJDU-GOSISDBHSA-N -1 3 347.418 4.094 20 0 EIADHM CC(C)(C)c1nnc([N-]C(=O)c2sccc2SC(F)F)s1 ZINC000107121386 1055211998 /nfs/dbraw/zinc/21/19/98/1055211998.db2.gz ZBKAGGRWGLDPKM-UHFFFAOYSA-N -1 3 349.453 4.464 20 0 EIADHM O=C([N-]CC1(C(F)(F)F)CCCC1)C(F)(F)c1ccc(F)cc1 ZINC000863508055 1055217780 /nfs/dbraw/zinc/21/77/80/1055217780.db2.gz COTZCAYLWCAAES-UHFFFAOYSA-N -1 3 339.279 4.156 20 0 EIADHM Cc1cccc(C2(NCc3nnc(-c4ccccc4[O-])o3)CCCC2)c1 ZINC000878237055 1055218012 /nfs/dbraw/zinc/21/80/12/1055218012.db2.gz TYPOZYAVQPBYDO-UHFFFAOYSA-N -1 3 349.434 4.310 20 0 EIADHM CCc1ccc(C(C)(C)NCc2nnc(-c3ccccc3[O-])o2)cc1 ZINC000878367860 1055275174 /nfs/dbraw/zinc/27/51/74/1055275174.db2.gz DEPADTAPGBPLJF-UHFFFAOYSA-N -1 3 337.423 4.030 20 0 EIADHM COC[C@@H](/N=C/c1cc(Cl)ccc1[O-])c1ccc(F)c(F)c1 ZINC000090987729 1055538898 /nfs/dbraw/zinc/53/88/98/1055538898.db2.gz XHNBVJUWERIYKF-SOQIOHJVSA-N -1 3 325.742 4.130 20 0 EIADHM C[C@@]([N-]C(=O)c1c(F)cccc1F)(c1ccc(F)cc1)C(F)(F)F ZINC000542869124 1056376726 /nfs/dbraw/zinc/37/67/26/1056376726.db2.gz MNPQMEIGXUQLBT-OAHLLOKOSA-N -1 3 347.258 4.311 20 0 EIADHM O=C(Cc1ccc(-n2cccc2)cc1)Nc1cc(Cl)ccc1[O-] ZINC000111210960 1056772120 /nfs/dbraw/zinc/77/21/20/1056772120.db2.gz RFAGYZKGYRYAJA-UHFFFAOYSA-N -1 3 326.783 4.018 20 0 EIADHM Cc1ccc([N-]S(=O)(=O)c2ccccc2C(F)(F)F)c(Cl)c1 ZINC000007403952 1056792472 /nfs/dbraw/zinc/79/24/72/1056792472.db2.gz SSCYDHPGHLMPBR-UHFFFAOYSA-N -1 3 349.761 4.468 20 0 EIADHM Cc1nn(-c2cccc(Cl)c2)c(Cl)c1C=Cc1nccc(=O)[n-]1 ZINC000742219792 1058549847 /nfs/dbraw/zinc/54/98/47/1058549847.db2.gz FIFXDAZNUNUYBQ-AATRIKPKSA-N -1 3 347.205 4.154 20 0 EIADHM COc1cccc(-c2noc([N-][C@H]3CSc4ccccc43)n2)c1 ZINC000742407993 1058606533 /nfs/dbraw/zinc/60/65/33/1058606533.db2.gz HBIWAGPWOSFZKR-AWEZNQCLSA-N -1 3 325.393 4.004 20 0 EIADHM COc1cccc(-c2noc([N-]Cc3oc4ccccc4c3C)n2)c1 ZINC000742407390 1058606869 /nfs/dbraw/zinc/60/68/69/1058606869.db2.gz BNZXPMRHYQLYRM-UHFFFAOYSA-N -1 3 335.363 4.412 20 0 EIADHM Cc1cc(C(=O)COC(=O)c2cc(Cl)c(Cl)[n-]2)cc(C)c1F ZINC000744626348 1059598900 /nfs/dbraw/zinc/59/89/00/1059598900.db2.gz FAIZQVNOQVPGHR-UHFFFAOYSA-N -1 3 344.169 4.117 20 0 EIADHM CCC(C)(C)CC(=O)O[C@@H](C)c1nc(=O)c2c(C)c(C)sc2[n-]1 ZINC000745777034 1059889858 /nfs/dbraw/zinc/88/98/58/1059889858.db2.gz FXFQOAVEWOJZPA-JTQLQIEISA-N -1 3 336.457 4.444 20 0 EIADHM Cc1cnc(COC(=O)c2cc(-c3ccccc3)cc(Cl)c2[O-])o1 ZINC000746079575 1060003822 /nfs/dbraw/zinc/00/38/22/1060003822.db2.gz OYHQQQPCUNTRJC-UHFFFAOYSA-N -1 3 343.766 4.366 20 0 EIADHM Cc1c([N-]S(=O)(=O)/C=C/c2ccc(C)cc2)cnn1C1CCCC1 ZINC000766576842 1060605434 /nfs/dbraw/zinc/60/54/34/1060605434.db2.gz HVCFYYBEEVXCLL-VAWYXSNFSA-N -1 3 345.468 4.028 20 0 EIADHM S=C1Cc2ccc(NCc3ccsc3Br)cc2[N-]1 ZINC001169058619 1060615980 /nfs/dbraw/zinc/61/59/80/1060615980.db2.gz KXFAUBJWDFQJFD-UHFFFAOYSA-N -1 3 339.283 4.418 20 0 EIADHM Cc1noc(C2CC2)c1[N-]C(=O)c1sccc1SC(F)F ZINC000766621656 1060695204 /nfs/dbraw/zinc/69/52/04/1060695204.db2.gz UNNDJJUBVLWLDA-UHFFFAOYSA-N -1 3 330.381 4.489 20 0 EIADHM COc1cccc(-n2nc(C)cc2Nc2ccc(Cl)c([O-])c2)c1 ZINC001212590617 1060841803 /nfs/dbraw/zinc/84/18/03/1060841803.db2.gz VNQVNUCKWVTEHZ-UHFFFAOYSA-N -1 3 329.787 4.292 20 0 EIADHM COCCCOc1ccc(F)cc1Nc1ccc(Cl)c([O-])c1 ZINC001212592419 1060889515 /nfs/dbraw/zinc/88/95/15/1060889515.db2.gz OPTHKBGBGAEOOV-UHFFFAOYSA-N -1 3 325.767 4.344 20 0 EIADHM CCN1CCN(c2ccc(Nc3ccc(Cl)c([O-])c3)cc2F)CC1 ZINC001212592459 1060890494 /nfs/dbraw/zinc/89/04/94/1060890494.db2.gz QXUKUXACMDMKPU-UHFFFAOYSA-N -1 3 349.837 4.070 20 0 EIADHM [O-]c1cc(Nc2ccc(N3CCSCC3)c(F)c2)ccc1Cl ZINC001212593781 1060913369 /nfs/dbraw/zinc/91/33/69/1060913369.db2.gz JUVQOERHKSDNJP-UHFFFAOYSA-N -1 3 338.835 4.482 20 0 EIADHM Nc1cccc2c(Br)cn(-c3ccc(Cl)c([O-])c3)c21 ZINC001212594866 1060973825 /nfs/dbraw/zinc/97/38/25/1060973825.db2.gz ADLWZZLOROPNQN-UHFFFAOYSA-N -1 3 337.604 4.334 20 0 EIADHM O=c1[n-]c(CN2CCC[C@@H]2C2CCCC2)nc2c3ccccc3oc21 ZINC000055927796 214348954 /nfs/dbraw/zinc/34/89/54/214348954.db2.gz GCINRYOYZMWGEI-OAHLLOKOSA-N -1 3 337.423 4.236 20 0 EIADHM COc1cc(CNc2cc(C)cc(C)c2)cc(Br)c1[O-] ZINC000019952559 212089594 /nfs/dbraw/zinc/08/95/94/212089594.db2.gz LQSIMJDHUAJBLR-UHFFFAOYSA-N -1 3 336.229 4.392 20 0 EIADHM O=C([N-]c1c(F)cccc1F)c1csc(-c2ccc(F)cc2)n1 ZINC000078437820 217052497 /nfs/dbraw/zinc/05/24/97/217052497.db2.gz XWYVAGCNJDYWMA-UHFFFAOYSA-N -1 3 334.322 4.480 20 0 EIADHM CCc1cccc2c1N(Cc1nc3c4ccccc4oc3c(=O)[n-]1)CC2 ZINC000532716456 1032133671 /nfs/dbraw/zinc/13/36/71/1032133671.db2.gz RVHGGLHNOWNSFJ-UHFFFAOYSA-N -1 3 345.402 4.207 20 0 EIADHM Cc1c(C(=O)[N-]c2cc(-c3ccccc3)on2)oc2c1C(=O)CCC2 ZINC000173071302 1032339255 /nfs/dbraw/zinc/33/92/55/1032339255.db2.gz VOAQEQXQTUONLV-UHFFFAOYSA-N -1 3 336.347 4.014 20 0 EIADHM COc1cc(C2(C(=O)Nc3ccc(Cl)cc3[O-])CC2)ccc1C ZINC000532837229 1032342628 /nfs/dbraw/zinc/34/26/28/1032342628.db2.gz MFJXGTGHEHAIDO-UHFFFAOYSA-N -1 3 331.799 4.033 20 0 EIADHM Cn1cc(CCC(=O)Nc2ccc(Cl)cc2[O-])c2ccccc21 ZINC000532840832 1032345082 /nfs/dbraw/zinc/34/50/82/1032345082.db2.gz YPLLKFLUEWKYJZ-UHFFFAOYSA-N -1 3 328.799 4.109 20 0 EIADHM Cc1cc(C(=O)Nc2cc(Br)ccc2[O-])c(C)n1C1CC1 ZINC000179653393 1032566750 /nfs/dbraw/zinc/56/67/50/1032566750.db2.gz NFEUPYNLKZGOMF-UHFFFAOYSA-N -1 3 349.228 4.160 20 0 EIADHM CCC[C@H](C(=O)Nc1ccc([O-])c(C(F)(F)F)c1)c1ccccn1 ZINC000500558498 1032649937 /nfs/dbraw/zinc/64/99/37/1032649937.db2.gz DXUYRMUZMCVUHV-LBPRGKRZSA-N -1 3 338.329 4.328 20 0 EIADHM CCc1ccc(NC(=O)Nc2ccc(-c3cc(=O)[n-]c(C)n3)cc2)cc1 ZINC000519945832 1019309940 /nfs/dbraw/zinc/30/99/40/1019309940.db2.gz SJFZUBSAXFXOJT-UHFFFAOYSA-N -1 3 348.406 4.364 20 0 EIADHM CCC[C@H](CC)S(=O)(=O)[N-]c1cnn([C@@H](C)CC)c1C1CC1 ZINC000567999465 1032832078 /nfs/dbraw/zinc/83/20/78/1032832078.db2.gz RIDPEZBCZRTLLJ-JSGCOSHPSA-N -1 3 327.494 4.052 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1cnc(-c2ccccc2)s1 ZINC000109127049 1019589533 /nfs/dbraw/zinc/58/95/33/1019589533.db2.gz KGEUQILBZFAZLQ-UHFFFAOYSA-N -1 3 330.796 4.421 20 0 EIADHM O=c1[n-]c(CNC2(C(F)F)CCCCC2)nc2c3ccccc3oc21 ZINC000510162451 1020141908 /nfs/dbraw/zinc/14/19/08/1020141908.db2.gz ZVJQDWHCOWGJFA-UHFFFAOYSA-N -1 3 347.365 4.139 20 0 EIADHM C[C@@H](CCC1CC1)NC(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC001625836321 1020219705 /nfs/dbraw/zinc/21/97/05/1020219705.db2.gz RMYUJNCTXXFGTB-AWEZNQCLSA-N -1 3 325.408 4.493 20 0 EIADHM Cc1ccccc1C1CCN(C(=O)c2cc([O-])ccc2Cl)CC1 ZINC000340012160 1020230190 /nfs/dbraw/zinc/23/01/90/1020230190.db2.gz SFEOCLBOMCVJPM-UHFFFAOYSA-N -1 3 329.827 4.374 20 0 EIADHM CCN(C(=O)c1cc(=O)c2ccccc2[n-]1)[C@@H](C)Cc1ccsc1 ZINC000275247088 1020279224 /nfs/dbraw/zinc/27/92/24/1020279224.db2.gz UVCFKHDTNIBUHE-ZDUSSCGKSA-N -1 3 340.448 4.095 20 0 EIADHM COc1cc(Nc2cccc(Cl)c2[O-])ccc1-n1cnc(C)c1 ZINC001210223596 1020961971 /nfs/dbraw/zinc/96/19/71/1020961971.db2.gz UGVHGYUBDPWRJC-UHFFFAOYSA-N -1 3 329.787 4.292 20 0 EIADHM CCOc1ccc(F)c([N-]C(=O)c2csc(C(C)C)n2)c1F ZINC000340437243 1021023779 /nfs/dbraw/zinc/02/37/79/1021023779.db2.gz VDWDKCLYFCXRIB-UHFFFAOYSA-N -1 3 326.368 4.196 20 0 EIADHM CC(C)c1ccc(-c2nc(CN3CC[C@@H](C(=O)[O-])[C@H]3C)cs2)cc1 ZINC000579968013 1021039637 /nfs/dbraw/zinc/03/96/37/1021039637.db2.gz DEKNFUUPSUTQGM-CXAGYDPISA-N -1 3 344.480 4.229 20 0 EIADHM Cc1cccc(C)c1[N-]S(=O)(=O)c1ccc(OC2CCCC2)cc1 ZINC000096659236 1032974178 /nfs/dbraw/zinc/97/41/78/1032974178.db2.gz LARSOPVWHQJLHL-UHFFFAOYSA-N -1 3 345.464 4.426 20 0 EIADHM CC(C)(C)C[C@@H]1CCN(C(=O)c2cc(=O)c3ccccc3[n-]2)C1(C)C ZINC000413986286 1021582353 /nfs/dbraw/zinc/58/23/53/1021582353.db2.gz JJWFNCONAIEVLP-AWEZNQCLSA-N -1 3 340.467 4.205 20 0 EIADHM Cc1cc2c(o1)CC(C)(C)C[C@H]2NC(=O)c1cc([O-])ccc1Cl ZINC000431742358 1021727961 /nfs/dbraw/zinc/72/79/61/1021727961.db2.gz UCMTXFRRVMEIBK-OAHLLOKOSA-N -1 3 333.815 4.391 20 0 EIADHM COc1c(F)cc(F)cc1Nc1cccc([O-])c1Br ZINC001210868738 1021818533 /nfs/dbraw/zinc/81/85/33/1021818533.db2.gz KXVKPKXYYATPOB-UHFFFAOYSA-N -1 3 330.128 4.185 20 0 EIADHM C[C@H](c1cccc(Br)c1)N1CCC[C@H](CCC(=O)[O-])C1 ZINC000086809324 1021978920 /nfs/dbraw/zinc/97/89/20/1021978920.db2.gz FQYCKDYKDZLPLI-CHWSQXEVSA-N -1 3 340.261 4.087 20 0 EIADHM Cc1nc(-c2cccc(NC(=O)c3cc([O-])ccc3Cl)c2)[nH]c1C ZINC000377807513 1022017678 /nfs/dbraw/zinc/01/76/78/1022017678.db2.gz RYNVOASEQDIVMD-UHFFFAOYSA-N -1 3 341.798 4.305 20 0 EIADHM CCOc1cccc([C@@H]2C[C@H]2NC(=O)c2cc([O-])c3ccccc3c2)c1 ZINC000515564032 1022043920 /nfs/dbraw/zinc/04/39/20/1022043920.db2.gz FBLWHMWYOLGJOH-VQTJNVASSA-N -1 3 347.414 4.230 20 0 EIADHM Cc1ccc(-c2csc3[n-]c(COC4CCCC4)nc(=O)c23)cc1 ZINC000174446796 1022085381 /nfs/dbraw/zinc/08/53/81/1022085381.db2.gz FGSJGAQIGIQIRO-UHFFFAOYSA-N -1 3 340.448 4.419 20 0 EIADHM Cc1cnc(-c2cccc(NC(=O)c3cc([O-])ccc3Cl)c2)o1 ZINC000377927896 1022116357 /nfs/dbraw/zinc/11/63/57/1022116357.db2.gz WLYSNIAWPQHUFO-UHFFFAOYSA-N -1 3 328.755 4.261 20 0 EIADHM CSc1ccccc1S(=O)(=O)[N-]c1cccc(F)c1Cl ZINC000564250345 1022208784 /nfs/dbraw/zinc/20/87/84/1022208784.db2.gz IMCWOPMKAQLWET-UHFFFAOYSA-N -1 3 331.821 4.002 20 0 EIADHM Cc1cc(OC(F)F)c(C(=O)[N-]c2c(F)cc(F)cc2F)s1 ZINC000175298210 1022319176 /nfs/dbraw/zinc/31/91/76/1022319176.db2.gz OBVOZMALTFLHPN-UHFFFAOYSA-N -1 3 337.269 4.328 20 0 EIADHM O=C(/C=C\c1cc(Br)cs1)Nc1cccc([O-])c1F ZINC000255642235 1022323292 /nfs/dbraw/zinc/32/32/92/1022323292.db2.gz JKHGJAKFGCDDQO-PLNGDYQASA-N -1 3 342.189 4.007 20 0 EIADHM CC(C)(c1ccc(NC(=O)c2cccc3n[n-]nc32)cc1)C(F)(F)F ZINC000580929321 1022710314 /nfs/dbraw/zinc/71/03/14/1022710314.db2.gz SKEBCJXRERRZRE-UHFFFAOYSA-N -1 3 348.328 4.050 20 0 EIADHM Cc1scc(C(=O)Nc2cccc(-c3nc(C)cc(=O)[n-]3)c2)c1C ZINC000378408165 1022804852 /nfs/dbraw/zinc/80/48/52/1022804852.db2.gz YLOSEHDJFVVZLN-UHFFFAOYSA-N -1 3 339.420 4.088 20 0 EIADHM [O-]c1cccc(CN2CCC[C@@H]2c2ccc(O)cc2)c1Br ZINC000656425321 1022879718 /nfs/dbraw/zinc/87/97/18/1022879718.db2.gz PHWIERHLHLNGOX-OAHLLOKOSA-N -1 3 348.240 4.197 20 0 EIADHM O=c1nc(COC[C@@H]2CCCO2)[n-]c2scc(C3CCCCC3)c21 ZINC000656491841 1023044576 /nfs/dbraw/zinc/04/45/76/1023044576.db2.gz RBPXRZYCNCYXIV-ZDUSSCGKSA-N -1 3 348.468 4.140 20 0 EIADHM Cc1cc2occ(CC(=O)[N-]OCc3cccnc3)c2cc1C(C)C ZINC000160864405 1023049356 /nfs/dbraw/zinc/04/93/56/1023049356.db2.gz ZKFXQKINCAAZTB-UHFFFAOYSA-N -1 3 338.407 4.050 20 0 EIADHM CCC[C@H](NCc1cccc([O-])c1Br)c1ccccn1 ZINC000656497321 1023057126 /nfs/dbraw/zinc/05/71/26/1023057126.db2.gz LAKSBLKSBFSLMZ-ZDUSSCGKSA-N -1 3 335.245 4.181 20 0 EIADHM O=c1cc(CNc2cccc(C(F)F)c2Cl)nc(C2CC2)[n-]1 ZINC000417019721 1023112990 /nfs/dbraw/zinc/11/29/90/1023112990.db2.gz DVRVFAAQRCNWOX-UHFFFAOYSA-N -1 3 325.746 4.263 20 0 EIADHM CC(C)[C@H](CC(F)(F)F)[N-]C(=O)C(F)(F)c1ccccc1F ZINC000782944074 1023185379 /nfs/dbraw/zinc/18/53/79/1023185379.db2.gz DWVVOSUHYXUYBF-NSHDSACASA-N -1 3 327.268 4.011 20 0 EIADHM CCc1noc(C)c1NC(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000179992184 1023220742 /nfs/dbraw/zinc/22/07/42/1023220742.db2.gz RKMFIAGSWKWUPT-UHFFFAOYSA-N -1 3 338.363 4.296 20 0 EIADHM CCOc1cccc(-c2noc(C=C([O-])c3ccccc3Cl)n2)c1 ZINC001211647366 1023223795 /nfs/dbraw/zinc/22/37/95/1023223795.db2.gz MBVOFINVRUFLNY-UHFFFAOYSA-N -1 3 342.782 4.214 20 0 EIADHM CCCOCC(=O)Nc1ccc([O-])c(-c2nc3ccccc3s2)c1 ZINC000179933031 1023223886 /nfs/dbraw/zinc/22/38/86/1023223886.db2.gz QFXIHDPBOWHMFF-UHFFFAOYSA-N -1 3 342.420 4.034 20 0 EIADHM [O-]C(=Cc1nc(-c2cc(F)cc(F)c2)no1)c1ccccc1Cl ZINC001211647423 1023225018 /nfs/dbraw/zinc/22/50/18/1023225018.db2.gz OYMIJLQZCRBFIL-UHFFFAOYSA-N -1 3 334.709 4.094 20 0 EIADHM O=C([O-])CC[C@H](NCc1cccc(OC2CC2)c1F)c1ccccc1 ZINC000656566032 1023225945 /nfs/dbraw/zinc/22/59/45/1023225945.db2.gz BCCVAOYJCMOQNH-KRWDZBQOSA-N -1 3 343.398 4.063 20 0 EIADHM CC1(C)[C@H](CCC(=O)[O-])C[C@@H]1NCc1ccc(Oc2ccccc2)o1 ZINC000656568856 1023238753 /nfs/dbraw/zinc/23/87/53/1023238753.db2.gz QUKAEIXQJMXZBU-PBHICJAKSA-N -1 3 343.423 4.441 20 0 EIADHM [O-]c1cc(F)cc(CNCc2cc(F)c(C(F)(F)F)cc2F)c1 ZINC000584741317 1023265442 /nfs/dbraw/zinc/26/54/42/1023265442.db2.gz AFMDEYMKCHXUIE-UHFFFAOYSA-N -1 3 335.247 4.118 20 0 EIADHM O=C(OC[C@@H]1CCC(F)(F)C1)c1cccc2[n-]c(C(F)F)nc21 ZINC000924085420 1023360016 /nfs/dbraw/zinc/36/00/16/1023360016.db2.gz FFTFQTPGTMHCRI-MRVPVSSYSA-N -1 3 330.281 4.093 20 0 EIADHM O=C([O-])CC[C@@H](NCc1cnc(C2CCC2)s1)c1ccccc1 ZINC000417600468 1023373346 /nfs/dbraw/zinc/37/33/46/1023373346.db2.gz JPDORNRNHRXBNG-MRXNPFEDSA-N -1 3 330.453 4.106 20 0 EIADHM CC(C)=CCSC[C@H](NCc1cc2ccccc2s1)C(=O)[O-] ZINC000417630721 1023381305 /nfs/dbraw/zinc/38/13/05/1023381305.db2.gz UZIUXFCEQFQQRP-HNNXBMFYSA-N -1 3 335.494 4.144 20 0 EIADHM O=C([O-])[C@@H]1C[C@@H](NCc2ccccc2C(F)(F)F)c2ccccc21 ZINC000417626006 1023385595 /nfs/dbraw/zinc/38/55/95/1023385595.db2.gz SHHOOBNRUSMUBR-GDBMZVCRSA-N -1 3 335.325 4.108 20 0 EIADHM CCCc1c([N-]S(=O)(=O)CCC(C)(C)C)cnn1-c1ccccc1 ZINC000581580441 1023385886 /nfs/dbraw/zinc/38/58/86/1023385886.db2.gz ZZWRLKXRHPNTIS-UHFFFAOYSA-N -1 3 349.500 4.003 20 0 EIADHM CC(C)(C)c1ccc(CNCc2cc(F)c(C(=O)[O-])c(F)c2)s1 ZINC000417637336 1023391752 /nfs/dbraw/zinc/39/17/52/1023391752.db2.gz CAHFYDYZUWFQQY-UHFFFAOYSA-N -1 3 339.407 4.312 20 0 EIADHM O=C([O-])C[C@@H](CCNCc1c(Cl)cccc1Cl)C(F)(F)F ZINC000417662084 1023395851 /nfs/dbraw/zinc/39/58/51/1023395851.db2.gz UECLQQOLKBQTSX-MRVPVSSYSA-N -1 3 344.160 4.126 20 0 EIADHM CC(C)(C)c1ccc(CNCc2cc(F)c(C(=O)[O-])c(F)c2)cc1 ZINC000417651708 1023397593 /nfs/dbraw/zinc/39/75/93/1023397593.db2.gz XZGSJJQWFUKUBM-UHFFFAOYSA-N -1 3 333.378 4.250 20 0 EIADHM Cn1ccc(C(=O)Nc2ccc(Br)cc2[O-])c1C1CCC1 ZINC000549742048 1033135270 /nfs/dbraw/zinc/13/52/70/1033135270.db2.gz VVGGLYULUBWSLF-UHFFFAOYSA-N -1 3 349.228 4.013 20 0 EIADHM C[C@@H](NCc1c(F)ccc([O-])c1F)c1cccc(OC(F)(F)F)c1 ZINC000511648797 1023476162 /nfs/dbraw/zinc/47/61/62/1023476162.db2.gz NRWGNCGTFCQIDR-SECBINFHSA-N -1 3 347.283 4.420 20 0 EIADHM CC[C@@H]1CC[C@@H](C)N(Cc2coc(-c3ccc(C(=O)[O-])cc3)n2)C1 ZINC000656767588 1023507202 /nfs/dbraw/zinc/50/72/02/1023507202.db2.gz HMEJHARUTUHAKE-ZIAGYGMSSA-N -1 3 328.412 4.050 20 0 EIADHM O=C([O-])[C@@H]1CCN(Cc2c(Cl)cccc2Cl)[C@H]2CCCC[C@@H]12 ZINC000656765798 1023509447 /nfs/dbraw/zinc/50/94/47/1023509447.db2.gz OSMZSLQXCLGMKN-OZVIIMIRSA-N -1 3 342.266 4.459 20 0 EIADHM Cc1ccc2ncc(CN3CC[C@H](C(=O)[O-])[C@@H]4CCCC[C@@H]43)cc2c1 ZINC000656765112 1023510257 /nfs/dbraw/zinc/51/02/57/1023510257.db2.gz IXYCBNNYUIMPQN-BJLQDIEVSA-N -1 3 338.451 4.009 20 0 EIADHM Cc1c(Cl)cc(F)c([N-]C(=O)c2nc3c(s2)CCC3)c1F ZINC000415364733 1023579173 /nfs/dbraw/zinc/57/91/73/1023579173.db2.gz SMHXLZKIIUIYOM-UHFFFAOYSA-N -1 3 328.771 4.124 20 0 EIADHM C[C@H](O[N-]C(=O)Cc1cccc2ccccc21)c1ccc(C#N)cc1 ZINC000194644659 1023776697 /nfs/dbraw/zinc/77/66/97/1023776697.db2.gz JWIKJSRTMGWSLN-HNNXBMFYSA-N -1 3 330.387 4.063 20 0 EIADHM CC[C@H](C)Oc1ccc([N-]S(=O)(=O)c2ccc(C)cc2C)cc1 ZINC000511696564 1023829024 /nfs/dbraw/zinc/82/90/24/1023829024.db2.gz CFYJYOSQLQWGCR-HNNXBMFYSA-N -1 3 333.453 4.282 20 0 EIADHM O=C(N[C@@H]1C[C@H]1c1c(F)cccc1Cl)c1cc([O-])ccc1Cl ZINC000511682679 1023830173 /nfs/dbraw/zinc/83/01/73/1023830173.db2.gz PMVPAKUGQKVRMF-QMTHXVAHSA-N -1 3 340.181 4.124 20 0 EIADHM CC(C)[C@H](NCc1nc(=O)c2sccc2[n-]1)c1ccccc1F ZINC000661486538 1024172001 /nfs/dbraw/zinc/17/20/01/1024172001.db2.gz XRIUYKZOBSPRBD-HNNXBMFYSA-N -1 3 331.416 4.023 20 0 EIADHM CCN(Cc1nc2c3ccccc3oc2c(=O)[n-]1)c1cccc(OC)c1 ZINC000341709983 1024382100 /nfs/dbraw/zinc/38/21/00/1024382100.db2.gz SVBQIYNCDSTPIR-UHFFFAOYSA-N -1 3 349.390 4.117 20 0 EIADHM CCOc1ccc(C2=CCN(C(=O)c3ccc(C)cc3[O-])CC2)cc1 ZINC000091932024 1024466634 /nfs/dbraw/zinc/46/66/34/1024466634.db2.gz NNONSNNIWRYVHI-UHFFFAOYSA-N -1 3 337.419 4.029 20 0 EIADHM O=S(=O)([N-]c1cccc(F)c1F)c1cc(Cl)cc(Cl)c1 ZINC000049375388 1024567709 /nfs/dbraw/zinc/56/77/09/1024567709.db2.gz TUAKJFZVTCRFGF-UHFFFAOYSA-N -1 3 338.162 4.072 20 0 EIADHM Cc1cc([C@H](C)N2CCC(OC3CCC(C)CC3)CC2)oc1C(=O)[O-] ZINC000652410846 1024820595 /nfs/dbraw/zinc/82/05/95/1024820595.db2.gz CXGOAUWXDVCBLI-SIWZUTFBSA-N -1 3 349.471 4.407 20 0 EIADHM O=C([O-])[C@@H]1CN(CC2CCC(C(F)(F)F)CC2)Cc2ccccc21 ZINC000652470538 1024844017 /nfs/dbraw/zinc/84/40/17/1024844017.db2.gz ZVPXXGYOFXKQQE-LDZOIKDWSA-N -1 3 341.373 4.039 20 0 EIADHM C[C@H](CCSc1ccccc1)N1Cc2ccccc2[C@@H](C(=O)[O-])C1 ZINC000652469723 1024844865 /nfs/dbraw/zinc/84/48/65/1024844865.db2.gz CXGSFCRWRDOPBW-BEFAXECRSA-N -1 3 341.476 4.241 20 0 EIADHM CC(C)(C(=O)[O-])[C@H]1CCCN(Cc2nc(-c3ccccc3)cs2)C1 ZINC000652498875 1024860263 /nfs/dbraw/zinc/86/02/63/1024860263.db2.gz XGMJMHHKTJEMNI-HNNXBMFYSA-N -1 3 344.480 4.133 20 0 EIADHM CCCCCc1nnc([N-]C(=O)c2oc(CC(C)C)nc2C)s1 ZINC000188295171 1024936853 /nfs/dbraw/zinc/93/68/53/1024936853.db2.gz ASRXHFUVDAWSEY-UHFFFAOYSA-N -1 3 336.461 4.018 20 0 EIADHM O=C([O-])CC[C@H](CNCc1cccc(Cl)c1Cl)C(F)(F)F ZINC000663262529 1024967740 /nfs/dbraw/zinc/96/77/40/1024967740.db2.gz SWLIXZCBUIFPIC-SECBINFHSA-N -1 3 344.160 4.126 20 0 EIADHM O=C([N-]c1ccsc1Cl)c1cc(-c2ccc3c(c2)CCO3)no1 ZINC000186931724 1025133895 /nfs/dbraw/zinc/13/38/95/1025133895.db2.gz IKULPMPRRLYRCP-UHFFFAOYSA-N -1 3 346.795 4.244 20 0 EIADHM CC(=O)[C@@H](C)CCSc1nnc([N-]c2ccccc2F)s1 ZINC000657227680 1025306927 /nfs/dbraw/zinc/30/69/27/1025306927.db2.gz IRIHCVXGKWCCET-VIFPVBQESA-N -1 3 325.434 4.128 20 0 EIADHM CCCCc1ccc([N-]S(=O)(=O)c2ccc(CCOC)cc2)cc1 ZINC000506792969 1025762940 /nfs/dbraw/zinc/76/29/40/1025762940.db2.gz CKQGRASPPGNYEB-UHFFFAOYSA-N -1 3 347.480 4.019 20 0 EIADHM CC(C)(C(=O)Nc1ccc([O-])c(C(F)(F)F)c1)c1ccccc1F ZINC000426608129 1025766339 /nfs/dbraw/zinc/76/63/39/1025766339.db2.gz PRGZHGCALIUPAR-UHFFFAOYSA-N -1 3 341.304 4.466 20 0 EIADHM CC(C)c1nnc([N-]C(=O)c2cnc(-c3ccccc3)s2)s1 ZINC000344071812 1025966976 /nfs/dbraw/zinc/96/69/76/1025966976.db2.gz WXWGDZJSRSUDSH-UHFFFAOYSA-N -1 3 330.438 4.037 20 0 EIADHM Cc1cc([C@H](C)N2CCC(OCc3ccccc3)CC2)oc1C(=O)[O-] ZINC000582067810 1026070979 /nfs/dbraw/zinc/07/09/79/1026070979.db2.gz KWZQWQZRQZOUKY-HNNXBMFYSA-N -1 3 343.423 4.028 20 0 EIADHM CC[C@@H](C)n1ncc(NC(=O)c2cc([O-])ccc2Cl)c1C1CC1 ZINC000344360994 1026276729 /nfs/dbraw/zinc/27/67/29/1026276729.db2.gz KIPKSCXDVMJFTJ-SNVBAGLBSA-N -1 3 333.819 4.343 20 0 EIADHM CCC(CC)N(Cc1ccc(C(=O)[O-])cc1Br)C1CC1 ZINC000582186544 1026311886 /nfs/dbraw/zinc/31/18/86/1026311886.db2.gz GBCAZHUZGPUOIT-UHFFFAOYSA-N -1 3 340.261 4.300 20 0 EIADHM Cc1ccc(OC2CCN(Cc3ccc(C(=O)[O-])s3)CC2)cc1C ZINC000563278596 1026313964 /nfs/dbraw/zinc/31/39/64/1026313964.db2.gz TYUQESIHFMEDFZ-UHFFFAOYSA-N -1 3 345.464 4.107 20 0 EIADHM Cc1oc(C(C)C)cc1C(=O)Nc1cc(Br)ccc1[O-] ZINC000582256992 1026375399 /nfs/dbraw/zinc/37/53/99/1026375399.db2.gz BBMQQNVKVFRGPC-UHFFFAOYSA-N -1 3 338.201 4.432 20 0 EIADHM C[C@H]1C[C@H](CC[N-]S(=O)(=O)c2ccc(F)cc2F)CC(C)(C)C1 ZINC001211704583 1026395935 /nfs/dbraw/zinc/39/59/35/1026395935.db2.gz BHLYARSUFZUXME-STQMWFEESA-N -1 3 345.455 4.096 20 0 EIADHM O=C(Nc1cc(Br)ccc1[O-])c1ccc(F)c(Cl)c1 ZINC000532013123 1026405039 /nfs/dbraw/zinc/40/50/39/1026405039.db2.gz PFQDMAYYLCGTDS-UHFFFAOYSA-N -1 3 344.567 4.200 20 0 EIADHM C[C@@H](CCC[C@H](C)C(=O)[O-])NCc1ncc(-c2ccccc2)s1 ZINC000426685062 1026474702 /nfs/dbraw/zinc/47/47/02/1026474702.db2.gz FSVGFJKYAQCEPG-KBPBESRZSA-N -1 3 332.469 4.179 20 0 EIADHM O=C([O-])Cc1ccccc1CNCc1ccc(-c2ccccc2)cc1 ZINC000426692469 1026494483 /nfs/dbraw/zinc/49/44/83/1026494483.db2.gz SAFNHSQTFHIVNY-UHFFFAOYSA-N -1 3 331.415 4.271 20 0 EIADHM O=C([O-])Cc1ccccc1CNCc1cccc(Oc2ccccc2)c1 ZINC000426711827 1026509055 /nfs/dbraw/zinc/50/90/55/1026509055.db2.gz RVVNUQAXMVFCOG-UHFFFAOYSA-N -1 3 347.414 4.396 20 0 EIADHM O=C([O-])[C@@H](NCc1ccc(F)c(Cl)c1)c1cccc(Cl)c1 ZINC000426751277 1026538990 /nfs/dbraw/zinc/53/89/90/1026538990.db2.gz USLAANZJBPSTEW-AWEZNQCLSA-N -1 3 328.170 4.048 20 0 EIADHM O=C([O-])C[C@@H](NCc1cc2ccc(F)cc2[nH]1)c1ccc(Cl)cc1 ZINC000426771240 1026550837 /nfs/dbraw/zinc/55/08/37/1026550837.db2.gz ZZMFHLKQJDNNAJ-MRXNPFEDSA-N -1 3 346.789 4.266 20 0 EIADHM CC(C)COc1cccc(CN[C@H](CC(=O)[O-])c2ccc(F)cc2)c1 ZINC000426783930 1026558813 /nfs/dbraw/zinc/55/88/13/1026558813.db2.gz LHXDZGAHGWDNHZ-LJQANCHMSA-N -1 3 345.414 4.166 20 0 EIADHM CCCOc1cccc(CN[C@@H](CC(=O)[O-])c2cccc(Cl)c2)c1 ZINC000426806257 1026560920 /nfs/dbraw/zinc/56/09/20/1026560920.db2.gz JAEODLBTNFIWRE-SFHVURJKSA-N -1 3 347.842 4.434 20 0 EIADHM CC(C)CCOc1ccc(CN[C@@H](C(=O)[O-])c2cccc(F)c2)cc1 ZINC000426791982 1026565509 /nfs/dbraw/zinc/56/55/09/1026565509.db2.gz KOMVMRRBTMSTTF-LJQANCHMSA-N -1 3 345.414 4.166 20 0 EIADHM CC(C)c1ccc([C@H](CC(=O)[O-])NCc2ccc(F)c(F)c2)cc1 ZINC000426813994 1026576121 /nfs/dbraw/zinc/57/61/21/1026576121.db2.gz BKFXCEGCSWFMKL-SFHVURJKSA-N -1 3 333.378 4.394 20 0 EIADHM [O-]c1cccc(CN2CCC[C@@H]2c2ccc3c(c2)OCCO3)c1Cl ZINC000506995646 1026581256 /nfs/dbraw/zinc/58/12/56/1026581256.db2.gz VNESZZLRBVZYAW-OAHLLOKOSA-N -1 3 345.826 4.154 20 0 EIADHM COc1ccccc1CN[C@H](CC(=O)[O-])c1ccc(C(C)C)cc1 ZINC000426824111 1026581933 /nfs/dbraw/zinc/58/19/33/1026581933.db2.gz LHACCHLZHDTINF-GOSISDBHSA-N -1 3 327.424 4.124 20 0 EIADHM COc1ccc(CN[C@@H](CC(=O)[O-])c2ccc(C(C)C)cc2)cc1F ZINC000426824779 1026583128 /nfs/dbraw/zinc/58/31/28/1026583128.db2.gz NYTHZYKUXCFZJP-SFHVURJKSA-N -1 3 345.414 4.263 20 0 EIADHM CSc1ccc(CN[C@H](C(=O)[O-])c2ccc(Cl)c(C)c2)cc1 ZINC000426828378 1026586085 /nfs/dbraw/zinc/58/60/85/1026586085.db2.gz LFVPYDCPNLHTEQ-INIZCTEOSA-N -1 3 335.856 4.286 20 0 EIADHM COc1ccc(OC)c([C@@H]2CCCN2Cc2cccc([O-])c2Cl)c1 ZINC000507022449 1026601382 /nfs/dbraw/zinc/60/13/82/1026601382.db2.gz OWDACKBLBOKZNH-INIZCTEOSA-N -1 3 347.842 4.400 20 0 EIADHM C[C@@H](c1nc2ccccc2s1)N(C)Cc1c(F)ccc([O-])c1F ZINC000507022293 1026601477 /nfs/dbraw/zinc/60/14/77/1026601477.db2.gz NNIVZUSXDYRJFN-JTQLQIEISA-N -1 3 334.391 4.473 20 0 EIADHM CCOCCN(CC[C@H]1CCC[C@@H](C)C1)Cc1ccc(C(=O)[O-])o1 ZINC000519605042 1026791639 /nfs/dbraw/zinc/79/16/39/1026791639.db2.gz KZTSSUMIIJXHLJ-HZPDHXFCSA-N -1 3 337.460 4.033 20 0 EIADHM CCOc1ccc([N-]S(=O)(=O)c2cccc(C(F)F)c2)c(C)c1 ZINC000780376460 1026834355 /nfs/dbraw/zinc/83/43/55/1026834355.db2.gz AKWNGKSEQDMDQU-UHFFFAOYSA-N -1 3 341.379 4.132 20 0 EIADHM CC(C)CN(C(=O)c1cc(=O)[n-]c(C2CC2)n1)c1cccc(Cl)c1 ZINC000582735624 1027097432 /nfs/dbraw/zinc/09/74/32/1027097432.db2.gz JLCFHLSYPVBGAF-UHFFFAOYSA-N -1 3 345.830 4.016 20 0 EIADHM Cc1nc2c(s1)[C@@H]([N-]c1nc(-c3ccc(C)cc3)no1)CCC2 ZINC000302014663 1027184416 /nfs/dbraw/zinc/18/44/16/1027184416.db2.gz FCRXSAPCDPAKMT-AWEZNQCLSA-N -1 3 326.425 4.299 20 0 EIADHM CCSc1cc(C(=O)Nc2ccc([O-])c(C(F)(F)F)c2)ccn1 ZINC000440987921 1027184848 /nfs/dbraw/zinc/18/48/48/1027184848.db2.gz QBEDPAMYWCKADW-UHFFFAOYSA-N -1 3 342.342 4.170 20 0 EIADHM Cc1cccc(C)c1OCC(=O)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000441012141 1027189078 /nfs/dbraw/zinc/18/90/78/1027189078.db2.gz RUJCHSWROXIRFG-UHFFFAOYSA-N -1 3 339.313 4.045 20 0 EIADHM CC(C)(C)c1nc([N-][C@@H](c2cccc(F)c2)c2ccccn2)no1 ZINC000302145562 1027231736 /nfs/dbraw/zinc/23/17/36/1027231736.db2.gz HOIDVPMKLMTQOZ-HNNXBMFYSA-N -1 3 326.375 4.103 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(NCC(C)(C)C(C)(C)C)nc2)n1 ZINC000431486640 1027251123 /nfs/dbraw/zinc/25/11/23/1027251123.db2.gz LKKLEWCLBWVHHZ-UHFFFAOYSA-N -1 3 328.460 4.291 20 0 EIADHM [O-]c1c(F)cc(Nc2cc(Cl)ncc2Br)cc1F ZINC001213373536 1027331364 /nfs/dbraw/zinc/33/13/64/1027331364.db2.gz KIFYOYPJXDTMSM-UHFFFAOYSA-N -1 3 335.535 4.225 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@@H]3CCCC(C)(C)C3)nc2)n1 ZINC000302672779 1027357654 /nfs/dbraw/zinc/35/76/54/1027357654.db2.gz OQOHUZONECBEGC-OAHLLOKOSA-N -1 3 326.444 4.187 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@@H]3CCC[C@H](C)CC3)nc2)n1 ZINC000302702759 1027365608 /nfs/dbraw/zinc/36/56/08/1027365608.db2.gz XRLHMQLSGALGQY-XJKSGUPXSA-N -1 3 326.444 4.187 20 0 EIADHM CC(=O)c1cccc(NC(=O)c2ccc(F)c(C(F)(F)F)c2)c1[O-] ZINC000520277850 1027380548 /nfs/dbraw/zinc/38/05/48/1027380548.db2.gz XUWXZHFHNSMOMV-UHFFFAOYSA-N -1 3 341.260 4.005 20 0 EIADHM Cc1cc(C)c(S(=O)(=O)[N-]c2ccc3ncsc3c2)c(C)c1 ZINC000614802771 1027782059 /nfs/dbraw/zinc/78/20/59/1027782059.db2.gz ATJHCIUGKYRTOF-UHFFFAOYSA-N -1 3 332.450 4.022 20 0 EIADHM O=C(NCC1(c2ccccc2)CCCC1)c1cc([O-])ccc1Cl ZINC000431511459 1027792505 /nfs/dbraw/zinc/79/25/05/1027792505.db2.gz LDXBKZIVIQJDDC-UHFFFAOYSA-N -1 3 329.827 4.287 20 0 EIADHM CCOc1c(Cl)cccc1NC(=O)c1cc([O-])ccc1Cl ZINC001626773061 1027806481 /nfs/dbraw/zinc/80/64/81/1027806481.db2.gz FQUYGXCZYGTKHR-UHFFFAOYSA-N -1 3 326.179 4.350 20 0 EIADHM COc1cccc([C@@H]2CCCN2C(=O)c2cc([O-])ccc2Cl)c1 ZINC000431514139 1027839305 /nfs/dbraw/zinc/83/93/05/1027839305.db2.gz PAZGOZQMPJQUML-KRWDZBQOSA-N -1 3 331.799 4.032 20 0 EIADHM CCc1ccc(C(=O)Nc2c(C)nn(-c3ccccc3)c2C)c([O-])c1 ZINC000188826384 1028036369 /nfs/dbraw/zinc/03/63/69/1028036369.db2.gz GJZUNWHOJFBVDO-UHFFFAOYSA-N -1 3 335.407 4.009 20 0 EIADHM Cc1cc(F)ccc1[C@@H]1CCCN1C(=O)NCc1ccc([O-])c(F)c1 ZINC000458428121 1028248562 /nfs/dbraw/zinc/24/85/62/1028248562.db2.gz VBNSSYYMWQNSCS-KRWDZBQOSA-N -1 3 346.377 4.026 20 0 EIADHM COc1cc(C)c(S(=O)(=O)[N-]c2cccc(C(F)F)c2)c(C)c1 ZINC000523728508 1028350349 /nfs/dbraw/zinc/35/03/49/1028350349.db2.gz WXFAVAYOGXZSTJ-UHFFFAOYSA-N -1 3 341.379 4.050 20 0 EIADHM C[C@H](CC(=O)[N-]OCCC(F)(F)F)c1ccccc1C(F)(F)F ZINC000162847781 1028469007 /nfs/dbraw/zinc/46/90/07/1028469007.db2.gz KZYFXHQILOPERQ-SECBINFHSA-N -1 3 343.267 4.199 20 0 EIADHM CC(C)(C)c1ccc(OCCNC(=O)c2cc([O-])ccc2Cl)cc1 ZINC000583351388 1028562622 /nfs/dbraw/zinc/56/26/22/1028562622.db2.gz XLIARTUWSZBHPY-UHFFFAOYSA-N -1 3 347.842 4.152 20 0 EIADHM O=C(Cc1ccc([O-])c(F)c1)Nc1ccccc1OC1CCCC1 ZINC000448738324 1028840874 /nfs/dbraw/zinc/84/08/74/1028840874.db2.gz QPLFFBBAOPMFNX-UHFFFAOYSA-N -1 3 329.371 4.034 20 0 EIADHM C[C@@H](NC(=O)c1cc([O-])ccc1Cl)c1cccc(N2CCCC2)c1 ZINC000278378990 1029047432 /nfs/dbraw/zinc/04/74/32/1029047432.db2.gz MWOGQQLPCVUMNM-CYBMUJFWSA-N -1 3 344.842 4.137 20 0 EIADHM O=C([N-]c1cccc(Cl)c1SCC(F)F)c1cncs1 ZINC000522957033 1029124378 /nfs/dbraw/zinc/12/43/78/1029124378.db2.gz SYICBKDMNGGIMO-UHFFFAOYSA-N -1 3 334.800 4.406 20 0 EIADHM CC(C)[C@@H](NC(=O)c1cc([O-])ccc1Cl)c1nc2ccccc2[nH]1 ZINC000583901212 1029344930 /nfs/dbraw/zinc/34/49/30/1029344930.db2.gz RKPZWZXCUVZUIO-MRXNPFEDSA-N -1 3 343.814 4.049 20 0 EIADHM Fc1cccc([C@@H]([N-]c2noc(-c3ccccc3)n2)c2ccccn2)c1 ZINC000158291264 1029428250 /nfs/dbraw/zinc/42/82/50/1029428250.db2.gz BUZUBZUOMBWQQY-GOSISDBHSA-N -1 3 346.365 4.472 20 0 EIADHM [O-]c1cccnc1CNCc1cc(Cl)ccc1OC1CCCC1 ZINC000475328372 1029539046 /nfs/dbraw/zinc/53/90/46/1029539046.db2.gz ILEMKRBMOMXIBF-UHFFFAOYSA-N -1 3 332.831 4.052 20 0 EIADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)[C@@H]3CCCC3(C)C)c2)n1 ZINC000475374781 1029588010 /nfs/dbraw/zinc/58/80/10/1029588010.db2.gz RKEJWOQUCPLKIQ-INIZCTEOSA-N -1 3 339.439 4.176 20 0 EIADHM CCc1ccc(S(=O)(=O)[N-]c2ccc(OC(C)C)c(C)c2)cc1 ZINC000525535554 1029666907 /nfs/dbraw/zinc/66/69/07/1029666907.db2.gz DABQKOVUYKSISL-UHFFFAOYSA-N -1 3 333.453 4.145 20 0 EIADHM C[C@@H]1CN(Cc2csc(-c3cccc(C(=O)[O-])c3)n2)C(C)(C)C1 ZINC000584297187 1029721219 /nfs/dbraw/zinc/72/12/19/1029721219.db2.gz ZJZYFHAEAAMTOS-LBPRGKRZSA-N -1 3 330.453 4.129 20 0 EIADHM CC[C@H](C)c1cc(C(=O)[N-]c2nc(-c3ccccc3F)co2)on1 ZINC000360956577 1029919260 /nfs/dbraw/zinc/91/92/60/1029919260.db2.gz MODBQSMBUUCNMZ-JTQLQIEISA-N -1 3 329.331 4.235 20 0 EIADHM c1cc2c(ncnc2[N-]c2nc3c(s2)COc2ccccc2-3)s1 ZINC000502681564 1030059139 /nfs/dbraw/zinc/05/91/39/1030059139.db2.gz FOFMTZQUOOMOKA-UHFFFAOYSA-N -1 3 338.417 4.451 20 0 EIADHM Cc1ccc(NC(=O)c2ccccc2C(=O)c2ccccc2)c([O-])c1 ZINC000141343099 1030062136 /nfs/dbraw/zinc/06/21/36/1030062136.db2.gz AUXUFDRCVKIMFH-UHFFFAOYSA-N -1 3 331.371 4.184 20 0 EIADHM CCS[C@@H]1CCCC[C@@H]1NC(=O)c1cc([O-])c2ccccc2c1 ZINC000525935497 1030126888 /nfs/dbraw/zinc/12/68/88/1030126888.db2.gz JQCSLHBGIDUXAI-FUHWJXTLSA-N -1 3 329.465 4.340 20 0 EIADHM C[C@H]1CC(C(=O)[O-])C[C@H](C)N1Cc1cc(-c2ccccc2Cl)on1 ZINC000530173082 1030191925 /nfs/dbraw/zinc/19/19/25/1030191925.db2.gz CDJNMVBGMWHBGR-RYUDHWBXSA-N -1 3 348.830 4.069 20 0 EIADHM [O-]c1cc(F)cc(CN[C@@H](c2cccc(Cl)c2)c2ccccn2)c1 ZINC000185576479 1030202564 /nfs/dbraw/zinc/20/25/64/1030202564.db2.gz GVKOBFGVXKBFBN-IBGZPJMESA-N -1 3 342.801 4.459 20 0 EIADHM CCOc1ccc([C@H](C)Oc2ncc(Br)cc2[O-])cc1 ZINC001228955920 1030736430 /nfs/dbraw/zinc/73/64/30/1030736430.db2.gz MNRZPERERJMVNR-JTQLQIEISA-N -1 3 338.201 4.088 20 0 EIADHM CCOc1ccc(S(=O)(=O)[N-]c2ccccc2C(C)C)cc1C ZINC000032586057 1030808730 /nfs/dbraw/zinc/80/87/30/1030808730.db2.gz CQRGXUNZJATCGU-UHFFFAOYSA-N -1 3 333.453 4.318 20 0 EIADHM CC(C)Sc1cccc(Cl)c1CN1CCC(C(=O)[O-])CC1 ZINC000263422341 1030859210 /nfs/dbraw/zinc/85/92/10/1030859210.db2.gz PFWUQUZMEWDBDO-UHFFFAOYSA-N -1 3 327.877 4.137 20 0 EIADHM O=C([O-])c1ccc(CN2CCC(=Cc3cccc(F)c3)CC2)cc1 ZINC000263438758 1030867334 /nfs/dbraw/zinc/86/73/34/1030867334.db2.gz VMMGZZSDUIHXBJ-UHFFFAOYSA-N -1 3 325.383 4.203 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)Nc1ccc2c(c1)CCCC2=O ZINC000452314609 1030965874 /nfs/dbraw/zinc/96/58/74/1030965874.db2.gz SIGOPMUTUPICBP-UHFFFAOYSA-N -1 3 341.382 4.012 20 0 EIADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)[C@H]3CCC[C@@H]3CC)c2)n1 ZINC000448723471 1030985741 /nfs/dbraw/zinc/98/57/41/1030985741.db2.gz HVRWBXDTIPYUBY-GUYCJALGSA-N -1 3 339.439 4.176 20 0 EIADHM C[C@@H](c1ccc(Cl)cc1)N(C(=O)Cc1ccc([O-])c(F)c1)C1CC1 ZINC000448745598 1031033747 /nfs/dbraw/zinc/03/37/47/1031033747.db2.gz FPHSXANEZUAPRO-LBPRGKRZSA-N -1 3 347.817 4.479 20 0 EIADHM CC(C)Cn1ccnc1CN[C@@H](C)c1cc(Cl)c(Cl)cc1[O-] ZINC000192898367 1031135621 /nfs/dbraw/zinc/13/56/21/1031135621.db2.gz ZIICFOCBZJRRCZ-NSHDSACASA-N -1 3 342.270 4.402 20 0 EIADHM Cc1cc(C(=O)Nc2cc(F)ccc2[O-])cc(C)c1OC(F)F ZINC000531372658 1031161276 /nfs/dbraw/zinc/16/12/76/1031161276.db2.gz TZTMXTBBBZQGAS-UHFFFAOYSA-N -1 3 325.286 4.002 20 0 EIADHM COc1ccc(-c2nc3cc(C)c(C)cc3[nH]2)c(Br)c1[O-] ZINC000169959384 1031318087 /nfs/dbraw/zinc/31/80/87/1031318087.db2.gz ZAEPWJWYVHSEFQ-UHFFFAOYSA-N -1 3 347.212 4.323 20 0 EIADHM Cc1nc(C(F)(F)F)sc1C(=O)Nc1ccc(Cl)cc1[O-] ZINC000360380465 1031425943 /nfs/dbraw/zinc/42/59/43/1031425943.db2.gz PWXHPNIVIHXVMW-UHFFFAOYSA-N -1 3 336.722 4.082 20 0 EIADHM CCCc1cc(=O)[n-]c(C(=Cc2c[nH]c(C(F)(F)F)c2)CC)n1 ZINC000453028935 1031520613 /nfs/dbraw/zinc/52/06/13/1031520613.db2.gz RPZFCUHKKUOSMQ-WDZFZDKYSA-N -1 3 325.334 4.020 20 0 EIADHM COc1cccc(-c2nc(-c3cc(Cl)cc(Cl)c3)no2)c1[O-] ZINC000389761460 1031947272 /nfs/dbraw/zinc/94/72/72/1031947272.db2.gz PMTAUORULSKNQO-UHFFFAOYSA-N -1 3 337.162 4.425 20 0 EIADHM O=C(Nc1cc(F)ccc1[O-])c1ccc(Cl)cc1Br ZINC000532128107 1032055568 /nfs/dbraw/zinc/05/55/68/1032055568.db2.gz XPMHCBMESVDYQH-UHFFFAOYSA-N -1 3 344.567 4.200 20 0 EIADHM Cc1cccc2nc(-c3cc(Cl)c4c(c3)OCCCO4)[n-]c(=O)c12 ZINC000614113013 1033381703 /nfs/dbraw/zinc/38/17/03/1033381703.db2.gz OSJOJLXCPLSXJA-UHFFFAOYSA-N -1 3 342.782 4.126 20 0 EIADHM [O-]c1ccc(F)c(CNCc2cccc(-c3cccnc3)c2)c1F ZINC000512580390 1033426784 /nfs/dbraw/zinc/42/67/84/1033426784.db2.gz AXNDEARLUBJUEU-UHFFFAOYSA-N -1 3 326.346 4.022 20 0 EIADHM CC[C@H]1C[C@@]1(NC(=O)c1cc([O-])ccc1Cl)c1cccc(C)c1 ZINC000512925563 1034202345 /nfs/dbraw/zinc/20/23/45/1034202345.db2.gz JPZPCDLIZCHTOA-DJJJIMSYSA-N -1 3 329.827 4.409 20 0 EIADHM O=C(Nc1ccccc1Nc1ccccc1)c1cc(F)cc2n[n-]nc21 ZINC000433381670 1034303866 /nfs/dbraw/zinc/30/38/66/1034303866.db2.gz LCSCYTOFQWTYBK-UHFFFAOYSA-N -1 3 347.353 4.093 20 0 EIADHM C[C@@H](S[C@@H]1CCOC1)c1nc(=O)c2c(-c3ccco3)csc2[n-]1 ZINC000419352074 1034401935 /nfs/dbraw/zinc/40/19/35/1034401935.db2.gz AGNIUDXLUVAUHP-NXEZZACHSA-N -1 3 348.449 4.240 20 0 EIADHM Cc1cccc(CNCc2c(F)ccc([O-])c2F)c1Br ZINC000513111670 1034586089 /nfs/dbraw/zinc/58/60/89/1034586089.db2.gz JROZQFAAFJTLDL-UHFFFAOYSA-N -1 3 342.183 4.031 20 0 EIADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)[C@H]3CCC(C)(C)C3)c2)n1 ZINC000513714766 1035454332 /nfs/dbraw/zinc/45/43/32/1035454332.db2.gz HNLXIQLIOQTTRT-AWEZNQCLSA-N -1 3 339.439 4.176 20 0 EIADHM CCc1sc(C(=O)Nc2cc(F)ccc2[O-])cc1Br ZINC000490655214 1035577576 /nfs/dbraw/zinc/57/75/76/1035577576.db2.gz YCHBCODMYMLKNO-UHFFFAOYSA-N -1 3 344.205 4.170 20 0 EIADHM O=C(Nc1n[n-]c(-c2cc3ccccc3o2)n1)c1csc(Cl)c1 ZINC000485104785 1035692821 /nfs/dbraw/zinc/69/28/21/1035692821.db2.gz IEJJQURISQPMMW-UHFFFAOYSA-N -1 3 344.783 4.185 20 0 EIADHM CC(C)CCN(C)C(=O)c1cc(CCc2ccccc2)ccc1[O-] ZINC000586750464 1035837112 /nfs/dbraw/zinc/83/71/12/1035837112.db2.gz JCSLUGBOZJPAFK-UHFFFAOYSA-N -1 3 325.452 4.296 20 0 EIADHM Cc1cccc(C(=O)Nc2cccc(Cn3ccnc3C(C)C)c2)c1[O-] ZINC000195682998 1035881037 /nfs/dbraw/zinc/88/10/37/1035881037.db2.gz SCYFUYUZIWHJQK-UHFFFAOYSA-N -1 3 349.434 4.321 20 0 EIADHM CCN(Cc1csc(-c2ccc(C)o2)n1)C1CCC(C(=O)[O-])CC1 ZINC000571702521 1036130660 /nfs/dbraw/zinc/13/06/60/1036130660.db2.gz LVBHGARBFXXEOV-UHFFFAOYSA-N -1 3 348.468 4.177 20 0 EIADHM CCSCc1cc(C(=O)[N-]c2csc(-c3ccccc3)n2)no1 ZINC000588079616 1036204009 /nfs/dbraw/zinc/20/40/09/1036204009.db2.gz LQAAVKAKGRYACB-UHFFFAOYSA-N -1 3 345.449 4.304 20 0 EIADHM C[C@H](/N=C/c1cc(Br)ccc1[O-])c1ccc(C#N)cc1 ZINC000032069099 1036454336 /nfs/dbraw/zinc/45/43/36/1036454336.db2.gz IJUKARZWEKKHJC-VSMYLPJWSA-N -1 3 329.197 4.206 20 0 EIADHM COc1ccc(C/N=C/c2cc(Cl)ccc2[O-])cc1OC(F)F ZINC000032069315 1036456737 /nfs/dbraw/zinc/45/67/37/1036456737.db2.gz NPFVFYPCUFOYRX-AWQFTUOYSA-N -1 3 341.741 4.275 20 0 EIADHM O=c1cc(C=Cc2ccc(-c3ccncc3)cc2F)nc(C2CC2)[n-]1 ZINC000486072270 1036472769 /nfs/dbraw/zinc/47/27/69/1036472769.db2.gz COQROLUMYQYYLE-WAYWQWQTSA-N -1 3 333.366 4.431 20 0 EIADHM O=c1nc(CSCc2ccno2)[n-]c2scc(-c3ccco3)c21 ZINC000603441622 1036833846 /nfs/dbraw/zinc/83/38/46/1036833846.db2.gz RIMMGIVJPCPVJQ-UHFFFAOYSA-N -1 3 345.405 4.078 20 0 EIADHM CC1(C[S@](=O)Cc2cc(=O)[n-]c(-c3ccccc3)n2)CCCCC1 ZINC000591251104 1037321779 /nfs/dbraw/zinc/32/17/79/1037321779.db2.gz DZEWWAXOYBJWMB-XMMPIXPASA-N -1 3 344.480 4.068 20 0 EIADHM CC1(C[S@@](=O)Cc2cc(=O)[n-]c(-c3ccccc3)n2)CCCCC1 ZINC000591251103 1037322155 /nfs/dbraw/zinc/32/21/55/1037322155.db2.gz DZEWWAXOYBJWMB-DEOSSOPVSA-N -1 3 344.480 4.068 20 0 EIADHM CC[C@H](C)c1ccc(S(=O)(=O)[N-]c2cc(F)c(F)cc2F)cc1 ZINC000591683369 1037548583 /nfs/dbraw/zinc/54/85/83/1037548583.db2.gz CTIFIGQFJUEYSK-JTQLQIEISA-N -1 3 343.370 4.418 20 0 EIADHM CC(C)c1ccc(C(=O)NCc2ccc([O-])c(Br)c2)cc1 ZINC000488679831 1037713763 /nfs/dbraw/zinc/71/37/63/1037713763.db2.gz YNHYTEMDNNGPRI-UHFFFAOYSA-N -1 3 348.240 4.208 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1ccc2[nH]c(C(F)F)nc2c1 ZINC000592373723 1037777793 /nfs/dbraw/zinc/77/77/93/1037777793.db2.gz YLGWAWVPNVABMX-UHFFFAOYSA-N -1 3 337.713 4.112 20 0 EIADHM CC(C)(C)OC1CC(CC(=O)Nc2ccc([O-])c(C(F)(F)F)c2)C1 ZINC000489055730 1037844540 /nfs/dbraw/zinc/84/45/40/1037844540.db2.gz SDZWTQWWDYCMNQ-UHFFFAOYSA-N -1 3 345.361 4.333 20 0 EIADHM Cc1nc2sc3c(c2c(NCc2ccc([O-])c(F)c2)n1)CCCC3 ZINC000606156658 1037909136 /nfs/dbraw/zinc/90/91/36/1037909136.db2.gz GHGLSYFWJLJLRZ-UHFFFAOYSA-N -1 3 343.427 4.335 20 0 EIADHM Cc1nc(S(=O)(=O)[C@@H](C)c2cccc(C)c2)[n-]c1-c1ccccc1 ZINC000490451413 1038647445 /nfs/dbraw/zinc/64/74/45/1038647445.db2.gz UMBYTZFFSUKBQL-HNNXBMFYSA-N -1 3 340.448 4.228 20 0 EIADHM Cc1[n-]c(S(=O)(=O)[C@@H](C)c2cccc(C)c2)nc1-c1ccccc1 ZINC000490451413 1038647456 /nfs/dbraw/zinc/64/74/56/1038647456.db2.gz UMBYTZFFSUKBQL-HNNXBMFYSA-N -1 3 340.448 4.228 20 0 EIADHM O=C([O-])CC[C@H]1CCCCN1Cc1csc(-c2ccc(F)cc2)n1 ZINC000424268384 1038764250 /nfs/dbraw/zinc/76/42/50/1038764250.db2.gz ZYCCCKINPWCIBG-MRXNPFEDSA-N -1 3 348.443 4.169 20 0 EIADHM C[C@H](C(=O)N=c1cc(-c2cccc(Cl)c2)[n-][nH]1)c1cccc(F)c1 ZINC000608359538 1038800869 /nfs/dbraw/zinc/80/08/69/1038800869.db2.gz KXNZJNZXWKFQEE-NSHDSACASA-N -1 3 343.789 4.033 20 0 EIADHM Cc1cc(F)c(CNCCC[C@H](Cc2ccccc2)C(=O)[O-])c(F)c1 ZINC000424620872 1038962829 /nfs/dbraw/zinc/96/28/29/1038962829.db2.gz PAQZHSXVNSVNOO-MRXNPFEDSA-N -1 3 347.405 4.087 20 0 EIADHM CCc1cccc(C(=O)N(Cc2ccco2)Cc2cccs2)c1[O-] ZINC000552110247 1039138613 /nfs/dbraw/zinc/13/86/13/1039138613.db2.gz CPWCJRHQANQDCN-UHFFFAOYSA-N -1 3 341.432 4.452 20 0 EIADHM CC(C)CCC[C@@H](C)NC(=O)c1cc([O-])cc(Br)c1 ZINC000700858925 1039259515 /nfs/dbraw/zinc/25/95/15/1039259515.db2.gz XIFDCKHAWFQONO-LLVKDONJSA-N -1 3 328.250 4.099 20 0 EIADHM CC(=O)c1cccc(NC(=O)COc2ccc(C(C)C)c(C)c2)c1[O-] ZINC000552287126 1039339933 /nfs/dbraw/zinc/33/99/33/1039339933.db2.gz JEPUJZVJSWCIEG-UHFFFAOYSA-N -1 3 341.407 4.044 20 0 EIADHM CC(C)(c1ccc(F)cc1)C1(NC(=O)c2cc([O-])ccc2Cl)CC1 ZINC000456777867 1039596188 /nfs/dbraw/zinc/59/61/88/1039596188.db2.gz PLBMNYJUBSLQKJ-UHFFFAOYSA-N -1 3 347.817 4.425 20 0 EIADHM CC(C)Sc1ccccc1[N-]C(=O)c1cc(-c2cccnc2)on1 ZINC000122306843 1039662556 /nfs/dbraw/zinc/66/25/56/1039662556.db2.gz LTUZRGXXGKRYQT-UHFFFAOYSA-N -1 3 339.420 4.489 20 0 EIADHM C[C@@H](OC(=O)c1ccc([O-])cc1)c1nc2ccccc2n1C(F)F ZINC000054608679 1039733858 /nfs/dbraw/zinc/73/38/58/1039733858.db2.gz HZGQVGGUGZGSFC-SNVBAGLBSA-N -1 3 332.306 4.055 20 0 EIADHM Cc1cc(C)c(Br)c(C(=O)Nc2cccc([O-])c2F)c1 ZINC000545187863 1039858572 /nfs/dbraw/zinc/85/85/72/1039858572.db2.gz ABYHCYYJODANNI-UHFFFAOYSA-N -1 3 338.176 4.163 20 0 EIADHM CCc1cccc(C(=O)Nc2cnn([C@H](C)CC)c2C2CC2)c1[O-] ZINC000537663624 1039875359 /nfs/dbraw/zinc/87/53/59/1039875359.db2.gz NRKOJOCWPRGFOL-GFCCVEGCSA-N -1 3 327.428 4.252 20 0 EIADHM [O-]c1cccc(CNc2ccc3c(c2)CCCN3)c1Br ZINC000414855934 1039879685 /nfs/dbraw/zinc/87/96/85/1039879685.db2.gz XPQMOKUCWABGLY-UHFFFAOYSA-N -1 3 333.229 4.125 20 0 EIADHM CCOc1c(Cl)cccc1CC(=O)Nc1ccc(Cl)cc1[O-] ZINC000478851967 1039979612 /nfs/dbraw/zinc/97/96/12/1039979612.db2.gz JQHQHPKCJVHOQK-UHFFFAOYSA-N -1 3 340.206 4.279 20 0 EIADHM Cc1ccc(C(C)(C)CNC(=O)c2cc([O-])ccc2Cl)c(C)c1 ZINC000553299931 1040106365 /nfs/dbraw/zinc/10/63/65/1040106365.db2.gz DWYTVTRHOXAKKH-UHFFFAOYSA-N -1 3 331.843 4.370 20 0 EIADHM CCCc1cc(=O)[n-]c(C(=Cc2ccn(-c3ccccc3)n2)CC)n1 ZINC000435335645 1040288997 /nfs/dbraw/zinc/28/89/97/1040288997.db2.gz JZKNRAVMMQINSS-SQFISAMPSA-N -1 3 334.423 4.271 20 0 EIADHM CCCc1cc(=O)[n-]c(C(=Cc2nccn2Cc2ccccc2)CC)n1 ZINC000435339968 1040298352 /nfs/dbraw/zinc/29/83/52/1040298352.db2.gz ZUAOQOFTHQDAMU-LGMDPLHJSA-N -1 3 348.450 4.330 20 0 EIADHM CCOc1ccc(F)c([N-]C(=O)c2ccc(F)c(F)c2F)c1F ZINC000535485027 1040305287 /nfs/dbraw/zinc/30/52/87/1040305287.db2.gz ZQVJUFMHWBCEEP-UHFFFAOYSA-N -1 3 331.240 4.033 20 0 EIADHM Cn1ccnc1[C@@H]([N-]c1nc2ccccc2o1)c1ccc(Cl)cc1 ZINC000514971283 1040394512 /nfs/dbraw/zinc/39/45/12/1040394512.db2.gz OIOCIDJOFRNFPK-INIZCTEOSA-N -1 3 338.798 4.416 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)N1CC2(CCCC2)c2ccccc21 ZINC000435568623 1040467614 /nfs/dbraw/zinc/46/76/14/1040467614.db2.gz IGPAIERPYZOXDN-UHFFFAOYSA-N -1 3 340.398 4.073 20 0 EIADHM CC[C@H]1CCc2c(sc3[n-]c(-c4csc(C)n4)nc(=O)c23)C1 ZINC000668142511 1040517419 /nfs/dbraw/zinc/51/74/19/1040517419.db2.gz OHFOOZWYAMRFML-VIFPVBQESA-N -1 3 331.466 4.344 20 0 EIADHM CCc1sc(C(=O)Nc2cccc([O-])c2F)cc1Br ZINC000551774660 1040576684 /nfs/dbraw/zinc/57/66/84/1040576684.db2.gz ABCFERNUCLJWQH-UHFFFAOYSA-N -1 3 344.205 4.170 20 0 EIADHM Cc1cc(Cl)ccc1S(=O)(=O)[N-]c1ccc(OC(C)C)cc1 ZINC000515631827 1040914039 /nfs/dbraw/zinc/91/40/39/1040914039.db2.gz BAOVBKIAJBURNN-UHFFFAOYSA-N -1 3 339.844 4.236 20 0 EIADHM O=S(=O)([N-]c1ccc(Oc2cccc(F)c2)cc1)c1ccccc1 ZINC000515697999 1041004026 /nfs/dbraw/zinc/00/40/26/1041004026.db2.gz YPHXEBGLNKMLCW-UHFFFAOYSA-N -1 3 343.379 4.419 20 0 EIADHM CCc1cc(=O)[n-]c(CN[C@H](c2ccc(Cl)cc2)[C@H](C)CC)n1 ZINC000538214632 1041172953 /nfs/dbraw/zinc/17/29/53/1041172953.db2.gz UGMCSMNLINVPEZ-XIKOKIGWSA-N -1 3 333.863 4.275 20 0 EIADHM CC(=O)c1cc(F)c([N-]C(=O)c2cc(F)cc(Cl)c2)c(F)c1F ZINC000461085185 1041223263 /nfs/dbraw/zinc/22/32/63/1041223263.db2.gz HOVCQXZTQLKSEX-UHFFFAOYSA-N -1 3 345.679 4.351 20 0 EIADHM O=C([O-])C[C@@H](NCc1ccc(C(F)(F)F)s1)c1cccs1 ZINC000904006579 1041269058 /nfs/dbraw/zinc/26/90/58/1041269058.db2.gz XTAASOXTFFSKDJ-SECBINFHSA-N -1 3 335.372 4.134 20 0 EIADHM O=C(c1cc([O-])ccc1Cl)N1C[C@H]2CCCCN2c2ccccc21 ZINC000554647174 1041307424 /nfs/dbraw/zinc/30/74/24/1041307424.db2.gz ODTLGCQOVCLOIM-CYBMUJFWSA-N -1 3 342.826 4.065 20 0 EIADHM COc1ccc(C(=O)N2CCCCC[C@@H]2c2ccc(C)o2)c([O-])c1 ZINC000436529016 1041313533 /nfs/dbraw/zinc/31/35/33/1041313533.db2.gz NNXLWMXRLGQLAQ-MRXNPFEDSA-N -1 3 329.396 4.060 20 0 EIADHM [O-]c1ccccc1-c1nc(-c2cccc(OCc3ccccc3)n2)no1 ZINC000436546711 1041323320 /nfs/dbraw/zinc/32/33/20/1041323320.db2.gz VNOKNTOSDPRZLC-UHFFFAOYSA-N -1 3 345.358 4.083 20 0 EIADHM CCN(CC(F)(F)F)C(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436538262 1041332822 /nfs/dbraw/zinc/33/28/22/1041332822.db2.gz SVXIIFYQSPXRPO-UHFFFAOYSA-N -1 3 339.313 4.209 20 0 EIADHM CC[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)c1ccc(OC)cc1[O-] ZINC000436540836 1041333014 /nfs/dbraw/zinc/33/30/14/1041333014.db2.gz ULRBATNQLAXEBW-HKUYNNGSSA-N -1 3 339.435 4.199 20 0 EIADHM COc1ccc(C(=O)N(C)[C@H](C)[C@@H](C)c2ccc(Cl)cc2)c([O-])c1 ZINC000436575494 1041339547 /nfs/dbraw/zinc/33/95/47/1041339547.db2.gz NPAMOHRJMPMTJU-CHWSQXEVSA-N -1 3 347.842 4.318 20 0 EIADHM Cc1ccc(-c2nc(COc3ccc(Cl)c(F)c3)no2)c([O-])c1 ZINC000436561689 1041343368 /nfs/dbraw/zinc/34/33/68/1041343368.db2.gz IQFDFFBJELCHAH-UHFFFAOYSA-N -1 3 334.734 4.122 20 0 EIADHM CC(C)c1ccc(C(=O)N[C@H](c2nccs2)C(F)(F)F)c([O-])c1 ZINC000436565121 1041346229 /nfs/dbraw/zinc/34/62/29/1041346229.db2.gz RRPJDTJKZQKIOD-GFCCVEGCSA-N -1 3 344.358 4.006 20 0 EIADHM COc1ccccc1C[C@H](C)N(C)C(=O)c1ccc(C(C)C)cc1[O-] ZINC000436569659 1041349248 /nfs/dbraw/zinc/34/92/48/1041349248.db2.gz HJTPBZHRHTUEKL-HNNXBMFYSA-N -1 3 341.451 4.227 20 0 EIADHM Cc1ccnc(Oc2ccc(NC(=O)c3ccc(C)c(C)c3[O-])cc2)n1 ZINC000436586183 1041362471 /nfs/dbraw/zinc/36/24/71/1041362471.db2.gz LNJGCQMDVFBACG-UHFFFAOYSA-N -1 3 349.390 4.152 20 0 EIADHM CN(Cc1ccccc1F)C(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436613290 1041372617 /nfs/dbraw/zinc/37/26/17/1041372617.db2.gz UOCLYTRZMHFJIW-UHFFFAOYSA-N -1 3 349.405 4.394 20 0 EIADHM CC(=O)c1ccc(C(=O)Nc2cccc(NC3CCCC3)c2)cc1[O-] ZINC000436629096 1041381944 /nfs/dbraw/zinc/38/19/44/1041381944.db2.gz HUARWGZFRORYIC-UHFFFAOYSA-N -1 3 338.407 4.202 20 0 EIADHM Cc1cccc([C@H]2CCCCN2C(=O)c2ccc(O)cc2[O-])c1C ZINC000436669474 1041409298 /nfs/dbraw/zinc/40/92/98/1041409298.db2.gz LYBTXKNSEZXOOU-GOSISDBHSA-N -1 3 325.408 4.082 20 0 EIADHM Cc1ccc(C(=O)N2CC3(CCC3)c3c2cccc3F)c([O-])c1C ZINC000436697659 1041429870 /nfs/dbraw/zinc/42/98/70/1041429870.db2.gz KCGVIODUTKRCMS-UHFFFAOYSA-N -1 3 325.383 4.230 20 0 EIADHM O=C([N-]c1csnc1-c1ccccc1)c1ccc(Br)o1 ZINC000436720021 1041442414 /nfs/dbraw/zinc/44/24/14/1041442414.db2.gz RAWLTRRJZYBFCX-UHFFFAOYSA-N -1 3 349.209 4.418 20 0 EIADHM Cc1ccc2oc(C(=O)Nc3ccc([O-])c(C(F)(F)F)c3)cc2n1 ZINC000436720632 1041442950 /nfs/dbraw/zinc/44/29/50/1041442950.db2.gz GIAUSKOEZIPKKW-UHFFFAOYSA-N -1 3 336.269 4.113 20 0 EIADHM O=C(c1ccccc1[O-])N1CCc2sccc2[C@H]1c1cccs1 ZINC000436751888 1041463104 /nfs/dbraw/zinc/46/31/04/1041463104.db2.gz ODMKIISMDGWVDA-KRWDZBQOSA-N -1 3 341.457 4.303 20 0 EIADHM C[C@H]1c2cccn2CCN1C(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436757082 1041466903 /nfs/dbraw/zinc/46/69/03/1041466903.db2.gz TVDUOPWFKQJTTA-INIZCTEOSA-N -1 3 346.430 4.002 20 0 EIADHM CSc1ccc([O-])c(C(=O)N(C)[C@@H](C)c2sc(C)nc2C)c1 ZINC000668400181 1041473225 /nfs/dbraw/zinc/47/32/25/1041473225.db2.gz VVVGCZFPEOZZEQ-JTQLQIEISA-N -1 3 336.482 4.021 20 0 EIADHM CCCCOc1ccc(C(=O)N2CCC=C(c3ccco3)C2)c([O-])c1 ZINC000436815661 1041486961 /nfs/dbraw/zinc/48/69/61/1041486961.db2.gz PKDHKVYAKNDOSK-UHFFFAOYSA-N -1 3 341.407 4.094 20 0 EIADHM CCc1ccc(C(=O)N2CCC[C@@H]2c2nc3cc(C)ccc3[nH]2)c([O-])c1 ZINC000436817615 1041487223 /nfs/dbraw/zinc/48/72/23/1041487223.db2.gz BOVKZELGDHAWPS-GOSISDBHSA-N -1 3 349.434 4.117 20 0 EIADHM CCc1ccc(C(=O)N2CCC[C@@H]2c2nc3ccc(C)cc3[nH]2)c([O-])c1 ZINC000436817615 1041487225 /nfs/dbraw/zinc/48/72/25/1041487225.db2.gz BOVKZELGDHAWPS-GOSISDBHSA-N -1 3 349.434 4.117 20 0 EIADHM C[C@@H]1CCN(C(=O)c2cc3c(cc2[O-])CCCC3)c2c(O)cccc21 ZINC000436817066 1041487425 /nfs/dbraw/zinc/48/74/25/1041487425.db2.gz QNBXUBSHGLLHEW-CYBMUJFWSA-N -1 3 337.419 4.131 20 0 EIADHM C[C@H]1CCN(C(=O)c2cc(Oc3ccccc3)ccc2[O-])CCS1 ZINC000436811603 1041490793 /nfs/dbraw/zinc/49/07/93/1041490793.db2.gz BIMDYPKTOUIYOU-AWEZNQCLSA-N -1 3 343.448 4.152 20 0 EIADHM COCc1ccc([C@H]2CCCN2C(=O)c2ccc(C(C)C)cc2[O-])o1 ZINC000436813770 1041492511 /nfs/dbraw/zinc/49/25/11/1041492511.db2.gz GALMGNCSZXBTKE-QGZVFWFLSA-N -1 3 343.423 4.232 20 0 EIADHM CC(C)c1ccc(C(=O)N(C)Cc2cc(F)c(F)c(F)c2)c([O-])c1 ZINC000436813571 1041493951 /nfs/dbraw/zinc/49/39/51/1041493951.db2.gz FACMKCMWADJJHR-UHFFFAOYSA-N -1 3 337.341 4.205 20 0 EIADHM COC[C@H](C)Oc1ccc(Cl)cc1NC(=O)c1ccc(C)cc1[O-] ZINC000436819955 1041500270 /nfs/dbraw/zinc/50/02/70/1041500270.db2.gz KENZOAHALDFLLT-LBPRGKRZSA-N -1 3 349.814 4.020 20 0 EIADHM O=C(c1ccccc1[O-])N1CCC[C@@H](c2cccc(C(F)(F)F)c2)C1 ZINC000436839241 1041505821 /nfs/dbraw/zinc/50/58/21/1041505821.db2.gz NRYZJEWHWLVFFG-CQSZACIVSA-N -1 3 349.352 4.431 20 0 EIADHM CC(=O)c1ccc(C(=O)N[C@H](C)c2cccc3ccccc32)cc1[O-] ZINC000436843415 1041513820 /nfs/dbraw/zinc/51/38/20/1041513820.db2.gz HHGSQCGKLRHAJQ-CYBMUJFWSA-N -1 3 333.387 4.239 20 0 EIADHM CC(=O)c1ccc(C(=O)Nc2nc(-c3cccs3)cs2)cc1[O-] ZINC000436860082 1041520483 /nfs/dbraw/zinc/52/04/83/1041520483.db2.gz DIXGSNSRVPQISA-UHFFFAOYSA-N -1 3 344.417 4.032 20 0 EIADHM COc1cccc(C(=O)N2C[C@H](c3ccccc3)c3ccccc32)c1[O-] ZINC000436885679 1041542492 /nfs/dbraw/zinc/54/24/92/1041542492.db2.gz IPTQEDOPLNVYNM-GOSISDBHSA-N -1 3 345.398 4.193 20 0 EIADHM COc1cccc(-c2nc(COc3ccc4ccccc4c3)no2)c1[O-] ZINC000436908371 1041546913 /nfs/dbraw/zinc/54/69/13/1041546913.db2.gz IRAJJQVTQASBOO-UHFFFAOYSA-N -1 3 348.358 4.183 20 0 EIADHM COc1cccc(-c2nc(-c3ccccc3OCC(C)C)no2)c1[O-] ZINC000436913264 1041550441 /nfs/dbraw/zinc/55/04/41/1041550441.db2.gz ZWZCWSZQJVLSLN-UHFFFAOYSA-N -1 3 340.379 4.153 20 0 EIADHM [O-]c1cc2ccccc2cc1-c1nc(-c2ccc3c(c2)OCCO3)no1 ZINC000436901187 1041553277 /nfs/dbraw/zinc/55/32/77/1041553277.db2.gz FZPNWDGQNVDFNT-UHFFFAOYSA-N -1 3 346.342 4.034 20 0 EIADHM COc1cccc(-c2nc(-c3ccc(SC)cc3Cl)no2)c1[O-] ZINC000436951362 1041563943 /nfs/dbraw/zinc/56/39/43/1041563943.db2.gz RKXFPFPLXNGQIS-UHFFFAOYSA-N -1 3 348.811 4.493 20 0 EIADHM C[C@H]1CN(C(=O)c2cc(Oc3ccccc3)ccc2[O-])CCC1(F)F ZINC000436941002 1041568833 /nfs/dbraw/zinc/56/88/33/1041568833.db2.gz ZFMYAQXRHLZBEL-ZDUSSCGKSA-N -1 3 347.361 4.302 20 0 EIADHM C[C@H](c1ccc(Cl)c(Cl)c1)N(C)C(=O)c1ccc(O)cc1[O-] ZINC000436945140 1041568856 /nfs/dbraw/zinc/56/88/56/1041568856.db2.gz SBXVZLURYFJXRS-SECBINFHSA-N -1 3 340.206 4.238 20 0 EIADHM CC(C)c1ccc(C(=O)N(C)[C@H](c2ncc[nH]2)c2ccccc2)c([O-])c1 ZINC000436968908 1041571964 /nfs/dbraw/zinc/57/19/64/1041571964.db2.gz VUHNXKWPFJBGNN-IBGZPJMESA-N -1 3 349.434 4.100 20 0 EIADHM COc1ccc(C(=O)N2CC=C(c3cccc4ccccc43)C2)c([O-])c1 ZINC000436957806 1041574821 /nfs/dbraw/zinc/57/48/21/1041574821.db2.gz AIEKLFFJDMBVMP-UHFFFAOYSA-N -1 3 345.398 4.093 20 0 EIADHM CSc1cccc(N(C)C(=O)c2ccc3c(c2[O-])CCCC3)c1 ZINC000436960215 1041576384 /nfs/dbraw/zinc/57/63/84/1041576384.db2.gz JJSJFTDCHKGEIO-UHFFFAOYSA-N -1 3 327.449 4.270 20 0 EIADHM C[C@@H](CSCc1noc(-c2ccccc2[O-])n1)c1ccccc1 ZINC000436972317 1041576706 /nfs/dbraw/zinc/57/67/06/1041576706.db2.gz NORPINVERYIIQR-ZDUSSCGKSA-N -1 3 326.421 4.479 20 0 EIADHM CC(C)C(=O)c1ccc(S(=O)(=O)[N-]c2ccsc2Cl)cc1 ZINC000437654391 1041871585 /nfs/dbraw/zinc/87/15/85/1041871585.db2.gz DPAGLHWCDXCCAV-UHFFFAOYSA-N -1 3 343.857 4.041 20 0 EIADHM CCOCc1ccc([N-]S(=O)(=O)c2c(C)c(C)cc(C)c2C)cc1 ZINC000438735328 1042328325 /nfs/dbraw/zinc/32/83/25/1042328325.db2.gz ZKHUWRMAGKRGTF-UHFFFAOYSA-N -1 3 347.480 4.258 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@@H]3CCc4c3cccc4C)nc2)n1 ZINC000518317547 1042465147 /nfs/dbraw/zinc/46/51/47/1042465147.db2.gz UFQKKFQKUNSANX-GOSISDBHSA-N -1 3 346.434 4.214 20 0 EIADHM O=C(c1ccc(O)cc1[O-])N1Cc2ccccc2C[C@H]1c1ccccc1 ZINC000439053040 1042483426 /nfs/dbraw/zinc/48/34/26/1042483426.db2.gz FNMWMCWGILSPCA-FQEVSTJZSA-N -1 3 345.398 4.038 20 0 EIADHM CCc1ccc([O-])c(C(=O)N2CC[C@H](c3ccc(Cl)cc3)C2)c1 ZINC000518457689 1042530335 /nfs/dbraw/zinc/53/03/35/1042530335.db2.gz JFWZENBKFZSELX-HNNXBMFYSA-N -1 3 329.827 4.238 20 0 EIADHM COc1ccc2cc([C@H](C)[S@](=O)c3ccc([O-])cc3)ccc2c1 ZINC000439432902 1042622905 /nfs/dbraw/zinc/62/29/05/1042622905.db2.gz XAAIBOCGRKIXCW-NPMABZOXSA-N -1 3 326.417 4.423 20 0 EIADHM Cc1ccc([N-]S(=O)(=O)c2cnc3ccsc3c2)c(Cl)c1 ZINC000439567269 1042693261 /nfs/dbraw/zinc/69/32/61/1042693261.db2.gz HSYJCUNQMMJRFJ-UHFFFAOYSA-N -1 3 338.841 4.059 20 0 EIADHM O=C([N-]c1nnc(/C=C/c2ccco2)s1)c1ccc(Cl)s1 ZINC000152385307 1042957119 /nfs/dbraw/zinc/95/71/19/1042957119.db2.gz MQFYGUKTSHTRHV-ZZXKWVIFSA-N -1 3 337.813 4.269 20 0 EIADHM Cc1cc(C(=O)[N-]c2cc(C)ccc2SCC(F)(F)F)on1 ZINC000076448099 1043093240 /nfs/dbraw/zinc/09/32/40/1043093240.db2.gz GUMXJFDFDJGTBZ-UHFFFAOYSA-N -1 3 330.331 4.198 20 0 EIADHM CSc1cccc(C)c1[N-]C(=O)c1cnc([C@H]2CCCO2)s1 ZINC000184600290 1043112249 /nfs/dbraw/zinc/11/22/49/1043112249.db2.gz MWVFXZDIZLMHCN-LLVKDONJSA-N -1 3 334.466 4.277 20 0 EIADHM CSc1cccc(C)c1[N-]C(=O)c1cc(-c2cccnc2)on1 ZINC000184632838 1043117161 /nfs/dbraw/zinc/11/71/61/1043117161.db2.gz OREJUHHHRDCDQW-UHFFFAOYSA-N -1 3 325.393 4.019 20 0 EIADHM O=C([N-]c1csc(-c2ccccc2)n1)c1nc2cccnc2s1 ZINC000672335239 1043123433 /nfs/dbraw/zinc/12/34/33/1043123433.db2.gz OOXGDFCZDBLFMV-UHFFFAOYSA-N -1 3 338.417 4.067 20 0 EIADHM [O-]c1cc(F)cc(CNc2ccccc2OC[C@H]2CCCCO2)c1 ZINC000185590609 1043200616 /nfs/dbraw/zinc/20/06/16/1043200616.db2.gz JCBSNJGJDSLUAO-QGZVFWFLSA-N -1 3 331.387 4.091 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)c1cc(Cl)cc(C(F)(F)F)c1 ZINC000427765836 1043200982 /nfs/dbraw/zinc/20/09/82/1043200982.db2.gz YLXNXYDKPAMJSD-UHFFFAOYSA-N -1 3 347.695 4.134 20 0 EIADHM Cc1csc([C@@H](NC(=O)c2cc([O-])c3ccccc3c2)C2CC2)n1 ZINC000280387364 1043225658 /nfs/dbraw/zinc/22/56/58/1043225658.db2.gz NAVWHOPGZSUTGC-KRWDZBQOSA-N -1 3 338.432 4.191 20 0 EIADHM O=C(Nc1ccc(OCC(F)F)cc1)c1cc([O-])c2ccccc2c1 ZINC000525924765 1043235083 /nfs/dbraw/zinc/23/50/83/1043235083.db2.gz GXFDXBYPLJULCI-UHFFFAOYSA-N -1 3 343.329 4.442 20 0 EIADHM Cc1ccc(NCc2c(F)ccc([O-])c2F)c(OC[C@H]2CCCO2)c1 ZINC000509185184 1043238171 /nfs/dbraw/zinc/23/81/71/1043238171.db2.gz OZVUKSCJLHXOIC-CYBMUJFWSA-N -1 3 349.377 4.149 20 0 EIADHM Cc1ccc(C[C@@H](C)NC(=O)c2cc([O-])c3ccccc3c2)s1 ZINC000526901095 1043243987 /nfs/dbraw/zinc/24/39/87/1043243987.db2.gz QELFBFSLJRQDPW-GFCCVEGCSA-N -1 3 325.433 4.276 20 0 EIADHM COc1ccc(NC(=O)c2cc([O-])c3ccccc3c2)c2ncccc12 ZINC000526924196 1043245648 /nfs/dbraw/zinc/24/56/48/1043245648.db2.gz FTJSZRMVEGSOQU-UHFFFAOYSA-N -1 3 344.370 4.355 20 0 EIADHM COCCN(C(=O)c1cc([O-])c2ccccc2c1)[C@@H](C)c1ccccc1 ZINC000527163470 1043251249 /nfs/dbraw/zinc/25/12/49/1043251249.db2.gz UBSRXIQWVPIHFZ-INIZCTEOSA-N -1 3 349.430 4.395 20 0 EIADHM CCN(CCc1cccs1)C(=O)c1cc([O-])c2ccccc2c1 ZINC000527165397 1043251707 /nfs/dbraw/zinc/25/17/07/1043251707.db2.gz DEVCHHAOSYGBPU-UHFFFAOYSA-N -1 3 325.433 4.312 20 0 EIADHM CC(C)[C@H](CC(F)(F)F)NC(=O)c1cc([O-])c2ccccc2c1 ZINC000527179536 1043253391 /nfs/dbraw/zinc/25/33/91/1043253391.db2.gz GUOMGAZVKSVMEI-AWEZNQCLSA-N -1 3 325.330 4.252 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N1CC[C@H](c2cccc(F)c2)C1 ZINC000527183712 1043253566 /nfs/dbraw/zinc/25/35/66/1043253566.db2.gz LFYUKNSPYUAKNV-INIZCTEOSA-N -1 3 335.378 4.314 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)N1CCC[C@H]1c1ccccc1Cl ZINC000163756926 1043264204 /nfs/dbraw/zinc/26/42/04/1043264204.db2.gz YCOSDQABIOVAFV-INIZCTEOSA-N -1 3 348.805 4.231 20 0 EIADHM Cc1c(N[C@@H](C)C(C)C)cccc1C(=O)NCc1ccc([O-])c(F)c1 ZINC000427944118 1043270688 /nfs/dbraw/zinc/27/06/88/1043270688.db2.gz CWKRJWHYGLAOGI-AWEZNQCLSA-N -1 3 344.430 4.226 20 0 EIADHM Cc1cccc(C(=O)Nc2ncc(Cc3ccccc3F)s2)c1[O-] ZINC001626095517 1043321300 /nfs/dbraw/zinc/32/13/00/1043321300.db2.gz IGAVICRLWOPGNU-UHFFFAOYSA-N -1 3 342.395 4.139 20 0 EIADHM CC(C)(C)OCCSc1nnc([N-]c2ccccc2F)s1 ZINC000065691927 1043415168 /nfs/dbraw/zinc/41/51/68/1043415168.db2.gz WXDJLQTURYKWMU-UHFFFAOYSA-N -1 3 327.450 4.328 20 0 EIADHM CSc1ccncc1[N-]C(=O)c1sc(-c2ccc(C)o2)nc1C ZINC000674257887 1043503849 /nfs/dbraw/zinc/50/38/49/1043503849.db2.gz VUMYHXVQNAURIB-UHFFFAOYSA-N -1 3 345.449 4.389 20 0 EIADHM CSc1ccncc1[N-]C(=O)c1csc(-c2cccs2)n1 ZINC000674257409 1043507560 /nfs/dbraw/zinc/50/75/60/1043507560.db2.gz MSYLBECOUDVIFY-UHFFFAOYSA-N -1 3 333.463 4.241 20 0 EIADHM CSc1cc(O)ccc1[N-]C(=O)c1c(C)onc1-c1ccccc1 ZINC000191561687 1043827428 /nfs/dbraw/zinc/82/74/28/1043827428.db2.gz KAUNVOCQRMYECH-UHFFFAOYSA-N -1 3 340.404 4.330 20 0 EIADHM CCCc1cc(=O)oc2cc(Oc3nc4ccccc4c(=O)[n-]3)ccc12 ZINC000731916201 1043845161 /nfs/dbraw/zinc/84/51/61/1043845161.db2.gz MGOWUCOSSMJVKS-UHFFFAOYSA-N -1 3 348.358 4.187 20 0 EIADHM O=C([N-]C1(c2ccc(Cl)cc2)CC1)C(F)(F)c1ccc(F)cc1 ZINC000732645419 1043976140 /nfs/dbraw/zinc/97/61/40/1043976140.db2.gz BLKWDDWDUOEJBQ-UHFFFAOYSA-N -1 3 339.744 4.376 20 0 EIADHM CCc1ccc([O-])c(C(=O)N(C)CCCOc2cccc(Cl)c2)c1 ZINC000499741369 1044451750 /nfs/dbraw/zinc/45/17/50/1044451750.db2.gz NGENXQJTCQMEKC-UHFFFAOYSA-N -1 3 347.842 4.149 20 0 EIADHM C[C@@H](c1ccccn1)N(C)C(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000094063015 1044502714 /nfs/dbraw/zinc/50/27/14/1044502714.db2.gz BIPBLHOICGYIKH-INIZCTEOSA-N -1 3 346.430 4.211 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N3CC(C)(C)CC(C)(C)C3)nc2)n1 ZINC000466467212 1044551415 /nfs/dbraw/zinc/55/14/15/1044551415.db2.gz UBGTUDZFVQKOLH-UHFFFAOYSA-N -1 3 340.471 4.069 20 0 EIADHM CC[C@H](Oc1ccnc(=S)[n-]1)c1ccc(Br)cc1 ZINC001226938536 1044577080 /nfs/dbraw/zinc/57/70/80/1044577080.db2.gz APKMEQLOIXKLBE-NSHDSACASA-N -1 3 325.231 4.058 20 0 EIADHM O=c1[n-]c(SC2CCCC2)nc2c1cnn2-c1cccc(Cl)c1 ZINC000676223425 1044683336 /nfs/dbraw/zinc/68/33/36/1044683336.db2.gz ONCDDVKTNFPTQG-UHFFFAOYSA-N -1 3 346.843 4.209 20 0 EIADHM Cc1ccc2c(Cl)c(C(=O)[N-]c3nc(C4CC4)no3)sc2c1 ZINC000734874317 1044701085 /nfs/dbraw/zinc/70/10/85/1044701085.db2.gz BZYJQLAHCVRFNM-UHFFFAOYSA-N -1 3 333.800 4.376 20 0 EIADHM CC[C@H](NC(=O)c1cc(=O)c2ccccc2[n-]1)c1cccc(Cl)c1 ZINC000053457103 1044810876 /nfs/dbraw/zinc/81/08/76/1044810876.db2.gz PYPLKNARRDJODS-HNNXBMFYSA-N -1 3 340.810 4.063 20 0 EIADHM COc1ccccc1Cc1noc(-c2cc3ccccc3cc2[O-])n1 ZINC000327291603 1044816469 /nfs/dbraw/zinc/81/64/69/1044816469.db2.gz IYTWGAWZLFBIDY-UHFFFAOYSA-N -1 3 332.359 4.195 20 0 EIADHM O=C(NC(C1CCCC1)C1CCCC1)c1cc(=O)c2ccccc2[n-]1 ZINC000735474667 1044822941 /nfs/dbraw/zinc/82/29/41/1044822941.db2.gz PBYMXQPHOMJDCU-UHFFFAOYSA-N -1 3 338.451 4.007 20 0 EIADHM O=C([N-]c1cscc1Br)c1c(F)ccc(F)c1F ZINC001129274347 1044850311 /nfs/dbraw/zinc/85/03/11/1044850311.db2.gz RWFSYXDOSNXZOE-UHFFFAOYSA-N -1 3 336.132 4.180 20 0 EIADHM C[C@H](OC(=O)c1cc2ccsc2[n-]1)C(=O)c1ccc2c(c1)CCC2 ZINC000914891501 1044852301 /nfs/dbraw/zinc/85/23/01/1044852301.db2.gz QVXIDNHFMOYIOI-NSHDSACASA-N -1 3 339.416 4.146 20 0 EIADHM CC(C)c1cccc(NC(=O)COC(=O)c2cc3ccsc3[n-]2)c1 ZINC000914891449 1044852369 /nfs/dbraw/zinc/85/23/69/1044852369.db2.gz PDWQKGVRASQFJN-UHFFFAOYSA-N -1 3 342.420 4.148 20 0 EIADHM Cc1cc(C)cc(NC(=O)[C@H](C)OC(=O)c2cc3ccsc3[n-]2)c1 ZINC000914890445 1044853100 /nfs/dbraw/zinc/85/31/00/1044853100.db2.gz GJNJHWDDHOJGLP-LBPRGKRZSA-N -1 3 342.420 4.030 20 0 EIADHM CCC[C@H]1CCc2nc([N-]C(=O)c3ocnc3C(F)F)sc2C1 ZINC000624964406 1044909022 /nfs/dbraw/zinc/90/90/22/1044909022.db2.gz NTWHRZQAVKSIPW-QMMMGPOBSA-N -1 3 341.383 4.226 20 0 EIADHM [O-]c1cc2ccccc2cc1-c1nc(Cc2cc(F)cc(F)c2)no1 ZINC000327424464 1044915719 /nfs/dbraw/zinc/91/57/19/1044915719.db2.gz NAKZUNUVMVINBN-UHFFFAOYSA-N -1 3 338.313 4.464 20 0 EIADHM O=C(COC(=O)c1cc2ccsc2[n-]1)c1ccc(F)c(Cl)c1 ZINC000736753036 1044968392 /nfs/dbraw/zinc/96/83/92/1044968392.db2.gz IVOMXQLOOKZIBF-UHFFFAOYSA-N -1 3 337.759 4.062 20 0 EIADHM CC(=O)c1ccc(C(=O)Nc2cc(C(F)(F)F)ccc2[O-])c(F)c1 ZINC000347739468 1044969772 /nfs/dbraw/zinc/96/97/72/1044969772.db2.gz XQRMSAIJVUUMGF-UHFFFAOYSA-N -1 3 341.260 4.005 20 0 EIADHM CCO[C@@H](C)c1nc(COC(=O)c2cc(Cl)c(Cl)[n-]2)cs1 ZINC000736771088 1044975033 /nfs/dbraw/zinc/97/50/33/1044975033.db2.gz MGQFMEGPARNWFD-ZETCQYMHSA-N -1 3 349.239 4.233 20 0 EIADHM CSCc1c2ccccc2oc1C(=O)[N-]c1nnc(C2CC2)s1 ZINC000021291657 1045042571 /nfs/dbraw/zinc/04/25/71/1045042571.db2.gz VPKMOTMHRBQJSK-UHFFFAOYSA-N -1 3 345.449 4.277 20 0 EIADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)C(F)=C3CCCC3)c2)n1 ZINC000763004269 1045482025 /nfs/dbraw/zinc/48/20/25/1045482025.db2.gz QKYMRQXSNUEFJX-UHFFFAOYSA-N -1 3 341.386 4.148 20 0 EIADHM Cc1ccc(C(=O)N2CCC(Oc3cc(C)ccc3C)CC2)c([O-])c1 ZINC000055708915 1045723491 /nfs/dbraw/zinc/72/34/91/1045723491.db2.gz DARSFDJDXPLWSL-UHFFFAOYSA-N -1 3 339.435 4.001 20 0 EIADHM CCc1nc([C@H](C)NC(=O)c2cc3sccc3c([O-])c2)cs1 ZINC000791360889 1045730371 /nfs/dbraw/zinc/73/03/71/1045730371.db2.gz SPODUYQHUNJOIS-VIFPVBQESA-N -1 3 332.450 4.117 20 0 EIADHM CCc1nc([C@@H](C)NC(=O)c2cc3sccc3c([O-])c2)cs1 ZINC000791360887 1045731264 /nfs/dbraw/zinc/73/12/64/1045731264.db2.gz SPODUYQHUNJOIS-SECBINFHSA-N -1 3 332.450 4.117 20 0 EIADHM O=C(NCCOC1CCCCCC1)c1cc2sccc2c([O-])c1 ZINC000791364752 1045731489 /nfs/dbraw/zinc/73/14/89/1045731489.db2.gz QGQLGEIEQBPESR-UHFFFAOYSA-N -1 3 333.453 4.076 20 0 EIADHM Cc1ccc(C[C@H](C)NC(=O)c2cc3sccc3c([O-])c2)s1 ZINC000791367147 1045731546 /nfs/dbraw/zinc/73/15/46/1045731546.db2.gz PYKXCYZIHDUFMB-JTQLQIEISA-N -1 3 331.462 4.338 20 0 EIADHM CCCN1C(=O)c2ccc(Cl)cc2N[C@@H]1c1ccc([O-])c(F)c1 ZINC000533713546 1045808035 /nfs/dbraw/zinc/80/80/35/1045808035.db2.gz GQUKSHGPHBICPB-INIZCTEOSA-N -1 3 334.778 4.161 20 0 EIADHM CCOC(=O)c1cc2cc(Nc3ccc([O-])c(F)c3F)ccc2o1 ZINC001212009049 1045830889 /nfs/dbraw/zinc/83/08/89/1045830889.db2.gz IFYPVQJCWBKNAA-UHFFFAOYSA-N -1 3 333.290 4.337 20 0 EIADHM CCOC(=O)c1ccc(Nc2ccc([O-])c(F)c2F)cc1Cl ZINC001212009752 1045831874 /nfs/dbraw/zinc/83/18/74/1045831874.db2.gz UJRVQYXMPMFXSS-UHFFFAOYSA-N -1 3 327.714 4.244 20 0 EIADHM O=C(c1ccncc1)c1ccc(Nc2ccc([O-])c(F)c2F)cc1 ZINC001212011161 1045832389 /nfs/dbraw/zinc/83/23/89/1045832389.db2.gz VTJAXUPEFDQVPL-UHFFFAOYSA-N -1 3 326.302 4.040 20 0 EIADHM CCOC(=O)c1ccc2c(cccc2Nc2ccc([O-])c(F)c2F)n1 ZINC001212013743 1045835163 /nfs/dbraw/zinc/83/51/63/1045835163.db2.gz HVKAYYOOKUBRIY-UHFFFAOYSA-N -1 3 344.317 4.139 20 0 EIADHM O=C(Nc1ccc(N2CCCC2)cc1)c1cc([O-])c2ccccc2c1 ZINC000792040551 1045855103 /nfs/dbraw/zinc/85/51/03/1045855103.db2.gz SZVJDTBXGPWZPI-UHFFFAOYSA-N -1 3 332.403 4.398 20 0 EIADHM Cc1ccc(-c2ccc(/C=C3\C(=O)[N-]C(=O)c4ccccc43)o2)cc1 ZINC000915987502 1045860555 /nfs/dbraw/zinc/86/05/55/1045860555.db2.gz FVZLFJBIZQEBNV-PDGQHHTCSA-N -1 3 329.355 4.066 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N1CCCO[C@H](c2ccccc2)C1 ZINC000792143318 1045863763 /nfs/dbraw/zinc/86/37/63/1045863763.db2.gz JWKZJRMJPOEWIH-NRFANRHFSA-N -1 3 347.414 4.149 20 0 EIADHM O=C(CCOc1cccc(Cl)c1Cl)[N-]OCc1ccccc1 ZINC000916161049 1045937735 /nfs/dbraw/zinc/93/77/35/1045937735.db2.gz IETMOMUQYULSPE-UHFFFAOYSA-N -1 3 340.206 4.010 20 0 EIADHM [O-]c1cccc(CNCc2sccc2Br)c1Cl ZINC000328266886 1046018792 /nfs/dbraw/zinc/01/87/92/1046018792.db2.gz WEJVOAHSHAWWHP-UHFFFAOYSA-N -1 3 332.650 4.159 20 0 EIADHM CCN(C[C@H](O)c1ccc(C)cc1)C(=O)c1ccc(C(C)C)cc1[O-] ZINC000769952453 1046107944 /nfs/dbraw/zinc/10/79/44/1046107944.db2.gz URMGJRDGHZFOGQ-FQEVSTJZSA-N -1 3 341.451 4.020 20 0 EIADHM Cc1cc(=O)[n-]c(-c2cccc(OC(=O)c3occc3C(C)C)c2)n1 ZINC000793158826 1046160415 /nfs/dbraw/zinc/16/04/15/1046160415.db2.gz MLLBIABCSWIYGU-UHFFFAOYSA-N -1 3 338.363 4.093 20 0 EIADHM C[C@H](NCc1ccc(C(=O)[O-])cc1)c1ccc(OCC2CC2)c(F)c1 ZINC000263415000 1046285822 /nfs/dbraw/zinc/28/58/22/1046285822.db2.gz MVOBKOZRMPBYSE-ZDUSSCGKSA-N -1 3 343.398 4.164 20 0 EIADHM O=C(CCC(=O)c1cccs1)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000125366249 1046302195 /nfs/dbraw/zinc/30/21/95/1046302195.db2.gz SDGMPHKHZKPTGL-UHFFFAOYSA-N -1 3 343.326 4.074 20 0 EIADHM CCc1cc(=O)[n-]c(CS[C@@H](C)c2ncc(-c3ccccc3)o2)n1 ZINC000125640986 1046322429 /nfs/dbraw/zinc/32/24/29/1046322429.db2.gz BGYGTSIWIQLQBX-LBPRGKRZSA-N -1 3 341.436 4.394 20 0 EIADHM CN(C)Cc1ccc(NC(=O)c2c([O-])cccc2Cl)cc1Cl ZINC000794223556 1046385770 /nfs/dbraw/zinc/38/57/70/1046385770.db2.gz XUFIRAOPMMTFFB-UHFFFAOYSA-N -1 3 339.222 4.013 20 0 EIADHM [O-]c1cccc(CNC2(c3cccc(F)c3)CC2)c1Br ZINC000459439233 1046667973 /nfs/dbraw/zinc/66/79/73/1046667973.db2.gz FBRXAGDYEVLJAO-UHFFFAOYSA-N -1 3 336.204 4.073 20 0 EIADHM C[C@]12CCCC[C@H]1CN2C(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC001170050109 1046750270 /nfs/dbraw/zinc/75/02/70/1046750270.db2.gz WWLABICRFZSJFM-AVRDEDQJSA-N -1 3 335.447 4.388 20 0 EIADHM Cc1cc(C)c(Br)c(C(=O)Nc2cc(F)ccc2[O-])c1 ZINC000128100494 1046762502 /nfs/dbraw/zinc/76/25/02/1046762502.db2.gz VRBZFBMBDPWYMK-UHFFFAOYSA-N -1 3 338.176 4.163 20 0 EIADHM CC(C)(NCc1cccc([O-])c1Br)c1ccccc1F ZINC000459556154 1046774802 /nfs/dbraw/zinc/77/48/02/1046774802.db2.gz JOVVICUHEPIERY-UHFFFAOYSA-N -1 3 338.220 4.319 20 0 EIADHM O=C(Nc1cccc([O-])c1F)c1cccc(OCc2cccs2)c1 ZINC000128202943 1046781499 /nfs/dbraw/zinc/78/14/99/1046781499.db2.gz CVGISXQOIOFRSN-UHFFFAOYSA-N -1 3 343.379 4.424 20 0 EIADHM C[C@@H]1C[C@@H](NCc2cccc([O-])c2Br)c2ccccc2O1 ZINC000459568180 1046787305 /nfs/dbraw/zinc/78/73/05/1046787305.db2.gz BARYBMZVOIMZDN-BXUZGUMPSA-N -1 3 348.240 4.157 20 0 EIADHM C[C@@H](OC(=O)c1cc2occc2[n-]1)C(=O)Nc1ccc2ccccc2c1 ZINC000786031120 1046803563 /nfs/dbraw/zinc/80/35/63/1046803563.db2.gz NBAJWBSKCWOFCE-GFCCVEGCSA-N -1 3 348.358 4.098 20 0 EIADHM Cc1ccccc1-c1noc([C@@H](C)OC(=O)c2cc3occc3[n-]2)n1 ZINC000786031075 1046803997 /nfs/dbraw/zinc/80/39/97/1046803997.db2.gz IZEPMKQZKOJMLI-LLVKDONJSA-N -1 3 337.335 4.037 20 0 EIADHM Cc1cccc(CNCc2ccc([O-])c(Cl)c2)c1Br ZINC000786824912 1046870627 /nfs/dbraw/zinc/87/06/27/1046870627.db2.gz ZOXXWHIVYLJZAV-UHFFFAOYSA-N -1 3 340.648 4.406 20 0 EIADHM O=C(Nc1cccc(-c2ccccc2)c1)c1nnc2ccccc2c1[O-] ZINC000805260267 1046872135 /nfs/dbraw/zinc/87/21/35/1046872135.db2.gz YQAFIXMNZQLEHE-UHFFFAOYSA-N -1 3 341.370 4.255 20 0 EIADHM O=C(Nc1cccc([O-])c1F)c1cc(-c2ccc(Cl)s2)on1 ZINC000128562649 1046937633 /nfs/dbraw/zinc/93/76/33/1046937633.db2.gz CUJIEOOONOXDIP-UHFFFAOYSA-N -1 3 338.747 4.154 20 0 EIADHM Cc1cc(OCc2ccccc2)c(C(=O)[N-]c2conc2C)s1 ZINC001130357188 1047011561 /nfs/dbraw/zinc/01/15/61/1047011561.db2.gz VNXQDDMOMHFTSA-UHFFFAOYSA-N -1 3 328.393 4.184 20 0 EIADHM O=C(Nc1cccc([O-])c1F)[C@H]1C[C@H]1c1cccc(C(F)(F)F)c1 ZINC000128842027 1047111330 /nfs/dbraw/zinc/11/13/30/1047111330.db2.gz VEVYRBDXRLFLHN-RYUDHWBXSA-N -1 3 339.288 4.292 20 0 EIADHM O=C(c1cc2sccc2c([O-])c1)N1CCC(C(F)(F)F)CC1 ZINC000788306854 1047152476 /nfs/dbraw/zinc/15/24/76/1047152476.db2.gz VEKQQKFSLAKEKF-UHFFFAOYSA-N -1 3 329.343 4.021 20 0 EIADHM O=C(c1cc2sccc2c([O-])c1)N1CCC[C@@H]1Cc1ccccc1 ZINC000788272017 1047155283 /nfs/dbraw/zinc/15/52/83/1047155283.db2.gz QKOVDEHVUFPYBQ-MRXNPFEDSA-N -1 3 337.444 4.454 20 0 EIADHM Cc1c([O-])ccc2c(CNc3ccc(Cl)c(F)c3)cc(=O)oc12 ZINC000917936252 1047223687 /nfs/dbraw/zinc/22/36/87/1047223687.db2.gz WTKQTQBWEXDPQI-UHFFFAOYSA-N -1 3 333.746 4.212 20 0 EIADHM CC(=O)c1cc(F)c([N-]C(=O)c2cc3cc(C)ccc3o2)c(F)c1 ZINC000537443243 1047233038 /nfs/dbraw/zinc/23/30/38/1047233038.db2.gz XWLYKDXTFZFFKO-UHFFFAOYSA-N -1 3 329.302 4.474 20 0 EIADHM Cc1ccc(-c2nc(CN[C@H](C)CCC[C@H](C)C(=O)[O-])cs2)cc1 ZINC000325635437 1047289594 /nfs/dbraw/zinc/28/95/94/1047289594.db2.gz VIZYNHFEFCHGSG-LSDHHAIUSA-N -1 3 346.496 4.488 20 0 EIADHM Cc1cccc(C2(C(=O)Nc3ccc([O-])c(C(F)(F)F)c3)CC2)c1 ZINC000476150566 1047385189 /nfs/dbraw/zinc/38/51/89/1047385189.db2.gz KHNXCKITRCTCRA-UHFFFAOYSA-N -1 3 335.325 4.390 20 0 EIADHM C[C@@H](COc1ccccc1)C(=O)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000476152468 1047390956 /nfs/dbraw/zinc/39/09/56/1047390956.db2.gz LIXHORDIKOKUQT-NSHDSACASA-N -1 3 339.313 4.065 20 0 EIADHM Cc1cc(=O)[n-]c(-c2cccc(OC(=O)[C@@H]3CCCCC3(C)C)c2)n1 ZINC000789435845 1047423054 /nfs/dbraw/zinc/42/30/54/1047423054.db2.gz UKAJVWMJXNHNGT-INIZCTEOSA-N -1 3 340.423 4.279 20 0 EIADHM CSc1ccc(Cl)c(NC(=O)c2c[n-]c3ccccc3c2=O)c1 ZINC001131085859 1047530850 /nfs/dbraw/zinc/53/08/50/1047530850.db2.gz YHYNXRQMDVJGQZ-UHFFFAOYSA-N -1 3 344.823 4.156 20 0 EIADHM CC[C@H](/N=C/c1cc(Br)ccc1[O-])c1c(C)noc1C ZINC000154802698 1047633411 /nfs/dbraw/zinc/63/34/11/1047633411.db2.gz MLSMPZYVHUGVMJ-TVYFDWKESA-N -1 3 337.217 4.330 20 0 EIADHM CC(C)(C)CCSc1nc2c(cnn2-c2ccccc2)c(=O)[n-]1 ZINC000556275489 1047653684 /nfs/dbraw/zinc/65/36/84/1047653684.db2.gz CHUUNHDBSZZBSP-UHFFFAOYSA-N -1 3 328.441 4.049 20 0 EIADHM O=C([N-]c1nc(Cc2ccccc2)ns1)c1ccc(Cl)s1 ZINC000107198126 1047714225 /nfs/dbraw/zinc/71/42/25/1047714225.db2.gz KNMIIDOAUWEVME-UHFFFAOYSA-N -1 3 335.841 4.096 20 0 EIADHM Cc1ccc(C(=O)Nc2ccc(-c3cn4c(n3)CCCC4)cc2)c([O-])c1 ZINC000108854165 1047820888 /nfs/dbraw/zinc/82/08/88/1047820888.db2.gz YIZQLKREBSJNLC-UHFFFAOYSA-N -1 3 347.418 4.153 20 0 EIADHM CCOc1cc(Cl)ccc1NC(=O)c1cc([O-])ccc1Cl ZINC000556620820 1047842869 /nfs/dbraw/zinc/84/28/69/1047842869.db2.gz ANYNEKZXXQODKS-UHFFFAOYSA-N -1 3 326.179 4.350 20 0 EIADHM CCc1ccc(C(=O)N[C@@H](C)[C@H](OC)c2ccc(Cl)cc2)c([O-])c1 ZINC001136846344 1047854881 /nfs/dbraw/zinc/85/48/81/1047854881.db2.gz AWKYRFXXWJZMGP-SGTLLEGYSA-N -1 3 347.842 4.114 20 0 EIADHM CCSc1ccc(Cl)cc1C(=O)Nc1n[n-]c(-c2ccco2)n1 ZINC001134127978 1047864817 /nfs/dbraw/zinc/86/48/17/1047864817.db2.gz IAOSSCOYSONLJJ-UHFFFAOYSA-N -1 3 348.815 4.082 20 0 EIADHM CC(=O)c1ccc(C(=O)N2CCCCC[C@H]2c2ccc(C)o2)cc1[O-] ZINC001136941225 1047968546 /nfs/dbraw/zinc/96/85/46/1047968546.db2.gz LALHDFYXKZRBMA-KRWDZBQOSA-N -1 3 341.407 4.254 20 0 EIADHM C[C@H]([N-]C(=O)C(F)(F)c1ccccc1)c1ccc(F)c(Cl)c1 ZINC000919841276 1048118286 /nfs/dbraw/zinc/11/82/86/1048118286.db2.gz UYENLOXMFYUEBH-JTQLQIEISA-N -1 3 327.733 4.448 20 0 EIADHM O=C(Nc1cc(F)ccc1[O-])c1ccc(C2SCCS2)cc1 ZINC000174885987 1048231704 /nfs/dbraw/zinc/23/17/04/1048231704.db2.gz DQKUJVWKHZOTKF-UHFFFAOYSA-N -1 3 335.425 4.262 20 0 EIADHM CSc1c(F)cc(NC(=O)c2cc([O-])ccc2Cl)cc1F ZINC000499113299 1048287383 /nfs/dbraw/zinc/28/73/83/1048287383.db2.gz IMRCCYJVKJBAOX-UHFFFAOYSA-N -1 3 329.755 4.298 20 0 EIADHM CN(c1ccc([N-]c2nnc(-c3ccco3)o2)cn1)C1CCCCC1 ZINC001212613251 1048394262 /nfs/dbraw/zinc/39/42/62/1048394262.db2.gz KXAOQSGKNIDKLL-UHFFFAOYSA-N -1 3 339.399 4.237 20 0 EIADHM Cc1ccc([C@@H]2C[C@H](C)CCN2C(=O)NCc2ccc([O-])c(F)c2)o1 ZINC000074375287 1048484446 /nfs/dbraw/zinc/48/44/46/1048484446.db2.gz GFQJSQPZLGAADK-WBMJQRKESA-N -1 3 346.402 4.116 20 0 EIADHM Cc1ccc(-c2nc(C(=O)[N-]c3cc(C(C)(C)F)on3)cs2)o1 ZINC001135195064 1048600069 /nfs/dbraw/zinc/60/00/69/1048600069.db2.gz FBISUNOREQFUHW-UHFFFAOYSA-N -1 3 335.360 4.156 20 0 EIADHM O=C(Cc1ccc([O-])c(F)c1)Nc1ccccc1Cc1ccccc1 ZINC001144631778 1048766631 /nfs/dbraw/zinc/76/66/31/1048766631.db2.gz ZXPGGFMTDHUIKK-UHFFFAOYSA-N -1 3 335.378 4.303 20 0 EIADHM CC(C)(C)CCCCCC(=O)Nc1ncc([O-])cc1Br ZINC001144678846 1048800315 /nfs/dbraw/zinc/80/03/15/1048800315.db2.gz JFJKIERPBHGUSI-UHFFFAOYSA-N -1 3 343.265 4.485 20 0 EIADHM C[C@@H]([N-]C(=O)C(F)(F)c1ccc(F)cc1)c1ccccc1Cl ZINC000920840720 1048800913 /nfs/dbraw/zinc/80/09/13/1048800913.db2.gz MIZCULKRGBKLSI-SNVBAGLBSA-N -1 3 327.733 4.448 20 0 EIADHM C[C@H]([N-]C(=O)C(F)(F)c1ccc(F)cc1)c1ccc(Cl)cc1 ZINC000920840591 1048801030 /nfs/dbraw/zinc/80/10/30/1048801030.db2.gz HQGPBMZSZXWBIM-JTQLQIEISA-N -1 3 327.733 4.448 20 0 EIADHM Cc1cccc(CCCOC(=O)c2cc3cc(Cl)sc3[n-]2)n1 ZINC000810571863 1048820856 /nfs/dbraw/zinc/82/08/56/1048820856.db2.gz WIPVKBRNMMDCKM-UHFFFAOYSA-N -1 3 334.828 4.376 20 0 EIADHM C[C@@H]1CCN(C(=O)c2cc(CCc3ccccc3)ccc2[O-])C[C@@H]1C ZINC001137556943 1048843925 /nfs/dbraw/zinc/84/39/25/1048843925.db2.gz FOIHILCHSQDLAT-SJORKVTESA-N -1 3 337.463 4.296 20 0 EIADHM Cc1cc(C(C)(C)C)cc(C)c1CCNC(=O)c1ccccc1[O-] ZINC001135658386 1048850855 /nfs/dbraw/zinc/85/08/55/1048850855.db2.gz GKHNOPRYMQWFBJ-UHFFFAOYSA-N -1 3 325.452 4.279 20 0 EIADHM CC(=O)c1ccc(C(=O)N[C@@H](c2ccc(Cl)cc2)C2CC2)cc1[O-] ZINC001135689566 1048859527 /nfs/dbraw/zinc/85/95/27/1048859527.db2.gz HWFMCCNJFJITQV-GOSISDBHSA-N -1 3 343.810 4.129 20 0 EIADHM CSc1cccnc1[N-]C(=O)c1cc(Oc2ccccc2)ccn1 ZINC001144820114 1048863923 /nfs/dbraw/zinc/86/39/23/1048863923.db2.gz AFHOHVWFRMGTKJ-UHFFFAOYSA-N -1 3 337.404 4.243 20 0 EIADHM CCCC[C@@](CC)(Nc1[n-]c(=O)c(Cl)cc1Cl)C(=O)OCC ZINC001171228954 1048867122 /nfs/dbraw/zinc/86/71/22/1048867122.db2.gz VSUOIBMANHZPGG-OAHLLOKOSA-N -1 3 349.258 4.408 20 0 EIADHM Cc1cccc(Oc2ccc(NC(=O)c3cccc4n[n-]nc43)cc2)c1 ZINC001135730515 1048877384 /nfs/dbraw/zinc/87/73/84/1048877384.db2.gz XENFUTQVILMFEP-UHFFFAOYSA-N -1 3 344.374 4.311 20 0 EIADHM CC[C@H](OC1CCCC1)C(=O)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000134080321 1048881828 /nfs/dbraw/zinc/88/18/28/1048881828.db2.gz ZZKMCGKWUQBREU-AWEZNQCLSA-N -1 3 331.334 4.087 20 0 EIADHM C[C@H]1CN(C(=O)c2cc3sccc3c([O-])c2)Cc2ccccc2O1 ZINC000817049040 1048889923 /nfs/dbraw/zinc/88/99/23/1048889923.db2.gz MXPVRKKQSPLIGK-LBPRGKRZSA-N -1 3 339.416 4.030 20 0 EIADHM O=C(Nc1ccc([O-])c(C(F)(F)F)c1)C1(c2cccc(F)c2)CC1 ZINC000134201202 1048894619 /nfs/dbraw/zinc/89/46/19/1048894619.db2.gz DRMGFDPHODGKCR-UHFFFAOYSA-N -1 3 339.288 4.220 20 0 EIADHM CC(C)(C)O[N-]C(=O)CCc1nc2cc(C(F)(F)F)ccc2s1 ZINC000125949152 1048895862 /nfs/dbraw/zinc/89/58/62/1048895862.db2.gz NYCBJLUOMSLKFD-UHFFFAOYSA-N -1 3 346.374 4.094 20 0 EIADHM C[C@@H](OC(=O)c1cc2ccsc2[n-]1)C(=O)c1cccc(Cl)c1 ZINC000817704460 1049028155 /nfs/dbraw/zinc/02/81/55/1049028155.db2.gz CKGXKNLZFONGRS-SECBINFHSA-N -1 3 333.796 4.311 20 0 EIADHM CCc1ccc([C@@H](NC(=O)c2ccc(OC)cc2[O-])C(C)C)cc1 ZINC001135978371 1049031065 /nfs/dbraw/zinc/03/10/65/1049031065.db2.gz NMCNINGQLPHJGW-IBGZPJMESA-N -1 3 327.424 4.090 20 0 EIADHM CC(C)c1noc([C@H](C)OC(=O)c2cc3cc(Cl)sc3[n-]2)n1 ZINC000811394652 1049050811 /nfs/dbraw/zinc/05/08/11/1049050811.db2.gz WXVOMKBJKOGTSL-ZETCQYMHSA-N -1 3 339.804 4.307 20 0 EIADHM CC(C)(C)OC(=O)c1ccc(NC(=O)CC2=CCCCC2)c([O-])c1 ZINC001146748499 1049054603 /nfs/dbraw/zinc/05/46/03/1049054603.db2.gz YAEARGFNKABSCM-UHFFFAOYSA-N -1 3 331.412 4.177 20 0 EIADHM Nc1ccc(C(=O)Nc2ccccc2SC2CCCC2)c([O-])c1 ZINC000817917467 1049058830 /nfs/dbraw/zinc/05/88/30/1049058830.db2.gz OXSVTWRAEFHFOL-UHFFFAOYSA-N -1 3 328.437 4.261 20 0 EIADHM CCCN(C(=O)c1ccc(N)cc1[O-])[C@H](C)c1cc2ccccc2o1 ZINC000817926574 1049060628 /nfs/dbraw/zinc/06/06/28/1049060628.db2.gz NIQSOTGJYXSGMN-CYBMUJFWSA-N -1 3 338.407 4.334 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1ccc(F)cc1C(F)(F)F ZINC000135141950 1049075388 /nfs/dbraw/zinc/07/53/88/1049075388.db2.gz IBFZWSKNTQKCCK-UHFFFAOYSA-N -1 3 333.668 4.456 20 0 EIADHM Cc1cccc([O-])c1C(=O)Nc1ccc2c(c1)OC1(CCCCC1)O2 ZINC001136103193 1049083855 /nfs/dbraw/zinc/08/38/55/1049083855.db2.gz VRPJOCVQGPKXEY-UHFFFAOYSA-N -1 3 339.391 4.385 20 0 EIADHM Cc1cccc(C(=O)Nc2nc3ccccc3n2C2CCCC2)c1[O-] ZINC001147331775 1049127884 /nfs/dbraw/zinc/12/78/84/1049127884.db2.gz OURMOGOHNIKBOU-UHFFFAOYSA-N -1 3 335.407 4.418 20 0 EIADHM CCc1ccc([O-])c(C(=O)N2C[C@@H](C)C[C@@H]2c2cccc(F)c2)c1 ZINC001148097861 1049264181 /nfs/dbraw/zinc/26/41/81/1049264181.db2.gz XEUVMJPRIGKGJG-SCLBCKFNSA-N -1 3 327.399 4.317 20 0 EIADHM COc1cccc(C(=O)Nc2snc(-c3ccccc3)c2C)c1[O-] ZINC001148197356 1049271864 /nfs/dbraw/zinc/27/18/64/1049271864.db2.gz GFFYWPXNWOKUEF-UHFFFAOYSA-N -1 3 340.404 4.085 20 0 EIADHM CCc1ccc(C(=O)Nc2ccc(C(=O)OC)c3ccccc23)c([O-])c1 ZINC001170928863 1049339814 /nfs/dbraw/zinc/33/98/14/1049339814.db2.gz TZFMOEKQXUPBBG-UHFFFAOYSA-N -1 3 349.386 4.147 20 0 EIADHM CCO[C@@H]1C[C@@H](N(C)C(=O)c2cc([O-])ccc2Cl)C1(CC)CC ZINC001148987493 1049407146 /nfs/dbraw/zinc/40/71/46/1049407146.db2.gz FJZVNOLOBHJYRS-HZPDHXFCSA-N -1 3 339.863 4.101 20 0 EIADHM CCc1ccc([O-])c(C(=O)Nc2ccc3[nH]c(-c4ccco4)nc3c2)c1 ZINC001136325499 1049471812 /nfs/dbraw/zinc/47/18/12/1049471812.db2.gz YCHGMZGPIAALEH-UHFFFAOYSA-N -1 3 347.374 4.343 20 0 EIADHM CCc1ccc(C(=O)NCC(C)(C)c2ccc(Cl)cc2)c([O-])c1 ZINC001136344066 1049515187 /nfs/dbraw/zinc/51/51/87/1049515187.db2.gz SLZJJJAEGDEWFI-UHFFFAOYSA-N -1 3 331.843 4.316 20 0 EIADHM CCc1cccc(C)c1NC(=O)c1c[n-]c2c(Cl)cccc2c1=O ZINC001136344633 1049517835 /nfs/dbraw/zinc/51/78/35/1049517835.db2.gz NSWPRFIAQCZXFD-UHFFFAOYSA-N -1 3 340.810 4.305 20 0 EIADHM O=C(C[C@@H](c1ccc(O)cc1)C1CC1)Nc1c([O-])cccc1Cl ZINC000615321379 1049635943 /nfs/dbraw/zinc/63/59/43/1049635943.db2.gz DXMIZKQVFPADAH-CQSZACIVSA-N -1 3 331.799 4.274 20 0 EIADHM CCc1cc(=O)[n-]c(CN2CC3(CCCCC3)[C@@H]2c2ccccc2)n1 ZINC001170966683 1049643230 /nfs/dbraw/zinc/64/32/30/1049643230.db2.gz GOUOVSJVZLOISB-FQEVSTJZSA-N -1 3 337.467 4.252 20 0 EIADHM CCc1cccc2c1OCC[C@@H]2NC(=O)c1ccc(C(C)C)cc1[O-] ZINC001136521738 1049717486 /nfs/dbraw/zinc/71/74/86/1049717486.db2.gz PIFCWXFJOUVZIW-SFHVURJKSA-N -1 3 339.435 4.332 20 0 EIADHM O=C(N[C@H]1CCc2ccc(F)cc21)c1cc2sccc2c([O-])c1 ZINC000813444332 1049777716 /nfs/dbraw/zinc/77/77/16/1049777716.db2.gz PMSGSSSBEVOPAQ-HNNXBMFYSA-N -1 3 327.380 4.163 20 0 EIADHM CCc1cccc(C(=O)Nc2nc(-c3cccs3)cs2)c1[O-] ZINC001136635831 1049802290 /nfs/dbraw/zinc/80/22/90/1049802290.db2.gz BVEHFRJJWWIQFG-UHFFFAOYSA-N -1 3 330.434 4.392 20 0 EIADHM CCc1ccc([O-])c(C(=O)Nc2nc3c(s2)c(C)ccc3C)c1 ZINC001136665233 1049816924 /nfs/dbraw/zinc/81/69/24/1049816924.db2.gz GXIDCSXXRXIENN-UHFFFAOYSA-N -1 3 326.421 4.433 20 0 EIADHM CC(=O)c1ccc(C(=O)N[C@H](CC(C)C)c2ccccc2C)cc1[O-] ZINC001136769347 1049873667 /nfs/dbraw/zinc/87/36/67/1049873667.db2.gz JCUMKVBRZCEBNP-LJQANCHMSA-N -1 3 339.435 4.420 20 0 EIADHM CCc1ccc(C(=O)N2CCS[C@H](C)[C@@H]2c2ccccc2)c([O-])c1 ZINC001136790732 1049884175 /nfs/dbraw/zinc/88/41/75/1049884175.db2.gz DDWMMTPNLWTKMP-AUUYWEPGSA-N -1 3 341.476 4.273 20 0 EIADHM Cc1nc([C@@H](C)N2CCC[C@@H](C(=O)[O-])C2)oc1-c1ccc(Cl)cc1 ZINC000263582063 1050090026 /nfs/dbraw/zinc/09/00/26/1050090026.db2.gz YAYBINXBGRKHAM-TZMCWYRMSA-N -1 3 348.830 4.161 20 0 EIADHM CC[C@]1(C(=O)[O-])CCCN(Cc2coc(-c3ccc(Cl)cc3)n2)C1 ZINC000324843331 1050123592 /nfs/dbraw/zinc/12/35/92/1050123592.db2.gz CPBOMRPGPSNLHE-SFHVURJKSA-N -1 3 348.830 4.072 20 0 EIADHM Cc1cccc(F)c1[N-]S(=O)(=O)c1ccc(C(=O)C(C)(C)C)cc1 ZINC000763499992 1050319051 /nfs/dbraw/zinc/31/90/51/1050319051.db2.gz JKPFRSWLHPJKPD-UHFFFAOYSA-N -1 3 349.427 4.164 20 0 EIADHM [O-]c1cncc(-c2nc(-c3cccc(OCc4ccccc4)c3)no2)c1 ZINC001212708245 1050329659 /nfs/dbraw/zinc/32/96/59/1050329659.db2.gz BUEPTTHBAPSOFN-UHFFFAOYSA-N -1 3 345.358 4.083 20 0 EIADHM O=C(NCC[C@@H]1CC[C@@H]2C[C@@H]21)c1cc(CCc2ccccc2)ccc1[O-] ZINC001177997837 1050350991 /nfs/dbraw/zinc/35/09/91/1050350991.db2.gz KMUMVSMCZMYVQF-XUVXKRRUSA-N -1 3 349.474 4.343 20 0 EIADHM O=C(Nc1cc([O-])cc(Cl)c1)c1ccc(C(=O)C(F)(F)F)cc1 ZINC001186576513 1050362747 /nfs/dbraw/zinc/36/27/47/1050362747.db2.gz LVNXATHKJACHRL-UHFFFAOYSA-N -1 3 343.688 4.043 20 0 EIADHM CCc1ccc([O-])c(C(=O)Nc2cc3n[nH]cc3c(C(F)(F)F)c2)c1 ZINC001178339528 1050438813 /nfs/dbraw/zinc/43/88/13/1050438813.db2.gz RGHHEMPFJHWZGK-UHFFFAOYSA-N -1 3 349.312 4.102 20 0 EIADHM COc1cccc(Nc2cc(Br)cc(F)c2[O-])c1F ZINC001173974670 1050684706 /nfs/dbraw/zinc/68/47/06/1050684706.db2.gz KBXMJRGSHMJKLZ-UHFFFAOYSA-N -1 3 330.128 4.185 20 0 EIADHM Cc1c2cc(F)ccc2oc1S(=O)(=O)[N-][C@@H]1CCCCC1(C)C ZINC001188033360 1050685832 /nfs/dbraw/zinc/68/58/32/1050685832.db2.gz BWCKTTIDJFVOSX-OAHLLOKOSA-N -1 3 339.432 4.127 20 0 EIADHM COc1cccc(Nc2cc(Br)cc(F)c2[O-])c1OC ZINC001174019439 1050704949 /nfs/dbraw/zinc/70/49/49/1050704949.db2.gz WPRPRAIYJLMIOI-UHFFFAOYSA-N -1 3 342.164 4.055 20 0 EIADHM CCc1cccc(C(=O)Nc2nc3c(s2)CCC[C@H]3CC)c1[O-] ZINC001179841409 1050790235 /nfs/dbraw/zinc/79/02/35/1050790235.db2.gz NFVXRNJRQGHWPL-LLVKDONJSA-N -1 3 330.453 4.493 20 0 EIADHM O=C(Nc1ccccc1)c1ccc(Nc2cc(=O)[n-]c(C3CC3)n2)cc1 ZINC001174160326 1050800471 /nfs/dbraw/zinc/80/04/71/1050800471.db2.gz AWUKQYHVFPNEGM-UHFFFAOYSA-N -1 3 346.390 4.056 20 0 EIADHM Cc1cccc([O-])c1C(=O)Nc1cccc(F)c1N1CCCCC1 ZINC001188655505 1050814043 /nfs/dbraw/zinc/81/40/43/1050814043.db2.gz QBIRCSOHQXFXAA-UHFFFAOYSA-N -1 3 328.387 4.082 20 0 EIADHM O=C(NC1CCCC1)c1cccc(Nc2cc([O-])c(F)cc2F)c1 ZINC001174197015 1050832854 /nfs/dbraw/zinc/83/28/54/1050832854.db2.gz JJSJLPUHFJMVHY-UHFFFAOYSA-N -1 3 332.350 4.086 20 0 EIADHM CCOc1cccc(OCC)c1C(=O)Nc1cc([O-])cc(Cl)c1 ZINC001188878073 1050855931 /nfs/dbraw/zinc/85/59/31/1050855931.db2.gz BJVDEVOHCIKFOO-UHFFFAOYSA-N -1 3 335.787 4.095 20 0 EIADHM CC(C)(C)c1cc([N-]S(=O)(=O)CC2CC2)c(O)c(C(C)(C)C)c1 ZINC001188973830 1050877113 /nfs/dbraw/zinc/87/71/13/1050877113.db2.gz MJRUGPZARZBUST-UHFFFAOYSA-N -1 3 339.501 4.139 20 0 EIADHM [O-]c1c(Br)ccc(Cl)c1Nc1cccc2[nH]ncc21 ZINC001174348295 1050904770 /nfs/dbraw/zinc/90/47/70/1050904770.db2.gz WLZFPLONCJTBPD-UHFFFAOYSA-N -1 3 338.592 4.428 20 0 EIADHM O=C(Nc1cncc([O-])c1)Nc1ccc(Cl)cc1C(F)(F)F ZINC001189093932 1050907089 /nfs/dbraw/zinc/90/70/89/1050907089.db2.gz IPZNEFZDDOCRAD-UHFFFAOYSA-N -1 3 331.681 4.103 20 0 EIADHM C[C@@H](CSCc1nnc(-c2ccccc2[O-])o1)c1ccccc1 ZINC001189276245 1050955532 /nfs/dbraw/zinc/95/55/32/1050955532.db2.gz JIPPZCHVOATUOX-ZDUSSCGKSA-N -1 3 326.421 4.479 20 0 EIADHM O=S(=O)(Cc1cc(F)ccc1F)[N-]c1cccc2ccccc21 ZINC001189688375 1051034704 /nfs/dbraw/zinc/03/47/04/1051034704.db2.gz GMBGSMITEUGTDK-UHFFFAOYSA-N -1 3 333.359 4.060 20 0 EIADHM COc1cccc([C@H]2C[C@@H](C)CN2Cc2c(F)ccc([O-])c2F)c1 ZINC001180834935 1051085686 /nfs/dbraw/zinc/08/56/86/1051085686.db2.gz INCCVGNRINLFHU-SJKOYZFVSA-N -1 3 333.378 4.262 20 0 EIADHM O=S(=O)([N-]C(C1CCC1)C1CCC1)c1c(Cl)cccc1Cl ZINC001190077285 1051118894 /nfs/dbraw/zinc/11/88/94/1051118894.db2.gz IIBYDTLXMYEEQC-UHFFFAOYSA-N -1 3 348.295 4.241 20 0 EIADHM Cc1c2ccccc2oc1[C@@H](C)NCc1cc(=O)oc2cc([O-])ccc12 ZINC000183606368 1051183911 /nfs/dbraw/zinc/18/39/11/1051183911.db2.gz GKOXGMKVZLLIRE-CYBMUJFWSA-N -1 3 349.386 4.404 20 0 EIADHM O=C(Nc1ccc(Cl)cc1[O-])[C@H]1SCCc2sccc21 ZINC000153550675 1051192779 /nfs/dbraw/zinc/19/27/79/1051192779.db2.gz LXPNWMMFQZLVOP-ZDUSSCGKSA-N -1 3 325.842 4.076 20 0 EIADHM CC(=O)c1cccc(Cl)c1[N-]S(=O)(=O)c1ccc(C2CC2)cc1 ZINC001190512797 1051199755 /nfs/dbraw/zinc/19/97/55/1051199755.db2.gz RRFDILWQAVJPGX-UHFFFAOYSA-N -1 3 349.839 4.221 20 0 EIADHM Cc1oc(-c2ccccc2)nc1CC(=O)Nc1ccc(Cl)cc1[O-] ZINC000153649034 1051210121 /nfs/dbraw/zinc/21/01/21/1051210121.db2.gz GVJHNHZMXQKJDJ-UHFFFAOYSA-N -1 3 342.782 4.190 20 0 EIADHM O=C(Nc1ccc(Cl)cc1[O-])c1ccc(Br)cc1F ZINC000153685151 1051215740 /nfs/dbraw/zinc/21/57/40/1051215740.db2.gz ABQFXGVGXYGIFA-UHFFFAOYSA-N -1 3 344.567 4.200 20 0 EIADHM O=C(Nc1ccc(Cl)cc1[O-])c1ccc(Oc2cccnc2)cc1 ZINC000153698013 1051217493 /nfs/dbraw/zinc/21/74/93/1051217493.db2.gz RSVOIGIYTNACAC-UHFFFAOYSA-N -1 3 340.766 4.485 20 0 EIADHM COc1cccc(Nc2c(F)cc([O-])cc2F)c1C(=O)C(F)(F)F ZINC001175102525 1051350726 /nfs/dbraw/zinc/35/07/26/1051350726.db2.gz NNSYJRNOXFQQKS-UHFFFAOYSA-N -1 3 347.239 4.168 20 0 EIADHM CC(C)(C)OC(=O)c1ccc(NC(=O)NC2CCCCCC2)c([O-])c1 ZINC001191277910 1051415148 /nfs/dbraw/zinc/41/51/48/1051415148.db2.gz TWTMPTXCWNPCLD-UHFFFAOYSA-N -1 3 348.443 4.192 20 0 EIADHM CC(C)COc1ccc(NC(=O)c2c([O-])cccc2O)cc1Cl ZINC001182302420 1051464481 /nfs/dbraw/zinc/46/44/81/1051464481.db2.gz BYTHFOZSBAOIHN-UHFFFAOYSA-N -1 3 335.787 4.038 20 0 EIADHM COC(=O)c1oc2cccc(F)c2c1Nc1c(F)ccc([O-])c1F ZINC001175264614 1051501385 /nfs/dbraw/zinc/50/13/85/1051501385.db2.gz YZHCKHYALSQNQE-UHFFFAOYSA-N -1 3 337.253 4.086 20 0 EIADHM Nc1ccc(-c2ccc(Nc3c(F)ccc([O-])c3F)c(O)c2)cc1O ZINC001175269821 1051505683 /nfs/dbraw/zinc/50/56/83/1051505683.db2.gz NBCVZOPBJFSCDC-UHFFFAOYSA-N -1 3 344.317 4.074 20 0 EIADHM [O-]c1ccc(F)c(Nc2c(F)ccc(Br)c2F)c1F ZINC001175270536 1051506773 /nfs/dbraw/zinc/50/67/73/1051506773.db2.gz DFTJCGACYMCJGU-UHFFFAOYSA-N -1 3 336.082 4.455 20 0 EIADHM O=C(Nc1cc([O-])cc(Cl)c1)c1cncc(-c2cccs2)c1 ZINC001191824514 1051561530 /nfs/dbraw/zinc/56/15/30/1051561530.db2.gz HYHZNPZXOBZBHW-UHFFFAOYSA-N -1 3 330.796 4.421 20 0 EIADHM Oc1ccc(C2CCCCC2)cc1Nc1ccc(-c2nn[n-]n2)cc1 ZINC001175431835 1051585519 /nfs/dbraw/zinc/58/55/19/1051585519.db2.gz PCCHMNQECAQSCL-UHFFFAOYSA-N -1 3 335.411 4.364 20 0 EIADHM Cc1c(-c2ccccc2)nsc1Nc1ccc(-c2nn[n-]n2)cc1 ZINC001175427687 1051588720 /nfs/dbraw/zinc/58/87/20/1051588720.db2.gz PIUPPNMOTOUSCP-UHFFFAOYSA-N -1 3 334.408 4.042 20 0 EIADHM O=C(Nc1cncc([O-])c1)Nc1c(Cl)cc(Cl)cc1Cl ZINC001192010826 1051612263 /nfs/dbraw/zinc/61/22/63/1051612263.db2.gz MQNSEAYHQMVJIE-UHFFFAOYSA-N -1 3 332.574 4.391 20 0 EIADHM Cc1nc(NC(=O)Nc2c(Cl)cc(Cl)cc2Cl)cc(=O)[n-]1 ZINC001192012621 1051612652 /nfs/dbraw/zinc/61/26/52/1051612652.db2.gz WPQHXVPEGSTOKI-UHFFFAOYSA-N -1 3 347.589 4.095 20 0 EIADHM Cc1ccc(C)c([C@@H](C)N(C)C(=O)NCc2ccc([O-])c(F)c2)c1 ZINC000163658179 1051621161 /nfs/dbraw/zinc/62/11/61/1051621161.db2.gz JXTBVYVIDMMHGH-CQSZACIVSA-N -1 3 330.403 4.051 20 0 EIADHM Cn1cc2cccc([N-]c3nc4cc(Br)ccc4o3)c2n1 ZINC001175457408 1051627612 /nfs/dbraw/zinc/62/76/12/1051627612.db2.gz AVDLGTDPBQJJJO-UHFFFAOYSA-N -1 3 343.184 4.221 20 0 EIADHM Cc1cc(NC(=O)Nc2ccc([O-])c(Br)c2)ccc1F ZINC001192381914 1051711727 /nfs/dbraw/zinc/71/17/27/1051711727.db2.gz DWPOZXCWPCQLJR-UHFFFAOYSA-N -1 3 339.164 4.246 20 0 EIADHM CC(C)(C)c1nc2ccc(NC(=O)c3c([O-])cccc3O)cc2s1 ZINC001182863258 1051723562 /nfs/dbraw/zinc/72/35/62/1051723562.db2.gz JLTDGMXQZOASDQ-UHFFFAOYSA-N -1 3 342.420 4.257 20 0 EIADHM [O-]c1cccc(Nc2ccnc(Br)c2)c1Br ZINC001175749273 1051757469 /nfs/dbraw/zinc/75/74/69/1051757469.db2.gz XHPBKBMVGIQRHN-UHFFFAOYSA-N -1 3 344.006 4.056 20 0 EIADHM [O-]c1cccc(Nc2cnn(-c3ccccc3)c2)c1Br ZINC001175797583 1051764548 /nfs/dbraw/zinc/76/45/48/1051764548.db2.gz WWVBWXLOEOFOFX-UHFFFAOYSA-N -1 3 330.185 4.084 20 0 EIADHM [O-]c1cc(Nc2cccnc2OCc2ccccc2)c(F)cc1F ZINC001175877079 1051809629 /nfs/dbraw/zinc/80/96/29/1051809629.db2.gz XJGGZGBCAJEXIT-UHFFFAOYSA-N -1 3 328.318 4.388 20 0 EIADHM Cc1c(NC(=O)c2cc(Cc3ccccc3)ccc2[O-])n[nH]c1C(C)C ZINC001183763367 1051891041 /nfs/dbraw/zinc/89/10/41/1051891041.db2.gz NSBXFOWRDSYFNB-UHFFFAOYSA-N -1 3 349.434 4.390 20 0 EIADHM Cc1ccc(-c2cc(C(=O)O[C@@H](C)CCCC(F)(F)F)n[n-]2)o1 ZINC000774723643 1051958285 /nfs/dbraw/zinc/95/82/85/1051958285.db2.gz TWNSULOPDRKKJJ-VIFPVBQESA-N -1 3 330.306 4.256 20 0 EIADHM Cc1ccc(-c2cc(C(=O)O[C@@H](C)CCCC(F)(F)F)[n-]n2)o1 ZINC000774723643 1051958297 /nfs/dbraw/zinc/95/82/97/1051958297.db2.gz TWNSULOPDRKKJJ-VIFPVBQESA-N -1 3 330.306 4.256 20 0 EIADHM Cc1cnc(Cl)c(NC(=O)c2ccc([O-])cc2C(F)(F)F)c1 ZINC001193734482 1051976969 /nfs/dbraw/zinc/97/69/69/1051976969.db2.gz SRDHWINUTTXSMN-UHFFFAOYSA-N -1 3 330.693 4.020 20 0 EIADHM Cc1cc(Cl)c(NC(=O)c2ccc([O-])cc2C(F)(F)F)cc1O ZINC001193749061 1051992024 /nfs/dbraw/zinc/99/20/24/1051992024.db2.gz ZHPAGWAREFOPLP-UHFFFAOYSA-N -1 3 345.704 4.331 20 0 EIADHM Cc1ccc(CCNC(=O)c2ccc([O-])cc2C(F)(F)F)c(C)c1 ZINC001193746508 1051992357 /nfs/dbraw/zinc/99/23/57/1051992357.db2.gz BRVJIRLTTPQKMI-UHFFFAOYSA-N -1 3 337.341 4.000 20 0 EIADHM CCN(CC)C(=O)c1cc(F)cc(Nc2ccc([O-])c(F)c2F)c1 ZINC001176298678 1052004810 /nfs/dbraw/zinc/00/48/10/1052004810.db2.gz LECSUNBUVRZBEA-UHFFFAOYSA-N -1 3 338.329 4.035 20 0 EIADHM COc1cccc([N-]S(=O)(=O)c2ccc(C)c3ccccc32)c1F ZINC001193857584 1052014784 /nfs/dbraw/zinc/01/47/84/1052014784.db2.gz MYHBUAWGXCOQHN-UHFFFAOYSA-N -1 3 345.395 4.097 20 0 EIADHM Cc1ccc(Cl)c(S(=O)(=O)[N-][C@@H](C)CCC(C)C)c1Cl ZINC001184523949 1052026268 /nfs/dbraw/zinc/02/62/68/1052026268.db2.gz MODSLAOAACWODS-NSHDSACASA-N -1 3 338.300 4.405 20 0 EIADHM Cc1nc(-c2cccc(NC(=O)c3c(C)cc(O)cc3[O-])c2)cs1 ZINC001193912485 1052026568 /nfs/dbraw/zinc/02/65/68/1052026568.db2.gz VVKNRGXQDYIXEG-UHFFFAOYSA-N -1 3 340.404 4.090 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2ccc(C)c(-c3ncco3)c2)c(C)c1 ZINC000164728303 1052036804 /nfs/dbraw/zinc/03/68/04/1052036804.db2.gz AYLFAJVWFWPHEF-UHFFFAOYSA-N -1 3 342.420 4.068 20 0 EIADHM O=C(Nc1c([O-])cccc1Br)Oc1ccc(Cl)cc1 ZINC001194055645 1052064641 /nfs/dbraw/zinc/06/46/41/1052064641.db2.gz JJYHFIYQMAKFNT-UHFFFAOYSA-N -1 3 342.576 4.419 20 0 EIADHM CCCCOc1ccccc1CN[C@@H](CC(=O)[O-])c1cccs1 ZINC000671162554 1052071260 /nfs/dbraw/zinc/07/12/60/1052071260.db2.gz LGANGTRXIRQJLI-HNNXBMFYSA-N -1 3 333.453 4.233 20 0 EIADHM Cc1cccc(C)c1S(=O)(=O)[N-]c1ccc(C(F)(F)F)cc1C ZINC001194633691 1052182439 /nfs/dbraw/zinc/18/24/39/1052182439.db2.gz FALKXHISFYXBPZ-UHFFFAOYSA-N -1 3 343.370 4.431 20 0 EIADHM O=C(NCc1ccc(Cl)s1)c1cc([O-])cc(C(F)(F)F)c1 ZINC000622299630 1052193619 /nfs/dbraw/zinc/19/36/19/1052193619.db2.gz HPNATKRTVPJGDN-UHFFFAOYSA-N -1 3 335.734 4.056 20 0 EIADHM CC1(C)[C@@H](c2cccc(Cl)c2)CCN1C(=O)c1ccc(O)cc1[O-] ZINC001176901529 1052209154 /nfs/dbraw/zinc/20/91/54/1052209154.db2.gz CPTDTOZNKWQTGZ-MRXNPFEDSA-N -1 3 345.826 4.160 20 0 EIADHM Cc1ccccc1[C@H](N=c1ncnc2[nH][n-]cc1-2)[C@H]1CCC[C@H](C)C1 ZINC001185323831 1052220652 /nfs/dbraw/zinc/22/06/52/1052220652.db2.gz ZFOCHIUOUTYFEW-DHSIGJKJSA-N -1 3 335.455 4.014 20 0 EIADHM O=S(=O)([N-]c1cc(Cl)c(F)c(Cl)c1F)c1ccsc1 ZINC001185391405 1052228576 /nfs/dbraw/zinc/22/85/76/1052228576.db2.gz KVNKBGRYODLROY-UHFFFAOYSA-N -1 3 344.191 4.134 20 0 EIADHM Cc1cc(F)c([N-]S(=O)(=O)c2ccc(Cl)c(C)c2)cc1F ZINC001185530126 1052257893 /nfs/dbraw/zinc/25/78/93/1052257893.db2.gz UGXVMFMQTVXUTR-UHFFFAOYSA-N -1 3 331.771 4.036 20 0 EIADHM CCc1ccc(C(=O)Nc2cnn(CC(C)C)c2C(C)C)c([O-])c1 ZINC000622475183 1052285085 /nfs/dbraw/zinc/28/50/85/1052285085.db2.gz RTYKFYCIPPDFDK-UHFFFAOYSA-N -1 3 329.444 4.183 20 0 EIADHM Cc1ccc(C(=O)N2CCOc3c2cccc3C(C)(C)C)c([O-])c1C ZINC000622541104 1052320202 /nfs/dbraw/zinc/32/02/02/1052320202.db2.gz BFMOIKMEOLDUBC-UHFFFAOYSA-N -1 3 339.435 4.346 20 0 EIADHM C[C@@H](C1CCCCC1)N(C)C(=O)c1cc([O-])cc(C(F)(F)F)c1 ZINC000622586690 1052338988 /nfs/dbraw/zinc/33/89/88/1052338988.db2.gz IXXGYUZKSUUQKL-NSHDSACASA-N -1 3 329.362 4.452 20 0 EIADHM COc1ccc(N(CC2CC2)C(=O)c2ccc(C)c(C)c2[O-])cc1 ZINC000622646799 1052368911 /nfs/dbraw/zinc/36/89/11/1052368911.db2.gz UPHZIHUOVRYSDV-UHFFFAOYSA-N -1 3 325.408 4.074 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)N[C@H](C1CCC1)C1CCCC1 ZINC000622736377 1052401506 /nfs/dbraw/zinc/40/15/06/1052401506.db2.gz ANCMADSBUXOUQI-FQEVSTJZSA-N -1 3 333.447 4.329 20 0 EIADHM Cc1cc(=O)[n-]c(C(C)(C)NC(=O)CC2CCC(C(C)(C)C)CC2)n1 ZINC000622739436 1052409401 /nfs/dbraw/zinc/40/94/01/1052409401.db2.gz JHIWTVCBWZGZGD-UHFFFAOYSA-N -1 3 347.503 4.085 20 0 EIADHM C[C@H](NC(=O)NCc1ccc([O-])c(F)c1)c1cc2ccccc2s1 ZINC000172586038 1052506126 /nfs/dbraw/zinc/50/61/26/1052506126.db2.gz JHFBTFQDRFRMOE-NSHDSACASA-N -1 3 344.411 4.306 20 0 EIADHM CCc1cc(=O)[n-]c(CN[C@@H](c2ccc(Cl)cc2)C2CCC2)n1 ZINC000182571973 1052940444 /nfs/dbraw/zinc/94/04/44/1052940444.db2.gz ZJTFTEBAMVTZLS-GOSISDBHSA-N -1 3 331.847 4.029 20 0 EIADHM O=C(Nc1ccc(Cl)cc1[O-])c1cc(O)ccc1C(F)(F)F ZINC000193690165 1053028765 /nfs/dbraw/zinc/02/87/65/1053028765.db2.gz IEWATOGVQUJVSK-UHFFFAOYSA-N -1 3 331.677 4.022 20 0 EIADHM CCCCC[C@H](NC(=O)c1cc(OC)c([O-])c(OC)c1)C(C)(C)C ZINC000764276593 1053050763 /nfs/dbraw/zinc/05/07/63/1053050763.db2.gz STRQXSWTOZPXEY-INIZCTEOSA-N -1 3 337.460 4.134 20 0 EIADHM [O-]C(=NO[C@@H]1CCCCO1)Nc1cccc(Sc2ccccc2)c1 ZINC000775609200 1053091537 /nfs/dbraw/zinc/09/15/37/1053091537.db2.gz RRVNESABZCROIG-QGZVFWFLSA-N -1 3 344.436 4.418 20 0 EIADHM O=C([N-]O[C@@H]1CCCCO1)Nc1cccc(Sc2ccccc2)c1 ZINC000775609200 1053091554 /nfs/dbraw/zinc/09/15/54/1053091554.db2.gz RRVNESABZCROIG-QGZVFWFLSA-N -1 3 344.436 4.418 20 0 EIADHM O=c1ccnc(C=Cc2cccc(OCCCc3ccccc3)c2)[n-]1 ZINC000764437337 1053102706 /nfs/dbraw/zinc/10/27/06/1053102706.db2.gz YVSHTLGBQKOTLV-QXMHVHEDSA-N -1 3 332.403 4.364 20 0 EIADHM O=c1ccnc(C=Cc2csc(-c3ccc(C(F)(F)F)cc3)n2)[n-]1 ZINC000764441264 1053107223 /nfs/dbraw/zinc/10/72/23/1053107223.db2.gz FLZYFLJQYWFDJW-WAYWQWQTSA-N -1 3 349.337 4.495 20 0 EIADHM CC(C)c1cccc(S(=O)(=O)[N-]c2cc(F)c(F)c(F)c2F)c1 ZINC001195154056 1053304351 /nfs/dbraw/zinc/30/43/51/1053304351.db2.gz SSAPFCFYKRPLJR-UHFFFAOYSA-N -1 3 347.333 4.167 20 0 EIADHM O=C([N-]c1cc(Cl)nnc1Cl)c1cc(Cl)c(Cl)s1 ZINC001195169464 1053314542 /nfs/dbraw/zinc/31/45/42/1053314542.db2.gz LWWDUTZYHXOWCB-UHFFFAOYSA-N -1 3 343.022 4.404 20 0 EIADHM Cc1cccc(Cl)c1S(=O)(=O)[N-]c1ccc(F)cc1Cl ZINC001195308191 1053371151 /nfs/dbraw/zinc/37/11/51/1053371151.db2.gz KSZQCPTUUFSFDR-UHFFFAOYSA-N -1 3 334.199 4.242 20 0 EIADHM O=C(Nc1ccc(Cl)cc1[O-])[C@@H](O)c1cc(Cl)cc(Cl)c1 ZINC000765221163 1053470755 /nfs/dbraw/zinc/47/07/55/1053470755.db2.gz AEMLWSJNCIRMAU-ZDUSSCGKSA-N -1 3 346.597 4.025 20 0 EIADHM O=C(Nc1ncccc1[O-])c1ccc(-c2ccc3[nH]ccc3c2)cc1 ZINC001195865719 1053508862 /nfs/dbraw/zinc/50/88/62/1053508862.db2.gz RPLUSXQYFLMAOO-UHFFFAOYSA-N -1 3 329.359 4.188 20 0 EIADHM Cc1ccc([O-])c(NC(=O)c2ccc(-c3ccc4[nH]ccc4c3)cc2)n1 ZINC001195867936 1053510274 /nfs/dbraw/zinc/51/02/74/1053510274.db2.gz GYTNVFDETZSCBF-UHFFFAOYSA-N -1 3 343.386 4.496 20 0 EIADHM O=C(NCc1cc(-c2ccccc2)no1)c1cc([O-])c2ccccc2c1 ZINC000471751314 1053701659 /nfs/dbraw/zinc/70/16/59/1053701659.db2.gz YPMUBABSVHTFFF-UHFFFAOYSA-N -1 3 344.370 4.130 20 0 EIADHM [O-]c1cccc(F)c1NC(=S)Nc1ccc(Br)cc1 ZINC001196622018 1053715823 /nfs/dbraw/zinc/71/58/23/1053715823.db2.gz PGBAZCCJJBLMOZ-UHFFFAOYSA-N -1 3 341.205 4.103 20 0 EIADHM [O-]c1ccc(NC(=S)Nc2ccc(F)cc2)cc1Br ZINC001196942296 1053810795 /nfs/dbraw/zinc/81/07/95/1053810795.db2.gz YVHHVGJHWRMPHN-UHFFFAOYSA-N -1 3 341.205 4.103 20 0 EIADHM [O-]c1cccc(F)c1NC(=S)Nc1cccc(Br)c1 ZINC001197002156 1053820015 /nfs/dbraw/zinc/82/00/15/1053820015.db2.gz JGQWBPYKSAKRDQ-UHFFFAOYSA-N -1 3 341.205 4.103 20 0 EIADHM CC(=O)c1ccc(C(=O)N2CCCSc3cc(C)ccc32)cc1[O-] ZINC000854515194 1053823005 /nfs/dbraw/zinc/82/30/05/1053823005.db2.gz KIEJZTYDXXHEMJ-UHFFFAOYSA-N -1 3 341.432 4.046 20 0 EIADHM C[C@H](c1cccc(F)c1)N1CCN(Cc2ccc([O-])c(Cl)c2)CC1 ZINC001197069513 1053832099 /nfs/dbraw/zinc/83/20/99/1053832099.db2.gz JGDFGOITSVDSPL-CQSZACIVSA-N -1 3 348.849 4.064 20 0 EIADHM O=C(CCC1CCCCC1)[N-]OCc1ncc(Cl)cc1Cl ZINC000776832736 1053975082 /nfs/dbraw/zinc/97/50/82/1053975082.db2.gz IZOWPRHYFBIIJQ-UHFFFAOYSA-N -1 3 331.243 4.297 20 0 EIADHM CCCOc1ccc(S(=O)(=O)[N-]c2ccccc2C(C)C)cc1 ZINC000029046409 1053988821 /nfs/dbraw/zinc/98/88/21/1053988821.db2.gz XEGKVADHUOMDBC-UHFFFAOYSA-N -1 3 333.453 4.400 20 0 EIADHM COc1cnc(C(=O)[N-]c2ccccc2SC(C)(C)C)c(F)c1 ZINC001197817867 1054007063 /nfs/dbraw/zinc/00/70/63/1054007063.db2.gz YWUBUNWZTCUGMY-UHFFFAOYSA-N -1 3 334.416 4.372 20 0 EIADHM CCCCCC[C@H](CC)CN(C)C(=O)c1cc(=O)[n-]c(C2CC2)n1 ZINC000856300417 1054053678 /nfs/dbraw/zinc/05/36/78/1054053678.db2.gz OGVVLFTVEGZCQR-AWEZNQCLSA-N -1 3 333.476 4.128 20 0 EIADHM [O-]c1cc(NC(=S)Nc2ccccc2OC(F)(F)F)ccc1F ZINC001198163477 1054087829 /nfs/dbraw/zinc/08/78/29/1054087829.db2.gz VAHGIRSCGPSASH-UHFFFAOYSA-N -1 3 346.305 4.239 20 0 EIADHM [O-]c1cccnc1NC(=S)Nc1cc(C(F)(F)F)ccc1Cl ZINC001198201367 1054092399 /nfs/dbraw/zinc/09/23/99/1054092399.db2.gz UAIYJFYUYQMBMV-UHFFFAOYSA-N -1 3 347.749 4.268 20 0 EIADHM CC[C@@H](NC(=O)c1cc(=O)c2ccccc2[n-]1)c1ccc(Cl)cc1 ZINC000041866374 1054153747 /nfs/dbraw/zinc/15/37/47/1054153747.db2.gz NUZYMAOKNPEZGA-OAHLLOKOSA-N -1 3 340.810 4.063 20 0 EIADHM C[C@@H]1CN(C(=O)c2cc([O-])c3ccccc3c2)C[C@@H](c2ccccc2)O1 ZINC000471878100 1054192241 /nfs/dbraw/zinc/19/22/41/1054192241.db2.gz WMPDCRGIXVGIDI-VFNWGFHPSA-N -1 3 347.414 4.148 20 0 EIADHM CCn1ncc2ccc(NC(=O)c3cc([O-])c4ccccc4c3)cc21 ZINC000471933029 1054204044 /nfs/dbraw/zinc/20/40/44/1054204044.db2.gz PZOPSBBELWBJJN-UHFFFAOYSA-N -1 3 331.375 4.167 20 0 EIADHM CN(C(=O)c1cc([O-])c2ccccc2c1)[C@@H]1CCc2ccccc2C1 ZINC000472151877 1054215883 /nfs/dbraw/zinc/21/58/83/1054215883.db2.gz HBOSGIOKHCTVAB-LJQANCHMSA-N -1 3 331.415 4.175 20 0 EIADHM Cc1cc2cc[nH]c2c(C(=O)Nc2cc(Br)ccc2[O-])c1 ZINC001198696861 1054227196 /nfs/dbraw/zinc/22/71/96/1054227196.db2.gz PZRHZSKDDOPJAD-UHFFFAOYSA-N -1 3 345.196 4.197 20 0 EIADHM CCC(CC)c1cc(CNC(=O)c2cc([O-])c3ccccc3c2)on1 ZINC000472215651 1054254380 /nfs/dbraw/zinc/25/43/80/1054254380.db2.gz ZBNGUOVJGUNPEG-UHFFFAOYSA-N -1 3 338.407 4.367 20 0 EIADHM O=C([N-]Cc1ccc(O)cc1)C(F)(F)c1cc(Cl)ccc1Cl ZINC000857472413 1054266758 /nfs/dbraw/zinc/26/67/58/1054266758.db2.gz UDXRGBIULXSDKR-UHFFFAOYSA-N -1 3 346.160 4.107 20 0 EIADHM C[C@H](c1cc2ccccc2o1)N(C)C(=O)c1cc(=O)c2ccccc2[n-]1 ZINC000044066996 1054276551 /nfs/dbraw/zinc/27/65/51/1054276551.db2.gz ACDIYDUDMPGGFZ-CYBMUJFWSA-N -1 3 346.386 4.108 20 0 EIADHM C[C@@H](c1cc2ccccc2o1)N(C)C(=O)c1cc(=O)c2ccccc2[n-]1 ZINC000044066994 1054277345 /nfs/dbraw/zinc/27/73/45/1054277345.db2.gz ACDIYDUDMPGGFZ-ZDUSSCGKSA-N -1 3 346.386 4.108 20 0 EIADHM CC[C@H](C)C(=O)Nc1cccc(CN[C@H](C)c2cccc([O-])c2F)c1 ZINC000872046646 1054359723 /nfs/dbraw/zinc/35/97/23/1054359723.db2.gz KBNUICLKLJPUEH-UONOGXRCSA-N -1 3 344.430 4.367 20 0 EIADHM C[C@@H](N[C@H](C)c1cccc([O-])c1F)c1ccc(Br)cn1 ZINC000872067686 1054375229 /nfs/dbraw/zinc/37/52/29/1054375229.db2.gz BKCQEWDVLMPXPG-NXEZZACHSA-N -1 3 339.208 4.101 20 0 EIADHM C[C@@H](N[C@@H](C)c1cccc([O-])c1F)c1nc(C(F)(F)F)cs1 ZINC000872067113 1054375383 /nfs/dbraw/zinc/37/53/83/1054375383.db2.gz OIRLPHZSJBWKGY-JGVFFNPUSA-N -1 3 334.338 4.418 20 0 EIADHM COc1cc(N[C@@H](C)c2cccc([O-])c2F)ccc1OC(F)F ZINC000872088411 1054385703 /nfs/dbraw/zinc/38/57/03/1054385703.db2.gz OAWVNXDSAGNTIH-VIFPVBQESA-N -1 3 327.302 4.314 20 0 EIADHM O=C([O-])c1csc(CN2CCC[C@@H](c3ccc(F)c(F)c3)C2)c1 ZINC000872160791 1054414177 /nfs/dbraw/zinc/41/41/77/1054414177.db2.gz KKHHDMQZYHWRRG-GFCCVEGCSA-N -1 3 337.391 4.104 20 0 EIADHM Cc1nc(C2CCN([C@@H](C)c3ccc(F)cc3)CC2)sc1C(=O)[O-] ZINC000872165045 1054416639 /nfs/dbraw/zinc/41/66/39/1054416639.db2.gz NROPTXRSWRUVRD-LBPRGKRZSA-N -1 3 348.443 4.229 20 0 EIADHM Cc1nc(C2CCN(C/C=C\c3ccccc3)CC2)sc1C(=O)[O-] ZINC000872165558 1054418842 /nfs/dbraw/zinc/41/88/42/1054418842.db2.gz YDLYDDYTHPIGEW-YVMONPNESA-N -1 3 342.464 4.043 20 0 EIADHM C[C@@H](NCc1cc(C(=O)[O-])cs1)c1ccccc1C(F)(F)F ZINC000902314217 1054777857 /nfs/dbraw/zinc/77/78/57/1054777857.db2.gz ZNBHSDQDHMTUQU-SECBINFHSA-N -1 3 329.343 4.316 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1cc(Br)ccc1F ZINC000067145534 1055028230 /nfs/dbraw/zinc/02/82/30/1055028230.db2.gz RKTHDLNFIXVIDD-UHFFFAOYSA-N -1 3 344.567 4.200 20 0 EIADHM COc1ccccc1NC(=O)Nc1ccc(C(F)(F)F)cc1[O-] ZINC001202127198 1055041790 /nfs/dbraw/zinc/04/17/90/1055041790.db2.gz KMGGMCHCVQCQRR-UHFFFAOYSA-N -1 3 326.274 4.064 20 0 EIADHM [O-]c1ccc(F)c(CNCc2ccccc2CC(F)(F)F)c1F ZINC000862547882 1055081695 /nfs/dbraw/zinc/08/16/95/1055081695.db2.gz RXDOVCAXRYUDBE-UHFFFAOYSA-N -1 3 331.284 4.065 20 0 EIADHM CCC(F)(F)C(C)(C)C[N-]C(=O)C(F)(F)c1c(F)cccc1F ZINC000862944828 1055128613 /nfs/dbraw/zinc/12/86/13/1055128613.db2.gz BUJIMGPHEJAYGQ-UHFFFAOYSA-N -1 3 341.295 4.244 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1ccn(-c2ccccc2Cl)n1 ZINC000065309083 1058227804 /nfs/dbraw/zinc/22/78/04/1058227804.db2.gz FSTGKQUMWASSRL-UHFFFAOYSA-N -1 3 348.189 4.137 20 0 EIADHM O=C(Nc1ncccc1[O-])c1cc(-c2cccs2)nc2ccccc21 ZINC000743805568 1059121210 /nfs/dbraw/zinc/12/12/10/1059121210.db2.gz HDJGMIDHEZFKGZ-UHFFFAOYSA-N -1 3 347.399 4.316 20 0 EIADHM Cc1cccc([C@H](C)C(=O)Oc2cccc(-c3nc(C)cc(=O)[n-]3)c2)c1 ZINC000744217954 1059334428 /nfs/dbraw/zinc/33/44/28/1059334428.db2.gz GHGOLFBWWCNVDI-HNNXBMFYSA-N -1 3 348.402 4.175 20 0 EIADHM Cc1cccc(CCC(=O)Oc2cccc(-c3nc(C)cc(=O)[n-]3)c2)c1 ZINC000744219411 1059334464 /nfs/dbraw/zinc/33/44/64/1059334464.db2.gz RKFKUXCTIIHAFV-UHFFFAOYSA-N -1 3 348.402 4.004 20 0 EIADHM Cc1cc(=O)[n-]c(-c2cccc(OC(=O)C(C)(C)c3ccccc3)c2)n1 ZINC000744217285 1059334753 /nfs/dbraw/zinc/33/47/53/1059334753.db2.gz QQLWHSUUEXSSCI-UHFFFAOYSA-N -1 3 348.402 4.041 20 0 EIADHM CC(C)CCc1nc(COC(=O)c2cc(-c3ccco3)[n-]n2)cs1 ZINC000744662838 1059604956 /nfs/dbraw/zinc/60/49/56/1059604956.db2.gz HGQQQVKZNPDIIC-UHFFFAOYSA-N -1 3 345.424 4.072 20 0 EIADHM CC(C)CCc1nc(COC(=O)c2cc(-c3ccco3)n[n-]2)cs1 ZINC000744662838 1059604992 /nfs/dbraw/zinc/60/49/92/1059604992.db2.gz HGQQQVKZNPDIIC-UHFFFAOYSA-N -1 3 345.424 4.072 20 0 EIADHM C[C@@H](OC(=O)c1ccc([O-])cc1)c1nnc(-c2cccc(Cl)c2)o1 ZINC000745889880 1059910848 /nfs/dbraw/zinc/91/08/48/1059910848.db2.gz XRHGCIXTHIKWQG-SNVBAGLBSA-N -1 3 344.754 4.014 20 0 EIADHM O=C(CCc1cccc(C(F)(F)F)c1)[N-]OCc1ccc(F)cc1 ZINC000766457009 1060365282 /nfs/dbraw/zinc/36/52/82/1060365282.db2.gz UUHGBWIZMGXKBR-UHFFFAOYSA-N -1 3 341.304 4.025 20 0 EIADHM CCc1cc(=O)[n-]c(CN2CCC[C@H]2c2ccc(C(C)C)cc2)n1 ZINC001168919163 1060521927 /nfs/dbraw/zinc/52/19/27/1060521927.db2.gz WVPVUCCBDGKCKK-SFHVURJKSA-N -1 3 325.456 4.205 20 0 EIADHM COc1cccc(-n2ncc(C)c2Nc2ccc(Cl)c([O-])c2)c1 ZINC001212590373 1060826758 /nfs/dbraw/zinc/82/67/58/1060826758.db2.gz JMCUTMPJZQHPPB-UHFFFAOYSA-N -1 3 329.787 4.292 20 0 EIADHM O=C(c1ccc(Nc2ccc(Cl)c([O-])c2)cc1)N1CCCCC1 ZINC001212592192 1060880605 /nfs/dbraw/zinc/88/06/05/1060880605.db2.gz CTPYORXFQZWZAU-UHFFFAOYSA-N -1 3 330.815 4.415 20 0 EIADHM CC(C)(C)OC(=O)c1ccc(Nc2ccc(Cl)c([O-])c2)cc1O ZINC001212594203 1060927585 /nfs/dbraw/zinc/92/75/85/1060927585.db2.gz UOUKSWXCBLATKW-UHFFFAOYSA-N -1 3 335.787 4.450 20 0 EIADHM COc1cc(CNc2ccc(F)cc2F)cc(Br)c1[O-] ZINC000019951744 212089297 /nfs/dbraw/zinc/08/92/97/212089297.db2.gz NJRNPTVLJNHZPS-UHFFFAOYSA-N -1 3 344.155 4.054 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2ccc(OC(C)C)cc2C)cc1F ZINC000614863629 1032102909 /nfs/dbraw/zinc/10/29/09/1032102909.db2.gz MUQYDYAFSFWXNY-UHFFFAOYSA-N -1 3 337.416 4.031 20 0 EIADHM CCCc1cc(=O)[n-]c(C(=Cc2cccc(OC(F)F)c2)CC)n1 ZINC000193618528 1032165782 /nfs/dbraw/zinc/16/57/82/1032165782.db2.gz BCOMTYPWBSEXOE-UKTHLTGXSA-N -1 3 334.366 4.274 20 0 EIADHM O=C(Cc1ccc([O-])c(F)c1)N(Cc1ccoc1)C1CCCCC1 ZINC000449987697 1032195080 /nfs/dbraw/zinc/19/50/80/1032195080.db2.gz QYTVAUIPGQFNPN-UHFFFAOYSA-N -1 3 331.387 4.028 20 0 EIADHM C[C@H](CC(=O)Nc1ccc(Cl)cc1[O-])C(=O)c1cccc(F)c1 ZINC000533159265 1032515065 /nfs/dbraw/zinc/51/50/65/1032515065.db2.gz QZKLCZCMWXJPIL-SNVBAGLBSA-N -1 3 335.762 4.032 20 0 EIADHM CCC(C)(C)c1ccc(S(=O)(=O)[N-]c2cccc(F)c2F)cc1 ZINC000467084123 1032556162 /nfs/dbraw/zinc/55/61/62/1032556162.db2.gz WXQPXACNGBGCDR-UHFFFAOYSA-N -1 3 339.407 4.453 20 0 EIADHM O=C(c1cc(Oc2ccccc2)ccc1[O-])N1CC[C@@]2(CC2(F)F)C1 ZINC000653003856 1032575920 /nfs/dbraw/zinc/57/59/20/1032575920.db2.gz GBSGWPABSSBEBC-GOSISDBHSA-N -1 3 345.345 4.056 20 0 EIADHM COc1cc(C)c(S(=O)(=O)[N-]c2ccc(C)cc2C)cc1Cl ZINC000432765458 1032728317 /nfs/dbraw/zinc/72/83/17/1032728317.db2.gz ZAPSSBUGYJYYGF-UHFFFAOYSA-N -1 3 339.844 4.075 20 0 EIADHM CSc1cc(O)ccc1[N-]C(=O)c1cc(-c2ccccc2F)on1 ZINC000683123421 1018867419 /nfs/dbraw/zinc/86/74/19/1018867419.db2.gz RSCKFVOFYGRFBV-UHFFFAOYSA-N -1 3 344.367 4.161 20 0 EIADHM C[C@H](CCCCC(=O)[O-])NCc1c(Cl)cccc1OC(F)F ZINC000683176090 1019101974 /nfs/dbraw/zinc/10/19/74/1019101974.db2.gz GDNZJJPOOHCDRL-SNVBAGLBSA-N -1 3 335.778 4.065 20 0 EIADHM CCSCc1cccc([N-]S(=O)(=O)c2ccc(C)cc2C)c1 ZINC000610193785 1019208770 /nfs/dbraw/zinc/20/87/70/1019208770.db2.gz HOIHXKVOVCUMNJ-UHFFFAOYSA-N -1 3 335.494 4.357 20 0 EIADHM CC(C)c1nnc([N-]C(=O)c2ccc(-c3ccc(F)cc3)o2)s1 ZINC000026571215 1019639417 /nfs/dbraw/zinc/63/94/17/1019639417.db2.gz MPHMFCZCFWJDHZ-UHFFFAOYSA-N -1 3 331.372 4.313 20 0 EIADHM Cc1sc2[n-]c(-c3ccco3)nc(=O)c2c1-c1ccc(F)cc1 ZINC000047682031 1020314838 /nfs/dbraw/zinc/31/48/38/1020314838.db2.gz CSVMLLGNGBLUFA-UHFFFAOYSA-N -1 3 326.352 4.359 20 0 EIADHM CCOc1cc(CNc2cc(OC)ccc2OC)cc(Cl)c1[O-] ZINC000076275231 1020391628 /nfs/dbraw/zinc/39/16/28/1020391628.db2.gz ISTXUIAQGXBHEB-UHFFFAOYSA-N -1 3 337.803 4.074 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1csc(Br)c1 ZINC000067145471 1020411118 /nfs/dbraw/zinc/41/11/18/1020411118.db2.gz SOFKPZJNJGDWOK-UHFFFAOYSA-N -1 3 332.606 4.122 20 0 EIADHM CCCc1ncc(C(=O)[N-]c2c(F)ccc(OCC)c2F)s1 ZINC000340431300 1021014495 /nfs/dbraw/zinc/01/44/95/1021014495.db2.gz PNKCYHATPYNVFI-UHFFFAOYSA-N -1 3 326.368 4.025 20 0 EIADHM CC(C)c1ccc(-c2nc(CN3CC[C@H](C(=O)[O-])[C@H]3C)cs2)cc1 ZINC000579968014 1021039283 /nfs/dbraw/zinc/03/92/83/1021039283.db2.gz DEKNFUUPSUTQGM-DYVFJYSZSA-N -1 3 344.480 4.229 20 0 EIADHM [O-]c1ccc(Cl)cc1/C=N/C[C@H](O)c1ccccc1C(F)(F)F ZINC000065999062 1021179978 /nfs/dbraw/zinc/17/99/78/1021179978.db2.gz SLIGDLMGAAXVFE-SJTXTDJHSA-N -1 3 343.732 4.217 20 0 EIADHM Cc1nc(C(=O)[N-]c2c(F)cc(Br)cc2F)sc1C ZINC000683744142 1021267512 /nfs/dbraw/zinc/26/75/12/1021267512.db2.gz VKNALPIXFDWVJQ-UHFFFAOYSA-N -1 3 347.184 4.053 20 0 EIADHM COc1ccc([O-])c(C(=O)N2Cc3ccccc3-c3ccccc32)c1 ZINC000612665827 1021268012 /nfs/dbraw/zinc/26/80/12/1021268012.db2.gz UIVZSUVCPIMRAL-UHFFFAOYSA-N -1 3 331.371 4.228 20 0 EIADHM O=C(N[C@H]1CC[C@H](Cc2ccccc2)C1)c1cc(=O)c2ccccc2[n-]1 ZINC000275752268 1021503967 /nfs/dbraw/zinc/50/39/67/1021503967.db2.gz CYDXNMMCRNFMFE-SJORKVTESA-N -1 3 346.430 4.082 20 0 EIADHM Cc1nc(-c2ccc(NC(=O)N(C)[C@H](C)C(C)(C)C)cc2)cc(=O)[n-]1 ZINC000613041768 1021655033 /nfs/dbraw/zinc/65/50/33/1021655033.db2.gz ZIRHSHJTDMBDCE-GFCCVEGCSA-N -1 3 342.443 4.056 20 0 EIADHM COc1cc(NCc2cc(=O)[n-]c(C3CC3)n2)c(C2CC2)cc1Cl ZINC000656126360 1021709794 /nfs/dbraw/zinc/70/97/94/1021709794.db2.gz RCJVKKOGTBBWLD-UHFFFAOYSA-N -1 3 345.830 4.211 20 0 EIADHM Cc1cc2c(o1)CC(C)(C)C[C@@H]2NC(=O)c1cc([O-])ccc1Cl ZINC000431742356 1021728488 /nfs/dbraw/zinc/72/84/88/1021728488.db2.gz UCMTXFRRVMEIBK-HNNXBMFYSA-N -1 3 333.815 4.391 20 0 EIADHM Cc1c(Br)ccc(N)c1Nc1cccc([O-])c1Cl ZINC001210854607 1021805850 /nfs/dbraw/zinc/80/58/50/1021805850.db2.gz HQHQTGJWBFYJEG-UHFFFAOYSA-N -1 3 327.609 4.442 20 0 EIADHM CCOC(=O)c1nc(Cl)sc1Nc1cccc([O-])c1Cl ZINC001210855790 1021808436 /nfs/dbraw/zinc/80/84/36/1021808436.db2.gz XVHJOVGYDRFUEB-UHFFFAOYSA-N -1 3 333.196 4.076 20 0 EIADHM Cc1cc(F)c(C(=O)[N-]c2nc(-c3ccsc3)ns2)cc1F ZINC000129678923 1021947107 /nfs/dbraw/zinc/94/71/07/1021947107.db2.gz ROMZYDHZRBYYBI-UHFFFAOYSA-N -1 3 337.376 4.106 20 0 EIADHM CC(C)(NCc1nc(-c2cc(Cl)ccc2Cl)cs1)C(=O)[O-] ZINC000340683423 1021972617 /nfs/dbraw/zinc/97/26/17/1021972617.db2.gz VVKQVSXCFFDECU-UHFFFAOYSA-N -1 3 345.251 4.070 20 0 EIADHM Cc1cc(O[C@H](C)C(=O)Nc2c([O-])cccc2Cl)ccc1Cl ZINC000580424789 1022013722 /nfs/dbraw/zinc/01/37/22/1022013722.db2.gz YQITZPHIULCYIG-SNVBAGLBSA-N -1 3 340.206 4.413 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N(CC)Cc3ccccc3C)nc2)n1 ZINC000685911833 1022558104 /nfs/dbraw/zinc/55/81/04/1022558104.db2.gz SNCBLKGLSUVIFM-UHFFFAOYSA-N -1 3 348.450 4.142 20 0 EIADHM CCCCCC[C@](C)(CCC)C(=O)N1CCCc2c(=O)[n-]cnc21 ZINC000893215526 1022765963 /nfs/dbraw/zinc/76/59/63/1022765963.db2.gz HWZOJAOKXTZMIR-IBGZPJMESA-N -1 3 333.476 4.238 20 0 EIADHM CC(C)c1ccc(C(=O)N2CCCC[C@@H]2[C@H]2CCCC[C@@H]2O)c([O-])c1 ZINC000647648035 1023097559 /nfs/dbraw/zinc/09/75/59/1023097559.db2.gz PFOLYHMZXMSXKA-QRQLOZEOSA-N -1 3 345.483 4.061 20 0 EIADHM CCCN(Cc1ccccc1)C(=O)CCCc1ccc([O-])c(F)c1 ZINC000468538595 1023106175 /nfs/dbraw/zinc/10/61/75/1023106175.db2.gz XHUKQGFCNFRWGI-UHFFFAOYSA-N -1 3 329.415 4.293 20 0 EIADHM [O-]C(=Cc1nc(-c2cccc(Cl)c2)no1)c1ccccc1Cl ZINC001211646840 1023204250 /nfs/dbraw/zinc/20/42/50/1023204250.db2.gz AYBWOVVEVZIUNG-UHFFFAOYSA-N -1 3 333.174 4.469 20 0 EIADHM O=C([O-])c1cccc(CN2CCC[C@@H]2Cc2c(F)cccc2Cl)c1 ZINC000414642750 1023308615 /nfs/dbraw/zinc/30/86/15/1023308615.db2.gz WGUZFASOCGHPDO-OAHLLOKOSA-N -1 3 347.817 4.384 20 0 EIADHM CC(C)=CCSC[C@H](NCc1ccc(Cl)cc1Cl)C(=O)[O-] ZINC000417621851 1023377247 /nfs/dbraw/zinc/37/72/47/1023377247.db2.gz GMZNAKFXZDKPQD-AWEZNQCLSA-N -1 3 348.295 4.236 20 0 EIADHM CC(C)(C)c1ccc(-c2ccc(CN[C@@H]3C=C[C@@H](C(=O)[O-])C3)o2)cc1 ZINC000417613059 1023378277 /nfs/dbraw/zinc/37/82/77/1023378277.db2.gz CHXUNOOHDKMIBG-NVXWUHKLSA-N -1 3 339.435 4.363 20 0 EIADHM O=C([O-])[C@H]1C[C@H](NCc2cscc2C(F)(F)F)c2ccccc21 ZINC000417626042 1023386312 /nfs/dbraw/zinc/38/63/12/1023386312.db2.gz MNUDYOFJKVKBLS-JSGCOSHPSA-N -1 3 341.354 4.170 20 0 EIADHM O=C([O-])[C@@H](NCc1cc2ccccc2o1)C(C1CCC1)C1CCC1 ZINC000417645339 1023388745 /nfs/dbraw/zinc/38/87/45/1023388745.db2.gz DCVDHZCVLGFBBJ-IBGZPJMESA-N -1 3 327.424 4.192 20 0 EIADHM CCC[C@@H](CCCCNCc1nc2c(s1)C[C@H](C)CC2)C(=O)[O-] ZINC000417641414 1023393858 /nfs/dbraw/zinc/39/38/58/1023393858.db2.gz PXDXVIBRMRSLGZ-KGLIPLIRSA-N -1 3 338.517 4.029 20 0 EIADHM CC[C@@H](C)C[C@@H](C)NC(=O)Nc1ccc(-c2cc(=O)[n-]c(C)n2)cc1 ZINC000341238627 1023425447 /nfs/dbraw/zinc/42/54/47/1023425447.db2.gz AROPHYLVZVVLFH-CHWSQXEVSA-N -1 3 342.443 4.104 20 0 EIADHM O=C(Nc1ccc(Br)cc1[O-])c1cc2ccccc2o1 ZINC000642323014 1023993083 /nfs/dbraw/zinc/99/30/83/1023993083.db2.gz GKVPBSFWRVUWJN-UHFFFAOYSA-N -1 3 332.153 4.153 20 0 EIADHM C[C@H]1CCN(Cc2c(Br)cccc2C(=O)[O-])CC1(C)C ZINC000652443666 1024836755 /nfs/dbraw/zinc/83/67/55/1024836755.db2.gz OQXWOZMGTHHBFU-NSHDSACASA-N -1 3 340.261 4.015 20 0 EIADHM C[C@@H](c1cccs1)N(C)C(=O)c1c[n-]c2c(Cl)cccc2c1=O ZINC000341873873 1024845276 /nfs/dbraw/zinc/84/52/76/1024845276.db2.gz HPFCDVXZTQFZSJ-JTQLQIEISA-N -1 3 346.839 4.076 20 0 EIADHM C[C@H](CC1CCCCC1)[N-]S(=O)(=O)c1cc(F)ccc1Cl ZINC001211684187 1024859199 /nfs/dbraw/zinc/85/91/99/1024859199.db2.gz ZMYWFOQDDAKVKS-LLVKDONJSA-N -1 3 333.856 4.116 20 0 EIADHM CN(CCCOc1ccc(Cl)cc1)Cc1ccsc1C(=O)[O-] ZINC000582008446 1024863246 /nfs/dbraw/zinc/86/32/46/1024863246.db2.gz NJGGVDHNKDPPNH-UHFFFAOYSA-N -1 3 339.844 4.001 20 0 EIADHM [O-]c1c(Cl)cc(Cl)cc1/C=N/[C@H]1CCN(Cc2ccccc2)C1 ZINC000022768600 1024933473 /nfs/dbraw/zinc/93/34/73/1024933473.db2.gz PWENJJIROCZNFV-CTJICSLTSA-N -1 3 349.261 4.392 20 0 EIADHM C[C@@H]([N-]c1nc(-c2ccccc2)no1)c1ccc(Br)cn1 ZINC000684600597 1024962945 /nfs/dbraw/zinc/96/29/45/1024962945.db2.gz VOKAXKKBEYBYLH-SNVBAGLBSA-N -1 3 345.200 4.067 20 0 EIADHM COc1cccc([C@@H](CC(=O)[O-])NCc2cccc(C(C)C)c2)c1 ZINC000663259833 1024965388 /nfs/dbraw/zinc/96/53/88/1024965388.db2.gz JLVLCUKWTCKEQA-LJQANCHMSA-N -1 3 327.424 4.124 20 0 EIADHM O=C([O-])CC[C@@H](CNCc1ccc(-c2ccccc2)o1)C(F)(F)F ZINC000663263041 1024967194 /nfs/dbraw/zinc/96/71/94/1024967194.db2.gz XVDUQNWHUCBQLS-ZDUSSCGKSA-N -1 3 341.329 4.080 20 0 EIADHM O=C([N-]c1cc(Cl)c(Cl)cc1F)c1ncoc1[C@H]1CCCO1 ZINC000341960164 1025010562 /nfs/dbraw/zinc/01/05/62/1025010562.db2.gz JCYWUWCZKMQHGQ-LLVKDONJSA-N -1 3 345.157 4.224 20 0 EIADHM C[C@@H](/N=C/c1cc(Cl)ccc1[O-])c1cccc(N2CCOC2=O)c1 ZINC000068653391 1025261149 /nfs/dbraw/zinc/26/11/49/1025261149.db2.gz UMXFKZONYBDNMT-ZICWZVMQSA-N -1 3 344.798 4.182 20 0 EIADHM CC[C@@H](c1ccc(Cl)cc1)N1CC[C@](C(=O)[O-])(C(F)(F)F)C1 ZINC000315815571 1025782015 /nfs/dbraw/zinc/78/20/15/1025782015.db2.gz DZWILUMNJSBZOX-JSGCOSHPSA-N -1 3 335.753 4.130 20 0 EIADHM O=C(Nc1cccc(-c2nccs2)c1)c1cc([O-])ccc1Cl ZINC000431329395 1025873229 /nfs/dbraw/zinc/87/32/29/1025873229.db2.gz RLFPDCWTQRSDQH-UHFFFAOYSA-N -1 3 330.796 4.421 20 0 EIADHM CC[C@@H]([N-]C(=O)C(F)(F)c1cccc(Cl)c1)c1nc(C)cs1 ZINC000729447552 1025881856 /nfs/dbraw/zinc/88/18/56/1025881856.db2.gz CTKUEWLJBGQCJC-GFCCVEGCSA-N -1 3 344.814 4.464 20 0 EIADHM [O-]c1ccc(F)c(CNCc2ccc(OC3CCCC3)cc2)c1F ZINC000512098719 1025986586 /nfs/dbraw/zinc/98/65/86/1025986586.db2.gz KPJMDAHJNTVFNJ-UHFFFAOYSA-N -1 3 333.378 4.282 20 0 EIADHM Cc1csc(CCCCNC(=O)c2cc([O-])c3ccccc3c2)n1 ZINC000349505463 1026345183 /nfs/dbraw/zinc/34/51/83/1026345183.db2.gz KKYBSFNLAGNYFG-UHFFFAOYSA-N -1 3 340.448 4.063 20 0 EIADHM CC(C)c1ccc(C(=O)N[C@H](c2ccccc2)[C@H](O)C(C)C)c([O-])c1 ZINC001167866314 1026346179 /nfs/dbraw/zinc/34/61/79/1026346179.db2.gz NWPXYNQNQGDXHS-WOJBJXKFSA-N -1 3 341.451 4.004 20 0 EIADHM Cc1ccc(C(=O)Nc2c(-c3ccccc3)nc3ccccn32)c([O-])c1 ZINC000582233202 1026357734 /nfs/dbraw/zinc/35/77/34/1026357734.db2.gz MEEOLPDKNJWLFU-UHFFFAOYSA-N -1 3 343.386 4.268 20 0 EIADHM [O-]c1ccc(CNc2ccc3c(c2)CN(CC(F)(F)F)C3)cc1F ZINC000894815520 1026468955 /nfs/dbraw/zinc/46/89/55/1026468955.db2.gz OAQAXOHPIAXJQN-UHFFFAOYSA-N -1 3 340.320 4.021 20 0 EIADHM O=C([O-])[C@@H](NCc1cc(Cl)cc(C(F)(F)F)c1)c1ccccc1 ZINC000426763554 1026529779 /nfs/dbraw/zinc/52/97/79/1026529779.db2.gz CHNKDTNHHDNAGI-AWEZNQCLSA-N -1 3 343.732 4.274 20 0 EIADHM O=C([O-])C[C@@H](NCc1ccc2ncccc2c1)c1cccc(Cl)c1 ZINC000426803756 1026571847 /nfs/dbraw/zinc/57/18/47/1026571847.db2.gz PBMSUCNZHIQREQ-GOSISDBHSA-N -1 3 340.810 4.194 20 0 EIADHM Cc1cc([C@H](NCc2cccc(OC(C)C)c2)C(=O)[O-])ccc1Cl ZINC000426824815 1026582837 /nfs/dbraw/zinc/58/28/37/1026582837.db2.gz ODVHFFQKCIMBDP-SFHVURJKSA-N -1 3 347.842 4.351 20 0 EIADHM Cc1cc2[nH]c(CN[C@@H](CC(=O)[O-])c3ccc(F)cc3)cc2c(C)c1 ZINC000426835163 1026594290 /nfs/dbraw/zinc/59/42/90/1026594290.db2.gz QFSJZHOVAWDOBU-SFHVURJKSA-N -1 3 340.398 4.229 20 0 EIADHM CCCCN(CCCC)c1ccc(-c2nc(CC)cc(=O)[n-]2)cn1 ZINC000426880845 1026607911 /nfs/dbraw/zinc/60/79/11/1026607911.db2.gz BJSZGQJZNITSLR-UHFFFAOYSA-N -1 3 328.460 4.213 20 0 EIADHM [O-]c1cc(F)cc(CN[C@H]2COc3c2ccc(Cl)c3Cl)c1 ZINC000472074922 1026729746 /nfs/dbraw/zinc/72/97/46/1026729746.db2.gz SYFXRPGKGVADAV-ZDUSSCGKSA-N -1 3 328.170 4.061 20 0 EIADHM CCCOc1cccc(C=C(Cc2ccccc2)c2nccc(=O)[n-]2)c1 ZINC000432693808 1026783486 /nfs/dbraw/zinc/78/34/86/1026783486.db2.gz KHRBJQBJGPINHK-CYVLTUHYSA-N -1 3 346.430 4.342 20 0 EIADHM O=c1ccnc(C(=Cc2cc(Cl)ccc2F)Cc2ccccc2)[n-]1 ZINC000432696625 1026785483 /nfs/dbraw/zinc/78/54/83/1026785483.db2.gz UKXMJLYNBCODPI-PTNGSMBKSA-N -1 3 340.785 4.346 20 0 EIADHM O=c1ccnc(C(=Cc2cccc(Cl)c2F)Cc2ccccc2)[n-]1 ZINC000432706155 1026805926 /nfs/dbraw/zinc/80/59/26/1026805926.db2.gz KTYPYEKDCZVOHY-QINSGFPZSA-N -1 3 340.785 4.346 20 0 EIADHM CN(Cc1csc(Br)c1)Cc1c(F)ccc([O-])c1F ZINC000507660808 1026869330 /nfs/dbraw/zinc/86/93/30/1026869330.db2.gz PYTPHOKFFMPTQH-UHFFFAOYSA-N -1 3 348.212 4.126 20 0 EIADHM Cc1cccc([O-])c1C(=O)N1CCC(=Cc2ccccc2F)CC1 ZINC000626065977 1026879170 /nfs/dbraw/zinc/87/91/70/1026879170.db2.gz TVOMSJVMNPBKFA-UHFFFAOYSA-N -1 3 325.383 4.159 20 0 EIADHM CN(Cc1cccc(C(F)(F)F)c1)[C@@H](C(=O)[O-])c1ccsc1 ZINC000582671421 1026922226 /nfs/dbraw/zinc/92/22/26/1026922226.db2.gz OMWYIAKULIMCLD-CYBMUJFWSA-N -1 3 329.343 4.025 20 0 EIADHM CCOCCOCc1cccc(NCc2ccc([O-])c(F)c2)c1C ZINC000892289694 1027034148 /nfs/dbraw/zinc/03/41/48/1027034148.db2.gz FOXSLGUSLQVDEL-UHFFFAOYSA-N -1 3 333.403 4.005 20 0 EIADHM O=C(Nc1cccc([O-])c1F)c1cc(Cl)cc(C(F)(F)F)c1 ZINC000133657535 1027130637 /nfs/dbraw/zinc/13/06/37/1027130637.db2.gz GRXUOVZAIKCZRH-UHFFFAOYSA-N -1 3 333.668 4.456 20 0 EIADHM O=C(Nc1ccc([O-])c(C(F)(F)F)c1)[C@@H]1CCCc2ccccc21 ZINC000440983698 1027160821 /nfs/dbraw/zinc/16/08/21/1027160821.db2.gz QRGSEAPCQPVXLM-CQSZACIVSA-N -1 3 335.325 4.470 20 0 EIADHM CCSc1ccc(C(=O)Nc2ccc([O-])c(C(F)(F)F)c2)cn1 ZINC000441005727 1027186151 /nfs/dbraw/zinc/18/61/51/1027186151.db2.gz GHLKEZWMWWKLPG-UHFFFAOYSA-N -1 3 342.342 4.170 20 0 EIADHM O=C(COc1ccc(Cl)cc1)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000441013673 1027189904 /nfs/dbraw/zinc/18/99/04/1027189904.db2.gz VDSTWYHYWQSDLU-UHFFFAOYSA-N -1 3 345.704 4.082 20 0 EIADHM Cc1cc2cccnc2c(NC(=O)CCCc2ccc([O-])c(F)c2)c1 ZINC000469820497 1027348655 /nfs/dbraw/zinc/34/86/55/1027348655.db2.gz NCFHUZSWIJSOTF-UHFFFAOYSA-N -1 3 338.382 4.349 20 0 EIADHM CCc1cccc(C(=O)N2CC[C@@H](C(F)(F)F)C(C)(C)C2)c1[O-] ZINC000520305268 1027706288 /nfs/dbraw/zinc/70/62/88/1027706288.db2.gz RKPWTJROIGJBFA-CYBMUJFWSA-N -1 3 329.362 4.005 20 0 EIADHM CSc1ccc([O-])c(C(=O)N2CCC(c3ccccc3)CC2)c1 ZINC000665879825 1027841696 /nfs/dbraw/zinc/84/16/96/1027841696.db2.gz ZWGHBUITWXNWRQ-UHFFFAOYSA-N -1 3 327.449 4.134 20 0 EIADHM COc1cccc(C(=O)Nc2ccc(OC(C)C)cc2Cl)c1[O-] ZINC000444515152 1027852747 /nfs/dbraw/zinc/85/27/47/1027852747.db2.gz SOHNBOHLIKSHNT-UHFFFAOYSA-N -1 3 335.787 4.094 20 0 EIADHM CCCCCc1nnc([N-]C(=O)c2csc(C(C)(C)C)n2)s1 ZINC000522484272 1027873529 /nfs/dbraw/zinc/87/35/29/1027873529.db2.gz AQPCBCPUPBKLAJ-UHFFFAOYSA-N -1 3 338.502 4.277 20 0 EIADHM CC(=O)c1cc(F)c([N-]C(=O)c2cc(F)c(F)cc2Cl)c(F)c1 ZINC000536312811 1027882574 /nfs/dbraw/zinc/88/25/74/1027882574.db2.gz XDGMWTALWHRNMU-UHFFFAOYSA-N -1 3 345.679 4.351 20 0 EIADHM COc1cc(Cl)c([N-]S(=O)(=O)c2ccccc2Cl)cc1C ZINC000520451372 1027988174 /nfs/dbraw/zinc/98/81/74/1027988174.db2.gz QWEKKTGKDGHPNZ-UHFFFAOYSA-N -1 3 346.235 4.111 20 0 EIADHM COc1ccc([O-])c(C(=O)N2C[C@H](C(C)(C)C)c3ccccc32)c1 ZINC000443865648 1028004630 /nfs/dbraw/zinc/00/46/30/1028004630.db2.gz DCVMYJVBNRWOMV-INIZCTEOSA-N -1 3 325.408 4.191 20 0 EIADHM Cc1ccc(C(=O)Nc2cccc(-c3cn4c(n3)CCCC4)c2)c([O-])c1 ZINC000108852316 1028208596 /nfs/dbraw/zinc/20/85/96/1028208596.db2.gz HHCLNUHTDBYZLU-UHFFFAOYSA-N -1 3 347.418 4.153 20 0 EIADHM O=C([O-])CC[C@H]1CCCCN1Cc1coc(-c2cccc(Cl)c2)n1 ZINC000324305146 1028242616 /nfs/dbraw/zinc/24/26/16/1028242616.db2.gz XGBRCZFJCGMBNC-MRXNPFEDSA-N -1 3 348.830 4.214 20 0 EIADHM Cc1cc(F)cc2c(=O)c(C(=O)Nc3ccc(F)c(Cl)c3)c[n-]c12 ZINC000155149702 1028361505 /nfs/dbraw/zinc/36/15/05/1028361505.db2.gz LCSSRJZVUCSORL-UHFFFAOYSA-N -1 3 348.736 4.020 20 0 EIADHM O=S(=O)([N-]c1ccc(Cl)cc1Cl)c1ccccc1Cl ZINC000016101644 1028476756 /nfs/dbraw/zinc/47/67/56/1028476756.db2.gz FKMQVCYUDRSPQI-UHFFFAOYSA-N -1 3 336.627 4.448 20 0 EIADHM Cc1c(Br)ccc(N)c1Nc1cc(F)c([O-])c(F)c1 ZINC001213381778 1028512440 /nfs/dbraw/zinc/51/24/40/1028512440.db2.gz GOIJSCLJSAQMLM-UHFFFAOYSA-N -1 3 329.144 4.067 20 0 EIADHM Cc1cc(=O)[n-]c(-c2cccc(OC(=O)CC3CCCCCC3)c2)n1 ZINC000079167773 1028892252 /nfs/dbraw/zinc/89/22/52/1028892252.db2.gz HDNZJZQSYKTKBT-UHFFFAOYSA-N -1 3 340.423 4.011 20 0 EIADHM O=C(Nc1c([O-])cccc1Cl)c1cc(Oc2ccccc2)ccn1 ZINC000583901124 1029345178 /nfs/dbraw/zinc/34/51/78/1029345178.db2.gz NSAYUODNSYFHNF-UHFFFAOYSA-N -1 3 340.766 4.485 20 0 EIADHM CCCO[C@H](C(=O)Nc1cccc([O-])c1F)c1ccc(F)cc1C ZINC000935136555 1029387380 /nfs/dbraw/zinc/38/73/80/1029387380.db2.gz COIINWYVTWELLU-KRWDZBQOSA-N -1 3 335.350 4.085 20 0 EIADHM C[C@H](C(=O)Nc1ccc(Br)cc1[O-])c1cccc(F)c1 ZINC000525161286 1029493377 /nfs/dbraw/zinc/49/33/77/1029493377.db2.gz YFGHWOCHDHZBAC-VIFPVBQESA-N -1 3 338.176 4.036 20 0 EIADHM Cc1oc(C(=O)[O-])cc1CN1CCC(CCc2ccc(C)cc2)CC1 ZINC000565101635 1029585675 /nfs/dbraw/zinc/58/56/75/1029585675.db2.gz RKACKXRYSGVDTJ-UHFFFAOYSA-N -1 3 341.451 4.439 20 0 EIADHM O=C(Nc1ncccc1[O-])[C@@H](Sc1ccccc1)c1ccccc1 ZINC000216634743 1029594682 /nfs/dbraw/zinc/59/46/82/1029594682.db2.gz BKINMYNIWJZDJI-KRWDZBQOSA-N -1 3 336.416 4.259 20 0 EIADHM O=C(Nc1cc(F)ccc1[O-])c1ccc(OC2CCC2)cc1Cl ZINC000536212119 1029602475 /nfs/dbraw/zinc/60/24/75/1029602475.db2.gz YREUPYZKXDDHKD-UHFFFAOYSA-N -1 3 335.762 4.368 20 0 EIADHM Cc1ccc(Cl)c([N-]S(=O)(=O)c2c(C)cccc2F)c1C ZINC000446955748 1029650575 /nfs/dbraw/zinc/65/05/75/1029650575.db2.gz BJHORXDLTWYVNB-UHFFFAOYSA-N -1 3 327.808 4.205 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(NC[C@H]3CCCC[C@H]3C)nc2)n1 ZINC000301183066 1029682525 /nfs/dbraw/zinc/68/25/25/1029682525.db2.gz RBEOGYOFTRDDFF-ZIAGYGMSSA-N -1 3 326.444 4.045 20 0 EIADHM Fc1ccccc1[N-]c1nnc(Sc2ccnc(C3CC3)n2)s1 ZINC000301236640 1029692386 /nfs/dbraw/zinc/69/23/86/1029692386.db2.gz KNSYERGBAFEDSW-UHFFFAOYSA-N -1 3 345.428 4.239 20 0 EIADHM O=C(CCOc1ccccc1Cl)Nc1cc(Cl)ccc1[O-] ZINC000170577053 1029850937 /nfs/dbraw/zinc/85/09/37/1029850937.db2.gz QTLMWUAQELIUDP-UHFFFAOYSA-N -1 3 326.179 4.107 20 0 EIADHM CC[C@H](C)n1ncc(C(=O)Nc2ccc(Cl)cc2[O-])c1C1CC1 ZINC000089867842 1029859027 /nfs/dbraw/zinc/85/90/27/1029859027.db2.gz WSCSYGIBKJXFLU-JTQLQIEISA-N -1 3 333.819 4.343 20 0 EIADHM COc1cc(C)cc(C)c1S(=O)(=O)[N-]c1cccc(C)c1Cl ZINC000584447821 1029882452 /nfs/dbraw/zinc/88/24/52/1029882452.db2.gz HDBKTIZUQGJYBV-UHFFFAOYSA-N -1 3 339.844 4.075 20 0 EIADHM CC(C)c1cnc(-c2ccc(NC(=O)c3c([O-])cccc3O)cc2)o1 ZINC000092122248 1029902988 /nfs/dbraw/zinc/90/29/88/1029902988.db2.gz SGCKMPIKLUOONQ-UHFFFAOYSA-N -1 3 338.363 4.129 20 0 EIADHM [O-]c1cc(Cl)c(CN2CCc3nc(Cl)ccc3C2)c(Cl)c1 ZINC001142114366 1029950098 /nfs/dbraw/zinc/95/00/98/1029950098.db2.gz FILOGVDQRZKHMY-UHFFFAOYSA-N -1 3 343.641 4.306 20 0 EIADHM O=C(Nc1cccc(C2CCOCC2)c1)c1cc([O-])ccc1Cl ZINC000529935572 1029960715 /nfs/dbraw/zinc/96/07/15/1029960715.db2.gz AIIFHAMZSRNCLO-UHFFFAOYSA-N -1 3 331.799 4.192 20 0 EIADHM C[C@H]1CC(F)(F)CCN1C(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000530011232 1030033887 /nfs/dbraw/zinc/03/38/87/1030033887.db2.gz LUTZFSQUDWGRNH-AWEZNQCLSA-N -1 3 345.389 4.243 20 0 EIADHM CN(Cc1nc2ccccc2o1)Cc1c(Cl)cc([O-])cc1Cl ZINC001142118460 1030052387 /nfs/dbraw/zinc/05/23/87/1030052387.db2.gz MKOSHEHROHCWQE-UHFFFAOYSA-N -1 3 337.206 4.472 20 0 EIADHM CCOc1ccc([C@@H](C)NCc2ccc(C(=O)[O-])cc2)cc1OCC ZINC000262956006 1030104220 /nfs/dbraw/zinc/10/42/20/1030104220.db2.gz BHQSOKWRLCXAMC-CQSZACIVSA-N -1 3 343.423 4.033 20 0 EIADHM Cc1ccc(SC2CCCC2)c(C(=O)NCc2ncccc2[O-])c1 ZINC000525948603 1030117270 /nfs/dbraw/zinc/11/72/70/1030117270.db2.gz SNNZDBFFXQYSQO-UHFFFAOYSA-N -1 3 342.464 4.060 20 0 EIADHM O=C(Nc1cccc([O-])c1F)c1cccnc1Sc1ccccc1 ZINC000128763655 1030151316 /nfs/dbraw/zinc/15/13/16/1030151316.db2.gz XEHWZYUERREPTK-UHFFFAOYSA-N -1 3 340.379 4.330 20 0 EIADHM Cc1cccc2c(=O)[nH]c(C(Cl)=Cc3ccc([O-])c(F)c3)nc12 ZINC000255598827 1030196125 /nfs/dbraw/zinc/19/61/25/1030196125.db2.gz XCZPEMNOBPPDFZ-KPKJPENVSA-N -1 3 330.746 4.225 20 0 EIADHM Cc1ccccc1-c1cc(=NC(=O)c2ccccc2C(F)(F)F)[nH][n-]1 ZINC000526122952 1030301921 /nfs/dbraw/zinc/30/19/21/1030301921.db2.gz VSZBISKRTJQZEA-UHFFFAOYSA-N -1 3 345.324 4.078 20 0 EIADHM O=[S@@](Cc1nc(-c2ccccc2Cl)cs1)c1ccc([O-])cc1 ZINC000187067430 1030329356 /nfs/dbraw/zinc/32/93/56/1030329356.db2.gz OXMRILZYAPPOSC-QFIPXVFZSA-N -1 3 349.864 4.477 20 0 EIADHM O=c1nc(CSc2ccncc2)[n-]c2scc(-c3ccco3)c21 ZINC000448103660 1030566635 /nfs/dbraw/zinc/56/66/35/1030566635.db2.gz VSKCWGVERIBXKS-UHFFFAOYSA-N -1 3 341.417 4.344 20 0 EIADHM CC(C)c1ncc(C(=O)[N-]c2nnc(-c3ccccc3)s2)s1 ZINC000448155858 1030618850 /nfs/dbraw/zinc/61/88/50/1030618850.db2.gz PSSUMXKRGMGDIT-UHFFFAOYSA-N -1 3 330.438 4.037 20 0 EIADHM O=C(Nc1cc(F)ccc1[O-])c1cc2cc(Br)ccc2[nH]1 ZINC000530895482 1030782913 /nfs/dbraw/zinc/78/29/13/1030782913.db2.gz GIOMUFXVEYOIGF-UHFFFAOYSA-N -1 3 349.159 4.027 20 0 EIADHM O=C(N=c1cc(-c2ccccc2F)o[n-]1)c1occc1-c1ccccc1 ZINC000448493551 1030821969 /nfs/dbraw/zinc/82/19/69/1030821969.db2.gz XHPIYXILYQFOGY-UHFFFAOYSA-N -1 3 348.333 4.415 20 0 EIADHM Cc1c2ccccc2oc1C(=O)N=c1cc(-c2cccc(F)c2)o[n-]1 ZINC000448540125 1030835070 /nfs/dbraw/zinc/83/50/70/1030835070.db2.gz YYOJSAKLMFQPPT-UHFFFAOYSA-N -1 3 336.322 4.210 20 0 EIADHM [O-]c1cccc(CN[C@@H](c2ccccn2)C2CCC2)c1Br ZINC000527769979 1030850204 /nfs/dbraw/zinc/85/02/04/1030850204.db2.gz CIXHRKKMRBVJHN-QGZVFWFLSA-N -1 3 347.256 4.181 20 0 EIADHM CCc1cccc(C(=O)N2CCC(OCC3CCCCC3)CC2)c1[O-] ZINC000531196526 1030974290 /nfs/dbraw/zinc/97/42/90/1030974290.db2.gz ZDBUREBOYVWOAZ-UHFFFAOYSA-N -1 3 345.483 4.156 20 0 EIADHM Cc1cc(C(=O)Nc2cc(Br)ccc2[O-])sc1C ZINC000531394069 1031168654 /nfs/dbraw/zinc/16/86/54/1031168654.db2.gz UMNMXEJQWMZSPJ-UHFFFAOYSA-N -1 3 326.215 4.085 20 0 EIADHM C[C@H]1CC[C@H](c2noc(-c3cc(Cc4ccccc4)ccc3[O-])n2)O1 ZINC000528234498 1031281122 /nfs/dbraw/zinc/28/11/22/1031281122.db2.gz KQXZRTJFRUADCG-SCLBCKFNSA-N -1 3 336.391 4.273 20 0 EIADHM CCCc1occc1C(=O)Nc1c([O-])ccc(Br)c1C ZINC000452762435 1031317310 /nfs/dbraw/zinc/31/73/10/1031317310.db2.gz YNSKEMKGDBJNSQ-UHFFFAOYSA-N -1 3 338.201 4.261 20 0 EIADHM O=C(N[C@H](c1ccccc1)[C@@H]1CCOC1)c1cc([O-])c2ccccc2c1 ZINC000375921185 1031516485 /nfs/dbraw/zinc/51/64/85/1031516485.db2.gz QLAGJSVUQNLYQB-DYESRHJHSA-N -1 3 347.414 4.053 20 0 EIADHM CCC[C@@H](CC(C)C)C(=O)Nc1ccc(-c2nc(C)cc(=O)[n-]2)cc1 ZINC000449801773 1032011019 /nfs/dbraw/zinc/01/10/19/1032011019.db2.gz FRAKKDVINWDLRE-INIZCTEOSA-N -1 3 341.455 4.146 20 0 EIADHM CSc1ccsc1C(=O)[N-]c1nnc(/C=C/c2ccco2)s1 ZINC000152503485 1032029108 /nfs/dbraw/zinc/02/91/08/1032029108.db2.gz RJDQYGVFPVRISS-SNAWJCMRSA-N -1 3 349.462 4.337 20 0 EIADHM COc1c(C)cc(S(=O)(=O)[N-]c2ccc(Cl)cc2C)cc1C ZINC000512591086 1033446970 /nfs/dbraw/zinc/44/69/70/1033446970.db2.gz AYZYSCHYIIDTCM-UHFFFAOYSA-N -1 3 339.844 4.075 20 0 EIADHM C[C@H](NCc1cccc([O-])c1Cl)c1ccc(-n2cccn2)c(F)c1 ZINC000645199750 1034141082 /nfs/dbraw/zinc/14/10/82/1034141082.db2.gz KSKIUNHXMBTJMB-LBPRGKRZSA-N -1 3 345.805 4.221 20 0 EIADHM C[C@@H](Oc1ccc(F)cc1Cl)C(=O)Nc1cc(Cl)ccc1[O-] ZINC000500950688 1034400210 /nfs/dbraw/zinc/40/02/10/1034400210.db2.gz OLOAJXOAJFPXMX-MRVPVSSYSA-N -1 3 344.169 4.244 20 0 EIADHM Cc1ccccc1C[C@H](C)N(C)Cc1cc(C(=O)[O-])ccc1Cl ZINC000576710737 1034883349 /nfs/dbraw/zinc/88/33/49/1034883349.db2.gz RSJJOGGMEBRAIR-AWEZNQCLSA-N -1 3 331.843 4.410 20 0 EIADHM COc1cccc(-c2nc(-c3ccsc3C(F)(F)F)no2)c1[O-] ZINC000904923366 1035673041 /nfs/dbraw/zinc/67/30/41/1035673041.db2.gz RJHWTTWSEVSFPP-UHFFFAOYSA-N -1 3 342.298 4.198 20 0 EIADHM [O-]c1ccc(Cc2nc(-c3ccc(C(F)(F)F)s3)no2)cc1F ZINC000904967700 1035687131 /nfs/dbraw/zinc/68/71/31/1035687131.db2.gz PZRJDSZYPRCHSL-UHFFFAOYSA-N -1 3 344.289 4.252 20 0 EIADHM CC(=O)c1ccc(OCCCC(=O)Nc2cc(Cl)ccc2[O-])cc1 ZINC000596754547 1036003506 /nfs/dbraw/zinc/00/35/06/1036003506.db2.gz GRJZMOJCIHNFCR-UHFFFAOYSA-N -1 3 347.798 4.046 20 0 EIADHM Cc1c2cc(F)ccc2oc1C(=O)[N-]c1cc([N+](=O)[O-])ccc1F ZINC000060553631 1036230463 /nfs/dbraw/zinc/23/04/63/1036230463.db2.gz BBEDYFATMLPCHR-UHFFFAOYSA-N -1 3 332.262 4.180 20 0 EIADHM O=c1cc(C=Cc2ccc(-c3ccccc3)o2)nc(-c2ccncc2)[n-]1 ZINC000485980977 1036408324 /nfs/dbraw/zinc/40/83/24/1036408324.db2.gz HDHUOCJSLMWYNY-VOTSOKGWSA-N -1 3 341.370 4.262 20 0 EIADHM O=C([O-])c1ccc(-c2nc(CN3CCC[C@@H]4CCC[C@@H]43)cs2)cc1 ZINC000572127673 1036439456 /nfs/dbraw/zinc/43/94/56/1036439456.db2.gz NOBKQSJUNJOHKM-GUYCJALGSA-N -1 3 342.464 4.273 20 0 EIADHM O=c1cc(C=Cc2ccc(-c3ccncc3)cc2F)nc(C2CC2)[n-]1 ZINC000486072269 1036472751 /nfs/dbraw/zinc/47/27/51/1036472751.db2.gz COQROLUMYQYYLE-AATRIKPKSA-N -1 3 333.366 4.431 20 0 EIADHM CC1=C(C)C[C@](C)(C(=O)OCc2nnc(-c3ccccc3[O-])o2)CC1 ZINC000909737584 1037166017 /nfs/dbraw/zinc/16/60/17/1037166017.db2.gz QVMOJQXIGSXNPM-LJQANCHMSA-N -1 3 342.395 4.012 20 0 EIADHM Cc1cc(C)cc(-c2nnc([N-]C(=O)c3cccc(F)c3F)s2)c1 ZINC000604263838 1037321735 /nfs/dbraw/zinc/32/17/35/1037321735.db2.gz UCXATAGEWFBMLS-UHFFFAOYSA-N -1 3 345.374 4.352 20 0 EIADHM CCN(Cc1ccccc1)Cn1c(Cc2cccs2)n[n-]c1=S ZINC000058204778 1037584056 /nfs/dbraw/zinc/58/40/56/1037584056.db2.gz JLIXHKACXALREF-UHFFFAOYSA-N -1 3 344.509 4.073 20 0 EIADHM CCCCSc1nnc(S[C@H](C)c2nc(C)cc(=O)[n-]2)s1 ZINC000488755605 1037741035 /nfs/dbraw/zinc/74/10/35/1037741035.db2.gz YCBFCCZVUIMOFL-SECBINFHSA-N -1 3 342.515 4.088 20 0 EIADHM CC(C)CN(C(=O)c1cc(F)cc2n[n-]nc21)c1ccc(Cl)cc1 ZINC000503720489 1037890658 /nfs/dbraw/zinc/89/06/58/1037890658.db2.gz YRFHIBMEQBLUTN-UHFFFAOYSA-N -1 3 346.793 4.053 20 0 EIADHM O=C([O-])[C@H](CNCc1cc(Cl)sc1Cl)Cc1ccccc1 ZINC000669469959 1037915874 /nfs/dbraw/zinc/91/58/74/1037915874.db2.gz QRCKKLZRWPRSNH-LBPRGKRZSA-N -1 3 344.263 4.088 20 0 EIADHM Cc1ccc([C@H]2CCCN2C(=O)NCc2ccc([O-])c(F)c2)cc1C ZINC000606714534 1038227132 /nfs/dbraw/zinc/22/71/32/1038227132.db2.gz ARXNKDIJBKOTFF-GOSISDBHSA-N -1 3 342.414 4.195 20 0 EIADHM CCc1ocnc1C(=O)[N-]c1cccc(Cl)c1SCC(F)F ZINC000606783342 1038261005 /nfs/dbraw/zinc/26/10/05/1038261005.db2.gz OGIBKDCDANCGOE-UHFFFAOYSA-N -1 3 346.786 4.500 20 0 EIADHM Cc1cccc([C@H](C)C(=O)Nc2ccc(Br)cc2[O-])c1 ZINC000606832245 1038268381 /nfs/dbraw/zinc/26/83/81/1038268381.db2.gz POQQBTFCIPWRHE-NSHDSACASA-N -1 3 334.213 4.205 20 0 EIADHM CC[C@@H](C)c1cc(C(=O)[N-]c2cc(F)c(OC(F)F)cc2F)on1 ZINC000490280508 1038470247 /nfs/dbraw/zinc/47/02/47/1038470247.db2.gz ZDJGWNQWSJMGNT-SSDOTTSWSA-N -1 3 346.280 4.320 20 0 EIADHM Cc1oc([C@H](C)N2CCC(OC3CCC(C)CC3)CC2)cc1C(=O)[O-] ZINC000516479462 1038803724 /nfs/dbraw/zinc/80/37/24/1038803724.db2.gz LNAJHEUZKGFBHI-BBBYJDLNSA-N -1 3 349.471 4.407 20 0 EIADHM CC(C)COc1cccc(CNC(=O)c2cc([O-])ccc2Cl)c1 ZINC000554991073 1038815883 /nfs/dbraw/zinc/81/58/83/1038815883.db2.gz OVLJAPZEBVEDIY-UHFFFAOYSA-N -1 3 333.815 4.010 20 0 EIADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)[C@H]3CCCC[C@H]3C)c2)n1 ZINC000424597207 1038919230 /nfs/dbraw/zinc/91/92/30/1038919230.db2.gz HJRVDYJIKASBFU-DYVFJYSZSA-N -1 3 339.439 4.176 20 0 EIADHM CSCCc1ccc([N-]S(=O)(=O)c2ccc(C)c(C)c2)cc1 ZINC000609015732 1038993301 /nfs/dbraw/zinc/99/33/01/1038993301.db2.gz GSLCWXLAGSUMIM-UHFFFAOYSA-N -1 3 335.494 4.010 20 0 EIADHM CC(=O)c1cccc(NC(=O)[C@@H]2C[C@H]2c2cccc3ccccc32)c1[O-] ZINC000552069844 1039091399 /nfs/dbraw/zinc/09/13/99/1039091399.db2.gz MFZPNVHAMXJGSM-RBUKOAKNSA-N -1 3 345.398 4.490 20 0 EIADHM O=C(Cc1ccc([O-])c(F)c1)Nc1ccc(OC2CCCC2)cc1 ZINC000448650913 1039223546 /nfs/dbraw/zinc/22/35/46/1039223546.db2.gz NMKJTMLADIMENP-UHFFFAOYSA-N -1 3 329.371 4.034 20 0 EIADHM O=C(Nc1c([O-])cccc1Cl)c1ccc(Br)cc1 ZINC000552434582 1039514370 /nfs/dbraw/zinc/51/43/70/1039514370.db2.gz PEWPTAMYTSYYEX-UHFFFAOYSA-N -1 3 326.577 4.060 20 0 EIADHM CCc1ccc([O-])c(C(=O)N(c2ccc(OC)cc2)[C@H](C)C2CC2)c1 ZINC000537637890 1039535141 /nfs/dbraw/zinc/53/51/41/1039535141.db2.gz AFWCRNNZRODZNT-CQSZACIVSA-N -1 3 339.435 4.409 20 0 EIADHM COc1cccc(-c2c[nH]cc2C(=O)Nc2cc(Cl)ccc2[O-])c1 ZINC000534721024 1039749851 /nfs/dbraw/zinc/74/98/51/1039749851.db2.gz IYAONXDPOXVPLQ-UHFFFAOYSA-N -1 3 342.782 4.302 20 0 EIADHM O=C(Nc1c([O-])cccc1Cl)c1cnc(Cc2ccccc2)s1 ZINC000552783223 1039819599 /nfs/dbraw/zinc/81/95/99/1039819599.db2.gz JHRVTAAVJOCADI-UHFFFAOYSA-N -1 3 344.823 4.345 20 0 EIADHM CCN(CCc1ccc(C(F)(F)F)cc1)C(=O)c1ccccc1[O-] ZINC000425158419 1039835661 /nfs/dbraw/zinc/83/56/61/1039835661.db2.gz IUVOBTLPPGPKPM-UHFFFAOYSA-N -1 3 337.341 4.116 20 0 EIADHM COc1cc([N-]S(=O)(=O)c2ccc(C(C)C)cc2)c(C)cc1C ZINC000478719593 1039881830 /nfs/dbraw/zinc/88/18/30/1039881830.db2.gz IDOBNYVSTZKPQI-UHFFFAOYSA-N -1 3 333.453 4.236 20 0 EIADHM CCc1cc(C)cc(CC)c1[N-]S(=O)(=O)c1ccc(COC)cc1 ZINC000481885176 1039884126 /nfs/dbraw/zinc/88/41/26/1039884126.db2.gz QZBJEFHSOLIKLT-UHFFFAOYSA-N -1 3 347.480 4.067 20 0 EIADHM CCCCCN(Cc1coc(-c2ccc(C(=O)[O-])cc2)n1)C(C)C ZINC000514607783 1040049654 /nfs/dbraw/zinc/04/96/54/1040049654.db2.gz BAPLJMABVCGPNH-UHFFFAOYSA-N -1 3 330.428 4.440 20 0 EIADHM O=C(CCc1ccc(F)cc1F)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000505643060 1040223341 /nfs/dbraw/zinc/22/33/41/1040223341.db2.gz CLKUOJOLJFUVQF-UHFFFAOYSA-N -1 3 345.267 4.261 20 0 EIADHM C[C@@H](C(=O)Nc1cc(Cl)ccc1[O-])c1cn(C)c2ccccc12 ZINC000477121836 1040242982 /nfs/dbraw/zinc/24/29/82/1040242982.db2.gz NUIOGDOXVFDRHZ-LLVKDONJSA-N -1 3 328.799 4.280 20 0 EIADHM CC[C@H](CN(CC)C(=O)NCc1ccc([O-])c(F)c1)c1ccccc1 ZINC000483103435 1040694019 /nfs/dbraw/zinc/69/40/19/1040694019.db2.gz SEDMGXLKWCYBET-MRXNPFEDSA-N -1 3 344.430 4.257 20 0 EIADHM C[C@@H]1CC[C@H](C(=O)[O-])[C@H](C)N1Cc1ncc(-c2cccc(Cl)c2)o1 ZINC000515498635 1040805171 /nfs/dbraw/zinc/80/51/71/1040805171.db2.gz ACAHCRCFEOXGRP-XUJVJEKNSA-N -1 3 348.830 4.069 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N1CC2(CCC2)[C@H]1c1cccnc1 ZINC000898415651 1040838304 /nfs/dbraw/zinc/83/83/04/1040838304.db2.gz JLUFTCUKOMBQCK-HXUWFJFHSA-N -1 3 344.414 4.308 20 0 EIADHM O=C(Nc1cc(F)ccc1[O-])c1cc2ccc(C(F)(F)F)cc2[nH]1 ZINC000539865679 1040852437 /nfs/dbraw/zinc/85/24/37/1040852437.db2.gz CMQLFQAACKNLDL-UHFFFAOYSA-N -1 3 338.260 4.284 20 0 EIADHM O=C(CCCc1ccc2ccccc2c1)NCc1ccc([O-])c(F)c1 ZINC000538292019 1041246029 /nfs/dbraw/zinc/24/60/29/1041246029.db2.gz XGNBFOALUSQLKO-UHFFFAOYSA-N -1 3 337.394 4.324 20 0 EIADHM CC(C)c1ccc([C@H](CC(=O)[O-])NCc2ccc(C(F)F)nc2)cc1 ZINC000904001746 1041246845 /nfs/dbraw/zinc/24/68/45/1041246845.db2.gz FKZHEQXXZLBMOW-KRWDZBQOSA-N -1 3 348.393 4.448 20 0 EIADHM CCc1nc(CNC/C=C/c2cc(C)c(C)cc2C)ccc1C(=O)[O-] ZINC000903997018 1041253687 /nfs/dbraw/zinc/25/36/87/1041253687.db2.gz MNZZHJYDEJAIKH-VOTSOKGWSA-N -1 3 338.451 4.070 20 0 EIADHM C=Cc1ccc(S(=O)(=O)[N-]c2c(F)cccc2NC(C)C)cc1 ZINC000436474370 1041271986 /nfs/dbraw/zinc/27/19/86/1041271986.db2.gz CNTLPKNZDGELOV-UHFFFAOYSA-N -1 3 334.416 4.090 20 0 EIADHM O=C([O-])[C@@H]1CC=C[C@@H](NCc2ccc(-c3ccccc3Cl)o2)C1 ZINC000904037348 1041286138 /nfs/dbraw/zinc/28/61/38/1041286138.db2.gz YQPBWPDKRHPLCL-CHWSQXEVSA-N -1 3 331.799 4.109 20 0 EIADHM CC(C)c1ccc(-c2nc(-c3ccnc(OC(F)F)c3)no2)c([O-])c1 ZINC000436484089 1041288105 /nfs/dbraw/zinc/28/81/05/1041288105.db2.gz DLWSAPAOJQQDES-UHFFFAOYSA-N -1 3 347.321 4.229 20 0 EIADHM Cc1ccc(C(=O)N2CCS[C@@H](C)[C@@H]2c2ccccc2)c([O-])c1 ZINC000436526883 1041310773 /nfs/dbraw/zinc/31/07/73/1041310773.db2.gz FRFQDPCRFZZPIB-KBXCAEBGSA-N -1 3 327.449 4.019 20 0 EIADHM CCN(Cc1ccncc1)C(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436537837 1041330656 /nfs/dbraw/zinc/33/06/56/1041330656.db2.gz GGHHFSQDECFDJE-UHFFFAOYSA-N -1 3 346.430 4.040 20 0 EIADHM COc1ccc(N(C(=O)c2ccc(C)c(C)c2[O-])[C@H](C)C2CC2)cc1 ZINC000436539395 1041332587 /nfs/dbraw/zinc/33/25/87/1041332587.db2.gz YDMXIUPQXVPYKR-OAHLLOKOSA-N -1 3 339.435 4.463 20 0 EIADHM CCN(C(=O)c1ccccc1[O-])[C@@H](Cc1ccc(F)cc1)C(C)C ZINC000436570557 1041350091 /nfs/dbraw/zinc/35/00/91/1041350091.db2.gz AFKIGYYFYDWBEM-SFHVURJKSA-N -1 3 329.415 4.261 20 0 EIADHM CC1(C)Cc2ccc(C(=O)N(CC3CC3)c3ccccc3)c([O-])c2O1 ZINC000436591222 1041352057 /nfs/dbraw/zinc/35/20/57/1041352057.db2.gz VUOUWQGOWSDMFJ-UHFFFAOYSA-N -1 3 337.419 4.163 20 0 EIADHM CC[C@H](OC)C(=O)Nc1ccc([O-])c(-c2nc3ccccc3s2)c1 ZINC000436599801 1041358719 /nfs/dbraw/zinc/35/87/19/1041358719.db2.gz DKMDMHUBOLCHEV-HNNXBMFYSA-N -1 3 342.420 4.032 20 0 EIADHM CC(C)c1ccc(C(=O)N2CC[C@@H](c3ccc(F)cc3)C2)c([O-])c1 ZINC000436588986 1041362500 /nfs/dbraw/zinc/36/25/00/1041362500.db2.gz NYVFILWKXOOXIU-MRXNPFEDSA-N -1 3 327.399 4.284 20 0 EIADHM Cc1ccc(C(=O)N2CC=C(c3ccc(Cl)cc3)CC2)c([O-])c1 ZINC000436586712 1041363157 /nfs/dbraw/zinc/36/31/57/1041363157.db2.gz UOSMWDOXDKCYOK-UHFFFAOYSA-N -1 3 327.811 4.284 20 0 EIADHM CC(C)c1ccc(C(=O)N2C[C@@H](c3ccsc3)O[C@@H](C)C2)c([O-])c1 ZINC000436589134 1041366245 /nfs/dbraw/zinc/36/62/45/1041366245.db2.gz VNHIYUVQVBAHEP-UGSOOPFHSA-N -1 3 345.464 4.179 20 0 EIADHM CCCN(C(=O)c1ccc(O)cc1[O-])[C@H](C)c1cc2ccccc2o1 ZINC000436612908 1041373391 /nfs/dbraw/zinc/37/33/91/1041373391.db2.gz ZUVJOZCRBCOHRM-CYBMUJFWSA-N -1 3 339.391 4.457 20 0 EIADHM COc1ccc(C(=O)N2C[C@@H](C)CC[C@H]2c2ccccc2)c([O-])c1 ZINC000436657306 1041413281 /nfs/dbraw/zinc/41/32/81/1041413281.db2.gz LDMUSYVCIGNSQM-KSSFIOAISA-N -1 3 325.408 4.014 20 0 EIADHM CCCCN(C(=O)c1cc(NC(C)=O)ccc1[O-])[C@H]1CCC[C@H](C)C1 ZINC000436701623 1041431011 /nfs/dbraw/zinc/43/10/11/1041431011.db2.gz AFEIKJHFDZBYIG-YOEHRIQHSA-N -1 3 346.471 4.172 20 0 EIADHM CCCCN(C(=O)c1cc(NC(C)=O)ccc1[O-])[C@H]1CCC[C@@H](C)C1 ZINC000436701615 1041431633 /nfs/dbraw/zinc/43/16/33/1041431633.db2.gz AFEIKJHFDZBYIG-PBHICJAKSA-N -1 3 346.471 4.172 20 0 EIADHM CCCCN(C(=O)c1cc(OC)c([O-])c(OC)c1)[C@H]1CCC[C@H](C)C1 ZINC000436701710 1041431728 /nfs/dbraw/zinc/43/17/28/1041431728.db2.gz ALKHCYJWSXBUIP-HOCLYGCPSA-N -1 3 349.471 4.230 20 0 EIADHM CCCCOc1ccc(C(=O)N(C)Cc2sccc2C)c([O-])c1 ZINC000436716747 1041441151 /nfs/dbraw/zinc/44/11/51/1041441151.db2.gz QVUYARVVSDYPKZ-UHFFFAOYSA-N -1 3 333.453 4.213 20 0 EIADHM CCc1ccc([O-])c(C(=O)N(C)[C@H](CC)c2ccccc2OC)c1 ZINC000436737908 1041446073 /nfs/dbraw/zinc/44/60/73/1041446073.db2.gz KLICWRVJCRUQEQ-QGZVFWFLSA-N -1 3 327.424 4.187 20 0 EIADHM COc1cccc(C(=O)Nc2cnn(CCC(C)C)c2C(C)C)c1[O-] ZINC000436737695 1041446478 /nfs/dbraw/zinc/44/64/78/1041446478.db2.gz JTRYGIZFYFDHRA-UHFFFAOYSA-N -1 3 345.443 4.019 20 0 EIADHM COc1ccc([C@H](C)N(C)C(=O)c2ccc(C(C)C)cc2[O-])cc1 ZINC000436757173 1041467230 /nfs/dbraw/zinc/46/72/30/1041467230.db2.gz HHBBBRWCHRDITO-AWEZNQCLSA-N -1 3 327.424 4.357 20 0 EIADHM CC(=O)c1ccc(C(=O)NC(c2ccccc2)c2ccccc2)cc1[O-] ZINC000436854764 1041506572 /nfs/dbraw/zinc/50/65/72/1041506572.db2.gz VCKSQKMKKBFCGO-UHFFFAOYSA-N -1 3 345.398 4.114 20 0 EIADHM O=C(c1cc(CCc2ccccc2)ccc1[O-])N1CC(C2CCC2)C1 ZINC000436864714 1041521900 /nfs/dbraw/zinc/52/19/00/1041521900.db2.gz NXUPSDXNKWJSCL-UHFFFAOYSA-N -1 3 335.447 4.050 20 0 EIADHM CC[C@@H](NC(=O)c1ccc(C(C)=O)c([O-])c1)c1ccc(Cl)cc1 ZINC000436869613 1041528687 /nfs/dbraw/zinc/52/86/87/1041528687.db2.gz NAHYGEAAWIZUCC-MRXNPFEDSA-N -1 3 331.799 4.129 20 0 EIADHM CCc1ccc(-c2nc(-c3ccc(N4CCCC4)cc3)no2)c([O-])c1 ZINC000436880686 1041539057 /nfs/dbraw/zinc/53/90/57/1041539057.db2.gz PEUOJNPRYLFEJS-UHFFFAOYSA-N -1 3 335.407 4.272 20 0 EIADHM [O-]c1cc2ccccc2cc1-c1nc(-c2ccc3c(c2)CCO3)no1 ZINC000436890544 1041545562 /nfs/dbraw/zinc/54/55/62/1041545562.db2.gz USCFYGUTOKFREQ-UHFFFAOYSA-N -1 3 330.343 4.197 20 0 EIADHM Cc1ccc(C(=O)N2CCC[C@H](c3ccc(F)cc3)CC2)c([O-])c1 ZINC000436905070 1041546667 /nfs/dbraw/zinc/54/66/67/1041546667.db2.gz NKSZNNOFNNMMHX-HNNXBMFYSA-N -1 3 327.399 4.250 20 0 EIADHM Cc1ccc(C(=O)N2CCC[C@@H](c3ccc(F)cc3)CC2)c([O-])c1 ZINC000436905072 1041547453 /nfs/dbraw/zinc/54/74/53/1041547453.db2.gz NKSZNNOFNNMMHX-OAHLLOKOSA-N -1 3 327.399 4.250 20 0 EIADHM COc1cccc(-c2nc(-c3ccc4[nH]c(C)c(C)c4c3)no2)c1[O-] ZINC000436918624 1041557975 /nfs/dbraw/zinc/55/79/75/1041557975.db2.gz JMMNHHQHJLOXRQ-UHFFFAOYSA-N -1 3 335.363 4.216 20 0 EIADHM COc1ccc(C(=O)N2CCC(c3cccc(Cl)c3)CC2)c([O-])c1 ZINC000436922394 1041558557 /nfs/dbraw/zinc/55/85/57/1041558557.db2.gz NDGPARYDKDHNDZ-UHFFFAOYSA-N -1 3 345.826 4.074 20 0 EIADHM O=C(c1cc(Oc2ccccc2)ccc1[O-])N1CCc2ccccc21 ZINC000436950254 1041564217 /nfs/dbraw/zinc/56/42/17/1041564217.db2.gz BGTMJTHUKDJWSM-UHFFFAOYSA-N -1 3 331.371 4.387 20 0 EIADHM Cc1ccccc1CN(Cc1ccccc1)C(=O)c1ccc(O)cc1[O-] ZINC000436939006 1041567078 /nfs/dbraw/zinc/56/70/78/1041567078.db2.gz XNNHCWSWGFCSCZ-UHFFFAOYSA-N -1 3 347.414 4.249 20 0 EIADHM COc1ccc2c(c1)CCC[C@@H]2c1noc(-c2ccc(C)cc2[O-])n1 ZINC000436962539 1041571983 /nfs/dbraw/zinc/57/19/83/1041571983.db2.gz MADUVZSVLYCSJU-INIZCTEOSA-N -1 3 336.391 4.227 20 0 EIADHM COc1cc(NC(=O)c2ccc(C)cc2[O-])cc(OC)c1C(C)C ZINC000436982544 1041582776 /nfs/dbraw/zinc/58/27/76/1041582776.db2.gz VBPCPWBQEPKVAW-UHFFFAOYSA-N -1 3 329.396 4.094 20 0 EIADHM CC(=O)c1ccc(C(=O)[N-]c2c(F)cc(Cl)cc2F)c(F)c1 ZINC000540750115 1041637770 /nfs/dbraw/zinc/63/77/70/1041637770.db2.gz YZEVYAMCGZOVME-UHFFFAOYSA-N -1 3 327.689 4.212 20 0 EIADHM Cc1[nH]c(SCc2cc(=O)[n-]c(C3CC3)n2)nc1-c1ccccc1 ZINC000516913886 1041808803 /nfs/dbraw/zinc/80/88/03/1041808803.db2.gz ZOKPAKYTJPROBN-UHFFFAOYSA-N -1 3 338.436 4.050 20 0 EIADHM C/C=C/c1ccc(OCC(=O)Nc2cc(Cl)ccc2[O-])c(OC)c1 ZINC000301995397 1042047567 /nfs/dbraw/zinc/04/75/67/1042047567.db2.gz DZHFULJNELWNGA-ONEGZZNKSA-N -1 3 347.798 4.105 20 0 EIADHM O=C([N-]c1nc2cc(Cl)ccn2n1)c1cc2cc(Cl)ccc2o1 ZINC000464648585 1042096599 /nfs/dbraw/zinc/09/65/99/1042096599.db2.gz GGFZPKGNDMMPOT-UHFFFAOYSA-N -1 3 347.161 4.035 20 0 EIADHM COc1cccc(C(=O)Nc2cccc(-c3csc(C)n3)c2)c1[O-] ZINC000302928135 1042186270 /nfs/dbraw/zinc/18/62/70/1042186270.db2.gz CWTLUOREECDUNC-UHFFFAOYSA-N -1 3 340.404 4.085 20 0 EIADHM O=C(COc1cccc(Cl)c1)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000473592384 1042304349 /nfs/dbraw/zinc/30/43/49/1042304349.db2.gz VQGVYOBSAQHWNN-UHFFFAOYSA-N -1 3 345.704 4.082 20 0 EIADHM C[C@H](CNC(=O)CCCc1ccc([O-])c(F)c1)Sc1ccccc1 ZINC000469422067 1042411160 /nfs/dbraw/zinc/41/11/60/1042411160.db2.gz KCRVPEJWHJNZJR-CQSZACIVSA-N -1 3 347.455 4.151 20 0 EIADHM O=C(NCCc1csc2ccccc12)c1cc([O-])ccc1Cl ZINC000518262349 1042448464 /nfs/dbraw/zinc/44/84/64/1042448464.db2.gz DLCSKGPVRIYCCG-UHFFFAOYSA-N -1 3 331.824 4.233 20 0 EIADHM CC(C)C(=C([O-])Nc1nc(-c2ccccc2)ns1)c1ccccc1 ZINC000439038367 1042472744 /nfs/dbraw/zinc/47/27/44/1042472744.db2.gz JLQRRLYSWBDVKM-INIZCTEOSA-N -1 3 337.448 4.005 20 0 EIADHM O=C1[N-]C(=O)/C(=C/c2ccc(-c3ccccc3Cl)o2)c2ccccc21 ZINC000030058192 1042484044 /nfs/dbraw/zinc/48/40/44/1042484044.db2.gz ORPNXKMJPPBTKZ-LFIBNONCSA-N -1 3 349.773 4.411 20 0 EIADHM COc1ccc2cc([C@@H](C)[S@](=O)c3ccc([O-])cc3)ccc2c1 ZINC000439432904 1042622013 /nfs/dbraw/zinc/62/20/13/1042622013.db2.gz XAAIBOCGRKIXCW-ZLOXQWCVSA-N -1 3 326.417 4.423 20 0 EIADHM Cc1cc(C)c(S(=O)(=O)[N-]c2ccccc2N2CCCC2)c(C)c1 ZINC000518860823 1042730931 /nfs/dbraw/zinc/73/09/31/1042730931.db2.gz NPTPGEZONNAJPO-UHFFFAOYSA-N -1 3 344.480 4.013 20 0 EIADHM COc1c(F)ccc(F)c1C(=O)[N-]c1cc(Cl)cc(F)c1F ZINC000441611416 1042916592 /nfs/dbraw/zinc/91/65/92/1042916592.db2.gz NAQABEZLHBUVMQ-UHFFFAOYSA-N -1 3 333.668 4.157 20 0 EIADHM Cc1ccc(NC(=O)c2c(C)cccc2[O-])cc1NC(=O)C(C)(C)C ZINC000625475674 1043148426 /nfs/dbraw/zinc/14/84/26/1043148426.db2.gz KKPFOJAZPAFZJD-UHFFFAOYSA-N -1 3 340.423 4.246 20 0 EIADHM O=C(Nc1ccc([O-])c(Cl)c1)[C@@H]1CCCCN1Cc1ccccc1 ZINC000509178110 1043200500 /nfs/dbraw/zinc/20/05/00/1043200500.db2.gz KQOTUCROSHSWAU-KRWDZBQOSA-N -1 3 344.842 4.039 20 0 EIADHM COc1c(F)cc(NC(=O)c2cc([O-])c3ccccc3c2)cc1F ZINC000525919124 1043233985 /nfs/dbraw/zinc/23/39/85/1043233985.db2.gz MADXEFMUJNWWKZ-UHFFFAOYSA-N -1 3 329.302 4.085 20 0 EIADHM COc1cc(Cl)ccc1CNC(=O)c1cc([O-])c2ccccc2c1 ZINC000525919980 1043235173 /nfs/dbraw/zinc/23/51/73/1043235173.db2.gz HBFRKBQUJRHUTD-UHFFFAOYSA-N -1 3 341.794 4.137 20 0 EIADHM Cc1ccccc1[C@H]1CN(C(=O)c2cc([O-])c3ccccc3c2)CCO1 ZINC000525934168 1043236000 /nfs/dbraw/zinc/23/60/00/1043236000.db2.gz LPSPBZKPWDLNJY-OAQYLSRUSA-N -1 3 347.414 4.068 20 0 EIADHM C[C@H](CNC(=O)c1cc([O-])c2ccccc2c1)Cc1cccs1 ZINC000525934668 1043237291 /nfs/dbraw/zinc/23/72/91/1043237291.db2.gz HPNZBAAETOYEHT-ZDUSSCGKSA-N -1 3 325.433 4.216 20 0 EIADHM Cc1ccc2c(CCNC(=O)c3cc([O-])c4ccccc4c3)c[nH]c2c1 ZINC000526929294 1043245701 /nfs/dbraw/zinc/24/57/01/1043245701.db2.gz PKGDNCIVQWRGOO-UHFFFAOYSA-N -1 3 344.414 4.308 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N1CC[C@@H](c2ccc(F)cc2)C1 ZINC000527031869 1043249307 /nfs/dbraw/zinc/24/93/07/1043249307.db2.gz DZVKVIXNBJBQLQ-MRXNPFEDSA-N -1 3 335.378 4.314 20 0 EIADHM O=C(Nc1cccc(OCCF)c1)c1cc([O-])c2ccccc2c1 ZINC000527457666 1043262903 /nfs/dbraw/zinc/26/29/03/1043262903.db2.gz RRZSGMNKWOUENT-UHFFFAOYSA-N -1 3 325.339 4.146 20 0 EIADHM COc1ccc(Cl)cc1CNC(=O)c1cc([O-])c2ccccc2c1 ZINC000527454802 1043263204 /nfs/dbraw/zinc/26/32/04/1043263204.db2.gz WAGWESYAPHDZAH-UHFFFAOYSA-N -1 3 341.794 4.137 20 0 EIADHM CC(C)(C)c1ccc(Cl)cc1NC(=O)NCc1ncccc1[O-] ZINC000670054784 1043392582 /nfs/dbraw/zinc/39/25/82/1043392582.db2.gz LQHQVYVUMBYARW-UHFFFAOYSA-N -1 3 333.819 4.060 20 0 EIADHM C[C@H](NC(=O)c1cc(=O)c2ccccc2[n-]1)c1csc2ccccc21 ZINC000729976415 1043423736 /nfs/dbraw/zinc/42/37/36/1043423736.db2.gz ATZIIHPSVXUHTP-LBPRGKRZSA-N -1 3 348.427 4.234 20 0 EIADHM Cc1cc(C(=O)Nc2cc(Br)ccc2[O-])c(C)s1 ZINC000674171074 1043467055 /nfs/dbraw/zinc/46/70/55/1043467055.db2.gz QDIPXCGEMMPMIO-UHFFFAOYSA-N -1 3 326.215 4.085 20 0 EIADHM Cc1cnn(Cc2ccccc2F)c1Nc1cc(F)cc(F)c1[O-] ZINC001212484222 1043483886 /nfs/dbraw/zinc/48/38/86/1043483886.db2.gz RFBMYEYDFUWTFZ-UHFFFAOYSA-N -1 3 333.313 4.106 20 0 EIADHM CSc1ccncc1[N-]C(=O)c1ccc(Oc2ccccc2)o1 ZINC000674258027 1043504077 /nfs/dbraw/zinc/50/40/77/1043504077.db2.gz XJEWTNSANUCUSW-UHFFFAOYSA-N -1 3 326.377 4.441 20 0 EIADHM CSc1ccc(S(=O)(=O)[N-]c2cc(Cl)cc(F)c2F)cc1 ZINC000442236258 1043585446 /nfs/dbraw/zinc/58/54/46/1043585446.db2.gz LSTRODFAVVZNIY-UHFFFAOYSA-N -1 3 349.811 4.141 20 0 EIADHM CC(C)CCc1ccccc1NC(=O)c1c[n-]c2ccccc2c1=O ZINC000521179183 1043615896 /nfs/dbraw/zinc/61/58/96/1043615896.db2.gz CZSYWBJDGCMQIO-UHFFFAOYSA-N -1 3 334.419 4.369 20 0 EIADHM O=C(O[C@H]1CCCc2ccccc2C1=O)c1cc(Cl)c(Cl)[n-]1 ZINC000731508949 1043780159 /nfs/dbraw/zinc/78/01/59/1043780159.db2.gz JYNGWRACQUDIRN-ZDUSSCGKSA-N -1 3 338.190 4.066 20 0 EIADHM CSc1cc(O)ccc1[N-]C(=O)c1csc(-c2ccc(C)o2)n1 ZINC000191168684 1043787955 /nfs/dbraw/zinc/78/79/55/1043787955.db2.gz NLHABBRMGGWGJA-UHFFFAOYSA-N -1 3 346.433 4.391 20 0 EIADHM O=C(CCOc1ccccc1)[N-]OCc1ccc(Cl)cc1Cl ZINC000731841357 1043836308 /nfs/dbraw/zinc/83/63/08/1043836308.db2.gz DAHXNCGSNGWHBO-UHFFFAOYSA-N -1 3 340.206 4.010 20 0 EIADHM O=c1[n-]c(Sc2nc3cc(Cl)ccc3[nH]2)nc2ccccc12 ZINC000731917632 1043844719 /nfs/dbraw/zinc/84/47/19/1043844719.db2.gz VINRCSXUWPCDBK-UHFFFAOYSA-N -1 3 328.784 4.016 20 0 EIADHM Cn1c2ccc(Cl)cc2nc1Sc1nc2ccccc2c(=O)[n-]1 ZINC000731976843 1043857821 /nfs/dbraw/zinc/85/78/21/1043857821.db2.gz GTLFNILGHMFCFQ-UHFFFAOYSA-N -1 3 342.811 4.027 20 0 EIADHM CCCN(C(=O)c1nnc2ccccc2c1[O-])[C@@H](CC)c1ccccc1 ZINC000732278438 1043892551 /nfs/dbraw/zinc/89/25/51/1043892551.db2.gz NAOLIUFHPDJVNS-SFHVURJKSA-N -1 3 349.434 4.339 20 0 EIADHM CSc1ccccc1[C@H](C)NC(=O)CCCc1ccc([O-])c(F)c1 ZINC000442964324 1043925363 /nfs/dbraw/zinc/92/53/63/1043925363.db2.gz KLGWDWIAYHEHSF-ZDUSSCGKSA-N -1 3 347.455 4.453 20 0 EIADHM [O-]c1ccc(-c2nc(-c3cccc(C(F)(F)F)c3Cl)no2)nc1 ZINC001212557881 1044305752 /nfs/dbraw/zinc/30/57/52/1044305752.db2.gz FTXYMTOTZQCWFX-UHFFFAOYSA-N -1 3 341.676 4.176 20 0 EIADHM O=C(N[C@H]1CCC(F)(F)C1)c1cc(Oc2ccccc2)ccc1[O-] ZINC000675708765 1044444688 /nfs/dbraw/zinc/44/46/88/1044444688.db2.gz INGGBSBSCKPLNO-LBPRGKRZSA-N -1 3 333.334 4.102 20 0 EIADHM C[C@H](c1cccnc1)N(C)C(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000094067926 1044504130 /nfs/dbraw/zinc/50/41/30/1044504130.db2.gz WDUZHSOASNQZIY-MRXNPFEDSA-N -1 3 346.430 4.211 20 0 EIADHM COc1ccccc1S(=O)(=O)[N-]c1cc(C(F)F)ccc1Cl ZINC000676028967 1044616194 /nfs/dbraw/zinc/61/61/94/1044616194.db2.gz ZPUDGGBEJFRXAI-UHFFFAOYSA-N -1 3 347.770 4.087 20 0 EIADHM C[C@H](CCC1CCCCC1)NC(=O)c1cc(=O)c2ccccc2[n-]1 ZINC000522386951 1044690839 /nfs/dbraw/zinc/69/08/39/1044690839.db2.gz QHQKZKCRPMAMKP-CQSZACIVSA-N -1 3 326.440 4.007 20 0 EIADHM C[C@H](c1cccc(Cl)c1)N(C)C(=O)c1cc(=O)c2ccccc2[n-]1 ZINC000053457619 1044813053 /nfs/dbraw/zinc/81/30/53/1044813053.db2.gz WDIMMLBCIHUARC-GFCCVEGCSA-N -1 3 340.810 4.015 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)c1sccc1-c1ccc(F)cc1 ZINC000738550890 1045065494 /nfs/dbraw/zinc/06/54/94/1045065494.db2.gz AYNQPPLMMSWJNW-UHFFFAOYSA-N -1 3 345.370 4.329 20 0 EIADHM CC[C@@H](OC(=O)c1cc2ccsc2[n-]1)C(=O)c1ccc(OC)cc1 ZINC000738588582 1045067252 /nfs/dbraw/zinc/06/72/52/1045067252.db2.gz UKCOPGUBUNBGJE-OAHLLOKOSA-N -1 3 343.404 4.056 20 0 EIADHM COc1cccc([C@H](C)NCc2cccc([O-])c2Br)c1 ZINC000315639069 1045406648 /nfs/dbraw/zinc/40/66/48/1045406648.db2.gz VRVAXRIKKKKEIE-NSHDSACASA-N -1 3 336.229 4.014 20 0 EIADHM O=C(Oc1ccccc1OC(F)(F)F)c1cc2ccsc2[n-]1 ZINC000768034274 1045696711 /nfs/dbraw/zinc/69/67/11/1045696711.db2.gz QXZZHXWGDRGWIR-UHFFFAOYSA-N -1 3 327.283 4.347 20 0 EIADHM CC[C@@H](NC(=O)c1cc2sccc2c([O-])c1)c1nc(C)cs1 ZINC000791353779 1045728325 /nfs/dbraw/zinc/72/83/25/1045728325.db2.gz VFJVFVQSOORICT-GFCCVEGCSA-N -1 3 332.450 4.253 20 0 EIADHM Cc1cccnc1[C@H](NCc1cc(=O)[n-]c(-c2ccccc2)n1)C(C)C ZINC000459387617 1045748652 /nfs/dbraw/zinc/74/86/52/1045748652.db2.gz ZVWAZBQFPJDKQH-LJQANCHMSA-N -1 3 348.450 4.040 20 0 EIADHM CCOC(=O)c1cnc2cc(Nc3ccc([O-])c(F)c3F)ccc2c1 ZINC001212016412 1045839270 /nfs/dbraw/zinc/83/92/70/1045839270.db2.gz ORXCYJKGUYKMPD-UHFFFAOYSA-N -1 3 344.317 4.139 20 0 EIADHM CNc1ccc(Br)cc1Nc1ccc([O-])c(F)c1F ZINC001212016415 1045839391 /nfs/dbraw/zinc/83/93/91/1045839391.db2.gz OXKAUUIDLLTZIG-UHFFFAOYSA-N -1 3 329.144 4.218 20 0 EIADHM O=C([O-])[C@@H]1CCN(Cc2ccc(Cl)cc2Cl)[C@@H]2CCC[C@H]21 ZINC000629373029 1045855478 /nfs/dbraw/zinc/85/54/78/1045855478.db2.gz IWHVDFYMMOBKRM-GZBFAFLISA-N -1 3 328.239 4.069 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)c1ccccc1SC(F)(F)F ZINC000769560024 1046021008 /nfs/dbraw/zinc/02/10/08/1046021008.db2.gz VIVOQPVNRIUJRR-UHFFFAOYSA-N -1 3 345.317 4.073 20 0 EIADHM O=C([O-])[C@@H]1C[C@@H]2CCCC[C@H]2N1Cc1csc(Cl)c1Cl ZINC000263454819 1046289954 /nfs/dbraw/zinc/28/99/54/1046289954.db2.gz ANPWSXLAYGWPLK-GDPRMGEGSA-N -1 3 334.268 4.273 20 0 EIADHM CCc1cc(=O)[n-]c(CSCc2nc(-c3cccs3)oc2C)n1 ZINC000125654203 1046321130 /nfs/dbraw/zinc/32/11/30/1046321130.db2.gz MORFCQDBUGHMRH-UHFFFAOYSA-N -1 3 347.465 4.203 20 0 EIADHM Cc1cnc(-c2cccc([N-]S(=O)(=O)c3ccc(C)cc3C)c2)o1 ZINC000066814735 1046673341 /nfs/dbraw/zinc/67/33/41/1046673341.db2.gz RJHHGJGHWJPQLE-UHFFFAOYSA-N -1 3 342.420 4.068 20 0 EIADHM CCOc1cc(CN[C@@H](C(C)C)C(F)(F)F)cc(Cl)c1[O-] ZINC000459498069 1046725968 /nfs/dbraw/zinc/72/59/68/1046725968.db2.gz UJFXQVGDUUSFGM-ZDUSSCGKSA-N -1 3 325.758 4.121 20 0 EIADHM CC[C@H](C)n1ncc(NCc2cccc([O-])c2Br)c1C ZINC000459535261 1046761589 /nfs/dbraw/zinc/76/15/89/1046761589.db2.gz XGIUKZFPPGLDMW-JTQLQIEISA-N -1 3 338.249 4.243 20 0 EIADHM CC[C@H](c1ccncc1)N(C)Cc1cccc([O-])c1Br ZINC000459551301 1046773133 /nfs/dbraw/zinc/77/31/33/1046773133.db2.gz NEZLYHCZQNNQAX-CQSZACIVSA-N -1 3 335.245 4.133 20 0 EIADHM CCOc1cc(CNCc2c(F)cc(F)cc2F)cc(Cl)c1[O-] ZINC000459587980 1046781889 /nfs/dbraw/zinc/78/18/89/1046781889.db2.gz KMULFDWSMHJJBD-UHFFFAOYSA-N -1 3 345.748 4.151 20 0 EIADHM C[C@H](OC(=O)c1cc2occc2[n-]1)c1nc2ccccc2n1C(F)F ZINC000786028660 1046797946 /nfs/dbraw/zinc/79/79/46/1046797946.db2.gz JUCWGCYCSXVDLV-VIFPVBQESA-N -1 3 345.305 4.424 20 0 EIADHM O=C(Nc1cccc([O-])c1F)c1ccc(Cl)c(C(F)(F)F)c1 ZINC000128448329 1046873557 /nfs/dbraw/zinc/87/35/57/1046873557.db2.gz AZFMCSLSTDOVOB-UHFFFAOYSA-N -1 3 333.668 4.456 20 0 EIADHM O=C([N-]C(c1ccc(Cl)cc1)c1ccc(Cl)cc1)C(F)F ZINC000787082563 1046902677 /nfs/dbraw/zinc/90/26/77/1046902677.db2.gz WRXYSZCQOFKSEZ-UHFFFAOYSA-N -1 3 330.161 4.464 20 0 EIADHM O=C([N-]C1(c2ccccc2Cl)CC1)C(F)(F)c1ccccc1F ZINC001130256971 1046924075 /nfs/dbraw/zinc/92/40/75/1046924075.db2.gz JOENDWYHWQMRAG-UHFFFAOYSA-N -1 3 339.744 4.376 20 0 EIADHM O=C(Nc1ccc(Cl)cc1[O-])c1ccccc1OC(F)(F)F ZINC000537151955 1046990016 /nfs/dbraw/zinc/99/00/16/1046990016.db2.gz STVIEJUCNHOTAJ-UHFFFAOYSA-N -1 3 331.677 4.197 20 0 EIADHM O=C(Nc1ccc(N2CCCC2)c(F)c1)c1cc([O-])ccc1Cl ZINC000788287483 1047156711 /nfs/dbraw/zinc/15/67/11/1047156711.db2.gz HXECPJLXKOZIJI-UHFFFAOYSA-N -1 3 334.778 4.037 20 0 EIADHM C[C@@H](Cc1ccccc1F)NC(=O)c1cc2sccc2c([O-])c1 ZINC000788290521 1047159702 /nfs/dbraw/zinc/15/97/02/1047159702.db2.gz NYLQXALMLSOFOZ-NSHDSACASA-N -1 3 329.396 4.107 20 0 EIADHM COc1cccc(C(=O)Nc2cccc(COc3ccccc3)c2)c1[O-] ZINC000917855661 1047182944 /nfs/dbraw/zinc/18/29/44/1047182944.db2.gz ZBUHIMMJOWSCKD-UHFFFAOYSA-N -1 3 349.386 4.232 20 0 EIADHM O=C(CCC(=O)c1ccc2c(c1)CCCC2)Nc1cccc([O-])c1F ZINC000129009078 1047227797 /nfs/dbraw/zinc/22/77/97/1047227797.db2.gz GXBYUFWGKPZVGF-UHFFFAOYSA-N -1 3 341.382 4.012 20 0 EIADHM Cc1ccc(-c2nc(CNCCC(C)(C)CCC(=O)[O-])cs2)cc1 ZINC000325592427 1047266873 /nfs/dbraw/zinc/26/68/73/1047266873.db2.gz QLROAWOHWFBEPN-UHFFFAOYSA-N -1 3 346.496 4.489 20 0 EIADHM O=C(CCc1ccc(OC(F)(F)F)cc1)Nc1cccc([O-])c1F ZINC000129129492 1047308702 /nfs/dbraw/zinc/30/87/02/1047308702.db2.gz JJZPIRBNFHJIFN-UHFFFAOYSA-N -1 3 343.276 4.001 20 0 EIADHM O=C(CCCc1nc2ccccc2s1)Nc1cccc([O-])c1F ZINC000129218049 1047334802 /nfs/dbraw/zinc/33/48/02/1047334802.db2.gz AHPGFKCADZRSCX-UHFFFAOYSA-N -1 3 330.384 4.102 20 0 EIADHM C[C@@H](Oc1ccc(Cl)c(Cl)c1)C(=O)Nc1cccc([O-])c1F ZINC000129308619 1047348576 /nfs/dbraw/zinc/34/85/76/1047348576.db2.gz WVNSXQLNVQCAKV-MRVPVSSYSA-N -1 3 344.169 4.244 20 0 EIADHM O=C(Nc1cccc([O-])c1F)C1c2ccccc2Oc2ccccc21 ZINC000129460342 1047396696 /nfs/dbraw/zinc/39/66/96/1047396696.db2.gz RSDBYJWEFIEVPB-UHFFFAOYSA-N -1 3 335.334 4.408 20 0 EIADHM O=C(CCc1ccc(Cl)cc1Cl)Nc1cccc([O-])c1F ZINC000129482894 1047402073 /nfs/dbraw/zinc/40/20/73/1047402073.db2.gz PAFSLALTVMZIAR-UHFFFAOYSA-N -1 3 328.170 4.409 20 0 EIADHM CCCc1cc(=O)[n-]c(C(=Cc2cccc(Br)n2)CC)n1 ZINC000789829674 1047477747 /nfs/dbraw/zinc/47/77/47/1047477747.db2.gz SLVPYHPBXIWLNB-PKNBQFBNSA-N -1 3 348.244 4.243 20 0 EIADHM O=C(Nc1ccc2c(c1)C=CCCC2)c1c[n-]c2ccccc2c1=O ZINC001131083740 1047529376 /nfs/dbraw/zinc/52/93/76/1047529376.db2.gz IHNSYZMOIFRQMG-UHFFFAOYSA-N -1 3 330.387 4.130 20 0 EIADHM CC[C@@H](/N=C/c1cc(Br)ccc1[O-])c1c(C)noc1C ZINC000154802807 1047634196 /nfs/dbraw/zinc/63/41/96/1047634196.db2.gz MLSMPZYVHUGVMJ-QOSBVPTNSA-N -1 3 337.217 4.330 20 0 EIADHM O=S(=O)([N-]c1ccc(Cl)cc1F)c1ccc(F)cc1Cl ZINC000044253630 1047634316 /nfs/dbraw/zinc/63/43/16/1047634316.db2.gz BITYRPLCDOTULP-UHFFFAOYSA-N -1 3 338.162 4.072 20 0 EIADHM C[C@H]1CN(C(=O)c2cc([O-])ccc2Cl)CC[C@H]1c1ccccc1 ZINC000556352500 1047699936 /nfs/dbraw/zinc/69/99/36/1047699936.db2.gz AYRJFNZFXOXZCR-XJKSGUPXSA-N -1 3 329.827 4.311 20 0 EIADHM Cc1sc2[n-]c([C@@H](C)OC(=O)CCC(C)(F)F)nc(=O)c2c1C ZINC000919293451 1047811097 /nfs/dbraw/zinc/81/10/97/1047811097.db2.gz WYRPJJMFYITVPU-MRVPVSSYSA-N -1 3 344.383 4.053 20 0 EIADHM CCCN(C(=O)c1ccc(CC)cc1[O-])[C@@H]1C[C@H](OCC)C1(C)C ZINC001136849019 1047852003 /nfs/dbraw/zinc/85/20/03/1047852003.db2.gz WDZSEOSMVOJXSZ-MSOLQXFVSA-N -1 3 333.472 4.010 20 0 EIADHM Cc1occ(C(F)(F)F)c1C(=O)[N-]c1nnc(CCC(C)C)s1 ZINC000824364894 1047860576 /nfs/dbraw/zinc/86/05/76/1047860576.db2.gz CVSBXSZWICIRRF-UHFFFAOYSA-N -1 3 347.362 4.299 20 0 EIADHM CC(C)[C@@H]1C[C@H](NC(=O)Cc2ccc([O-])c(F)c2)c2ccccc21 ZINC001171070035 1047974639 /nfs/dbraw/zinc/97/46/39/1047974639.db2.gz LMYCKEUTZPNQID-WMZOPIPTSA-N -1 3 327.399 4.075 20 0 EIADHM Cc1ccsc1-c1nsc([N-]C(=O)c2cc(F)cc(F)c2)n1 ZINC000131558799 1048038983 /nfs/dbraw/zinc/03/89/83/1048038983.db2.gz ZADUNSYARBXXLB-UHFFFAOYSA-N -1 3 337.376 4.106 20 0 EIADHM CCCCCC[C@@](C)(CC)C(=O)NCc1cc(=O)[n-]c(C2CCC2)n1 ZINC000825304587 1048064758 /nfs/dbraw/zinc/06/47/58/1048064758.db2.gz CLGGOENNLWIQSG-HXUWFJFHSA-N -1 3 347.503 4.453 20 0 EIADHM CCCCCC[C@@H](C)CC(=O)NCc1cc(=O)[n-]c(C2CCC2)n1 ZINC000825298559 1048064889 /nfs/dbraw/zinc/06/48/89/1048064889.db2.gz UUNFLWWGVDKGHG-CQSZACIVSA-N -1 3 333.476 4.063 20 0 EIADHM CC(=O)c1cccc(NC(=O)c2cc3c(s2)CC[C@H](C)C3)c1[O-] ZINC000556893076 1048119165 /nfs/dbraw/zinc/11/91/65/1048119165.db2.gz QZRUOSYDVPBTRJ-JTQLQIEISA-N -1 3 329.421 4.033 20 0 EIADHM CCCCC[C@@H](NC(=O)c1ccc(OC)cc1[O-])c1ccccc1 ZINC001143658292 1048139069 /nfs/dbraw/zinc/13/90/69/1048139069.db2.gz MLFYNRPUGYEIGV-GOSISDBHSA-N -1 3 327.424 4.452 20 0 EIADHM O=C(N[C@@H]1CC=CC[C@H]1C(F)(F)F)c1cc2sccc2c([O-])c1 ZINC000828546150 1048179333 /nfs/dbraw/zinc/17/93/33/1048179333.db2.gz PDWAODIAVAYRBX-VXGBXAGGSA-N -1 3 341.354 4.234 20 0 EIADHM CCc1cccc(C(=O)Nc2ccn(-c3ccc(Cl)cc3)n2)c1[O-] ZINC001144259628 1048538777 /nfs/dbraw/zinc/53/87/77/1048538777.db2.gz CZNGRNPOIWZNQU-UHFFFAOYSA-N -1 3 341.798 4.046 20 0 EIADHM COc1cc(NC(=O)c2cccc(C)c2[O-])c(C2CC2)cc1Cl ZINC001144266275 1048546223 /nfs/dbraw/zinc/54/62/23/1048546223.db2.gz JELCYZJJOSBMEX-UHFFFAOYSA-N -1 3 331.799 4.492 20 0 EIADHM O=C([N-]c1nc2c(s1)CCCC2)c1snc(Cl)c1Cl ZINC000845114328 1048600191 /nfs/dbraw/zinc/60/01/91/1048600191.db2.gz QWJJNAOWKZBQKD-UHFFFAOYSA-N -1 3 334.253 4.038 20 0 EIADHM O=C([N-]c1nc(-c2ccco2)cs1)c1ncc(C(F)(F)F)s1 ZINC001144403152 1048643340 /nfs/dbraw/zinc/64/33/40/1048643340.db2.gz BJMLUSJMXKNASN-UHFFFAOYSA-N -1 3 345.327 4.131 20 0 EIADHM CCc1ccc(C(=O)Nc2ccc(C(C)C)cc2C(=O)OC)c([O-])c1 ZINC001144558380 1048728331 /nfs/dbraw/zinc/72/83/31/1048728331.db2.gz RHQYHICOLAGOGG-UHFFFAOYSA-N -1 3 341.407 4.117 20 0 EIADHM C[C@@H]1CC(C)(C)c2cccc(NC(=O)Cc3ccc([O-])c(F)c3)c21 ZINC001144630986 1048763530 /nfs/dbraw/zinc/76/35/30/1048763530.db2.gz AETPKLCNTNENJN-GFCCVEGCSA-N -1 3 327.399 4.497 20 0 EIADHM C[C@H]([N-]C(=O)C(F)(F)c1ccc(F)cc1)c1cccc(Cl)c1 ZINC000920840960 1048801069 /nfs/dbraw/zinc/80/10/69/1048801069.db2.gz VFUIMMAHYHOBST-JTQLQIEISA-N -1 3 327.733 4.448 20 0 EIADHM O=C([N-]C1(c2ccc(F)cc2)CCC1)C(F)(F)c1ccc(F)cc1 ZINC000920844841 1048802305 /nfs/dbraw/zinc/80/23/05/1048802305.db2.gz LCZZZMZMRQBAQK-UHFFFAOYSA-N -1 3 337.316 4.252 20 0 EIADHM C[C@H](OC(=O)c1cc2cc(Cl)sc2[n-]1)c1ncc(Cl)n1C ZINC000810652948 1048833790 /nfs/dbraw/zinc/83/37/90/1048833790.db2.gz QELDKXXYNJNQQZ-LURJTMIESA-N -1 3 344.223 4.188 20 0 EIADHM [O-]c1ccc(F)c(CNc2cnn(-c3ccccc3Cl)c2)c1F ZINC000816558976 1048835262 /nfs/dbraw/zinc/83/52/62/1048835262.db2.gz SIWCDEMRIZCYPD-UHFFFAOYSA-N -1 3 335.741 4.122 20 0 EIADHM O=C(OCCCOCC(F)(F)F)c1cc2cc(Cl)sc2[n-]1 ZINC000810647025 1048839918 /nfs/dbraw/zinc/83/99/18/1048839918.db2.gz BOEMDIAWVGXWSB-UHFFFAOYSA-N -1 3 341.738 4.009 20 0 EIADHM O=C(NCCc1ccccc1)c1cc(Oc2ccccc2)ccc1[O-] ZINC001135659331 1048851853 /nfs/dbraw/zinc/85/18/53/1048851853.db2.gz LLWUPNIXYZXORR-UHFFFAOYSA-N -1 3 333.387 4.157 20 0 EIADHM Cc1nc(C(C)C)sc1[C@@H](C)N(C)Cc1ccccc1CC(=O)[O-] ZINC000846258387 1048852189 /nfs/dbraw/zinc/85/21/89/1048852189.db2.gz QISAJQFCMDDJKV-CQSZACIVSA-N -1 3 346.496 4.395 20 0 EIADHM CCc1cccc(C(=O)Nc2cnn(-c3ccccc3Cl)c2)c1[O-] ZINC001144840403 1048867079 /nfs/dbraw/zinc/86/70/79/1048867079.db2.gz PBUQMBXFNMFXIR-UHFFFAOYSA-N -1 3 341.798 4.046 20 0 EIADHM O=C(c1cc2sccc2c([O-])c1)N1CC(F)(c2ccccc2F)C1 ZINC000816943233 1048882771 /nfs/dbraw/zinc/88/27/71/1048882771.db2.gz QRQWKLZYLLOCTL-UHFFFAOYSA-N -1 3 345.370 4.067 20 0 EIADHM O=C(Nc1ccc([O-])c(C(F)(F)F)c1)[C@@H]1CSc2ccccc21 ZINC000134111751 1048884463 /nfs/dbraw/zinc/88/44/63/1048884463.db2.gz GLMQLSWARRCJPM-LLVKDONJSA-N -1 3 339.338 4.239 20 0 EIADHM CCc1ccncc1NC(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC001144919414 1048889090 /nfs/dbraw/zinc/88/90/90/1048889090.db2.gz VDIRWASYEPQNLH-UHFFFAOYSA-N -1 3 332.403 4.193 20 0 EIADHM Cc1ccc(C(F)(F)C(=O)[N-][C@@H](c2ccccc2)C(F)F)cc1 ZINC000817223952 1048910633 /nfs/dbraw/zinc/91/06/33/1048910633.db2.gz FXMVMBLRLOTRMN-AWEZNQCLSA-N -1 3 325.305 4.209 20 0 EIADHM O=c1ccnc(C=Cc2cnn(C3CCCC3)c2-c2ccccc2)[n-]1 ZINC000817345161 1048951110 /nfs/dbraw/zinc/95/11/10/1048951110.db2.gz BFLPLBTWAHZUIY-KHPPLWFESA-N -1 3 332.407 4.331 20 0 EIADHM CCN(CC(C)C)C(=O)c1cc(CCc2ccccc2)ccc1[O-] ZINC001135915152 1048967623 /nfs/dbraw/zinc/96/76/23/1048967623.db2.gz ABVCHXXLSDOQRV-UHFFFAOYSA-N -1 3 325.452 4.296 20 0 EIADHM Cc1ccc(C[C@@H]2CCCN2C(=O)c2cc([O-])ccc2Cl)cc1 ZINC001146421752 1049024419 /nfs/dbraw/zinc/02/44/19/1049024419.db2.gz ZAJKQPCOMKRALJ-HNNXBMFYSA-N -1 3 329.827 4.201 20 0 EIADHM Cc1cc(=O)[n-]c([C@@H](C)Sc2nnc(-c3ccc(C)c(C)c3)o2)n1 ZINC000135205457 1049085799 /nfs/dbraw/zinc/08/57/99/1049085799.db2.gz DWMODHSDXCNFOY-GFCCVEGCSA-N -1 3 342.424 4.011 20 0 EIADHM CCN(c1ccc(NC(=O)c2ccc(C)c(C)c2[O-])cc1)C(C)C ZINC001136138841 1049152768 /nfs/dbraw/zinc/15/27/68/1049152768.db2.gz FRBANGBBXJMDDD-UHFFFAOYSA-N -1 3 326.440 4.496 20 0 EIADHM O=C([N-]c1cc(-c2ccc(Cl)s2)on1)c1cnoc1C1CC1 ZINC001147650520 1049200092 /nfs/dbraw/zinc/20/00/92/1049200092.db2.gz GQZFXDKNCINEMH-UHFFFAOYSA-N -1 3 335.772 4.174 20 0 EIADHM Cc1cc(Cl)nc(Cl)c1C(=O)Nc1cc([O-])cc(Cl)c1 ZINC001147900819 1049239097 /nfs/dbraw/zinc/23/90/97/1049239097.db2.gz LTQSVQGRIOMMFP-UHFFFAOYSA-N -1 3 331.586 4.308 20 0 EIADHM CC(C)N(Cc1nc2c3ccccc3oc2c(=O)[n-]1)c1ccccc1 ZINC000078662402 1049270714 /nfs/dbraw/zinc/27/07/14/1049270714.db2.gz MFAIRWDUUPESSB-UHFFFAOYSA-N -1 3 333.391 4.084 20 0 EIADHM COc1c(C)ccc(NC(=O)c2cc3sccc3c([O-])c2)c1C ZINC001136203418 1049280635 /nfs/dbraw/zinc/28/06/35/1049280635.db2.gz BJAYSBFZXXEMKE-UHFFFAOYSA-N -1 3 327.405 4.485 20 0 EIADHM C[C@@H]1CCC[C@H](NC(=O)c2cc(CCc3ccccc3)ccc2[O-])C1 ZINC001136204253 1049294186 /nfs/dbraw/zinc/29/41/86/1049294186.db2.gz ISLMRSDLNDAYDL-APWZRJJASA-N -1 3 337.463 4.486 20 0 EIADHM CCO[C@@H]1C[C@H](NC(=O)c2cc([O-])c3ccccc3c2)C12CCCC2 ZINC001148553449 1049332202 /nfs/dbraw/zinc/33/22/02/1049332202.db2.gz QFPIATYCZMHFHA-RBUKOAKNSA-N -1 3 339.435 4.013 20 0 EIADHM CC1(C)Oc2ccc(NC(=O)c3cc4c(cc3[O-])CCCC4)cc2O1 ZINC001136229657 1049334828 /nfs/dbraw/zinc/33/48/28/1049334828.db2.gz FCLUERPUWQUOMN-UHFFFAOYSA-N -1 3 339.391 4.031 20 0 EIADHM Cc1ccc(C(=O)Nc2ccc(F)c(Br)c2)c([O-])c1C ZINC001148573424 1049338753 /nfs/dbraw/zinc/33/87/53/1049338753.db2.gz UWGOLWOEMDNNAV-UHFFFAOYSA-N -1 3 338.176 4.163 20 0 EIADHM COc1cc(OC)cc([C@H](C)Nc2[n-]c(=O)c(Cl)cc2Cl)c1 ZINC001170929414 1049338731 /nfs/dbraw/zinc/33/87/31/1049338731.db2.gz ARDBNDATLYECKF-QMMMGPOBSA-N -1 3 343.210 4.284 20 0 EIADHM CC(=O)c1cc(C(=O)NC23CC4C[C@@](C)(C2)C[C@](C)(C4)C3)ccc1[O-] ZINC001148669228 1049358362 /nfs/dbraw/zinc/35/83/62/1049358362.db2.gz RKTDZGHDOPIGDX-DELCKGKKSA-N -1 3 341.451 4.074 20 0 EIADHM CCc1ccc(C(=O)N[C@H]2CC(C)(C)Cc3oc(C)cc32)c([O-])c1 ZINC001136256400 1049359860 /nfs/dbraw/zinc/35/98/60/1049359860.db2.gz YJOCUJGZPCUKPB-INIZCTEOSA-N -1 3 327.424 4.300 20 0 EIADHM O=C(C[C@@H](Cc1ccccc1)c1ccccc1)[N-]OC/C=C/Cl ZINC000812403920 1049451022 /nfs/dbraw/zinc/45/10/22/1049451022.db2.gz UEVLTMNSTFGJAW-VWGXWWAPSA-N -1 3 329.827 4.203 20 0 EIADHM C[C@@H](OC(=O)c1cc(Cl)c(Cl)[n-]1)C(=O)c1ccc(F)cc1F ZINC000828635795 1049499440 /nfs/dbraw/zinc/49/94/40/1049499440.db2.gz OPHAGIPMAVTVQD-ZCFIWIBFSA-N -1 3 348.132 4.028 20 0 EIADHM Cc1cccc(C)c1OC[C@@H](C)NC(=O)c1cc([O-])c2ccccc2c1 ZINC001136384493 1049565639 /nfs/dbraw/zinc/56/56/39/1049565639.db2.gz LXWGNMDXZTYCRX-MRXNPFEDSA-N -1 3 349.430 4.360 20 0 EIADHM CCc1ncsc1C(=O)[N-]c1nnc(-c2ccc(C)cc2C)s1 ZINC000138095457 1049713310 /nfs/dbraw/zinc/71/33/10/1049713310.db2.gz WVHKTJUHHCLZCK-UHFFFAOYSA-N -1 3 344.465 4.093 20 0 EIADHM O=c1cc(Nc2ccc(C(F)(F)F)cc2O)n(C2CCCC2)[n-]1 ZINC001212628715 1049813425 /nfs/dbraw/zinc/81/34/25/1049813425.db2.gz CWHLAAAPYSZEOA-UHFFFAOYSA-N -1 3 327.306 4.172 20 0 EIADHM Cc1noc(C(C)C)c1[N-]C(=O)c1csc(-c2ccccc2)n1 ZINC001134027734 1049857594 /nfs/dbraw/zinc/85/75/94/1049857594.db2.gz KEWAVTOGVDJCLX-UHFFFAOYSA-N -1 3 327.409 4.482 20 0 EIADHM Cc1cc2ccccc2[nH]c1=N[N-]C(=O)c1c(F)cccc1Cl ZINC000181326861 1050098969 /nfs/dbraw/zinc/09/89/69/1050098969.db2.gz AHAWSKZHNMJVSP-UHFFFAOYSA-N -1 3 329.762 4.093 20 0 EIADHM CC(C)(C)c1ccc(C2CCC(N=c3ncnc4[nH][n-]cc3-4)CC2)cc1 ZINC001186380561 1050315579 /nfs/dbraw/zinc/31/55/79/1050315579.db2.gz ILLDYWMRSJNTBW-UHFFFAOYSA-N -1 3 349.482 4.162 20 0 EIADHM O=S(=O)([N-]c1cc(O)ccc1Cl)c1csc2ccccc21 ZINC001186497963 1050340822 /nfs/dbraw/zinc/34/08/22/1050340822.db2.gz LXMMFOQIARYUPS-UHFFFAOYSA-N -1 3 339.825 4.061 20 0 EIADHM CC(=O)c1cccc([O-])c1NC(=O)c1ccc(Cc2ccccc2)cc1 ZINC001186548747 1050366834 /nfs/dbraw/zinc/36/68/34/1050366834.db2.gz OZWXHNBKSYIBJV-UHFFFAOYSA-N -1 3 345.398 4.438 20 0 EIADHM Cc1ccc([O-])c(NC(=O)c2ccc(Cl)c(C(F)(F)F)c2)n1 ZINC001186622870 1050370140 /nfs/dbraw/zinc/37/01/40/1050370140.db2.gz MAWVOOYGJBFTBN-UHFFFAOYSA-N -1 3 330.693 4.020 20 0 EIADHM CCCCC[C@H]([N-]S(=O)(=O)c1cccnc1Cl)C(C)(C)C ZINC001186922847 1050447826 /nfs/dbraw/zinc/44/78/26/1050447826.db2.gz XHZHWWOUXZMZCL-ZDUSSCGKSA-N -1 3 332.897 4.008 20 0 EIADHM CC1(C)[C@@H](c2ccc(Cl)cc2)CCN1C(=O)c1ccccc1[O-] ZINC001178530295 1050493293 /nfs/dbraw/zinc/49/32/93/1050493293.db2.gz KYNJOSZXSCPUQH-MRXNPFEDSA-N -1 3 329.827 4.454 20 0 EIADHM C[C@@H]1CC([N-]S(=O)(=O)c2c(Cl)cccc2Cl)C[C@@H](C)C1 ZINC001187164037 1050498066 /nfs/dbraw/zinc/49/80/66/1050498066.db2.gz KEQSWPDFTXLIRV-UWVGGRQHSA-N -1 3 336.284 4.096 20 0 EIADHM O=C(Nc1cc(F)cc(F)c1)Nc1c([O-])cccc1Br ZINC001187570347 1050575301 /nfs/dbraw/zinc/57/53/01/1050575301.db2.gz PVKGHNSFDAAUAP-UHFFFAOYSA-N -1 3 343.127 4.077 20 0 EIADHM Cc1ccccc1-c1cccc(NC(=O)c2[n-]nnc2C(F)(F)F)c1 ZINC001187766025 1050621471 /nfs/dbraw/zinc/62/14/71/1050621471.db2.gz BVULXLIBYGMIOL-UHFFFAOYSA-N -1 3 346.312 4.051 20 0 EIADHM Cc1ccccc1-c1cccc(NC(=O)c2nn[n-]c2C(F)(F)F)c1 ZINC001187766025 1050621477 /nfs/dbraw/zinc/62/14/77/1050621477.db2.gz BVULXLIBYGMIOL-UHFFFAOYSA-N -1 3 346.312 4.051 20 0 EIADHM C[C@@H](NCc1cccc([O-])c1Br)c1cc2cnccc2o1 ZINC001179429521 1050688982 /nfs/dbraw/zinc/68/89/82/1050688982.db2.gz DCVBSMUPXWWKIE-SNVBAGLBSA-N -1 3 347.212 4.147 20 0 EIADHM Cc1cc(=O)[n-]c(CSc2nc3ccccc3n2-c2ccccc2)n1 ZINC001188108035 1050700239 /nfs/dbraw/zinc/70/02/39/1050700239.db2.gz GVIXBQWSVWYEFT-UHFFFAOYSA-N -1 3 348.431 4.122 20 0 EIADHM COc1ccc2cc(Nc3ccc(-n4ccc(=O)[n-]4)cc3)ccc2c1 ZINC001174032057 1050714514 /nfs/dbraw/zinc/71/45/14/1050714514.db2.gz FBCYVUJYEZHMKI-UHFFFAOYSA-N -1 3 331.375 4.483 20 0 EIADHM CCc1ccc([O-])c(C(=O)Nc2ccc(Oc3ncccn3)cc2C)c1 ZINC000094057205 1050740816 /nfs/dbraw/zinc/74/08/16/1050740816.db2.gz UEQKIAGGDCGTBP-UHFFFAOYSA-N -1 3 349.390 4.098 20 0 EIADHM O=C(c1ccc(Nc2cc(F)c([O-])c(F)c2)cc1)N1CCCCC1 ZINC001174072080 1050744954 /nfs/dbraw/zinc/74/49/54/1050744954.db2.gz GURRSQDMQBGRTF-UHFFFAOYSA-N -1 3 332.350 4.040 20 0 EIADHM COc1ccc(NC(=O)[N-]c2cc(-c3ccco3)no2)cc1Cl ZINC001188443001 1050771357 /nfs/dbraw/zinc/77/13/57/1050771357.db2.gz KRDWACLEKVRLGL-UHFFFAOYSA-N -1 3 333.731 4.241 20 0 EIADHM CC1CCN(C(=O)c2cccc(Nc3ncc(Cl)cc3[O-])c2)CC1 ZINC001174203014 1050837927 /nfs/dbraw/zinc/83/79/27/1050837927.db2.gz FXSFRZKTNBECGN-UHFFFAOYSA-N -1 3 345.830 4.056 20 0 EIADHM CC1CCN(C(=O)c2cccc(Nc3ccc([O-])c(F)c3F)c2)CC1 ZINC001174203862 1050838673 /nfs/dbraw/zinc/83/86/73/1050838673.db2.gz JQGYYYOUPDXTLU-UHFFFAOYSA-N -1 3 346.377 4.286 20 0 EIADHM [O-]c1c(Br)ccc(Cl)c1Nc1ccc2nccn2c1 ZINC001174280008 1050860524 /nfs/dbraw/zinc/86/05/24/1050860524.db2.gz NJLZWBRLOHMVBF-UHFFFAOYSA-N -1 3 338.592 4.199 20 0 EIADHM Cc1c(F)cccc1NC(=O)Nc1cc(Br)ccc1[O-] ZINC001189052013 1050894434 /nfs/dbraw/zinc/89/44/34/1050894434.db2.gz UOFQYTAJBJDWAQ-UHFFFAOYSA-N -1 3 339.164 4.246 20 0 EIADHM [O-]c1cccc(Nc2ccnc(C(F)(F)F)c2)c1Br ZINC001174363377 1050927788 /nfs/dbraw/zinc/92/77/88/1050927788.db2.gz FWRIFNVJBXCZBJ-UHFFFAOYSA-N -1 3 333.107 4.312 20 0 EIADHM CC(C)(C)[C@@H]1CCC[C@@H]([N-]S(=O)(=O)c2cccnc2Cl)CC1 ZINC001189288348 1050946798 /nfs/dbraw/zinc/94/67/98/1050946798.db2.gz IODGUOONOFGXHP-CHWSQXEVSA-N -1 3 344.908 4.008 20 0 EIADHM O=S(=O)(Cc1ccc(F)c(F)c1)[N-]c1csc2ccccc12 ZINC001189272942 1050953290 /nfs/dbraw/zinc/95/32/90/1050953290.db2.gz QEFMOAWZCARJRP-UHFFFAOYSA-N -1 3 339.388 4.121 20 0 EIADHM CCCCOc1ccc(NC(=O)Nc2c([O-])cccc2C(C)=O)cc1 ZINC001189315246 1050961245 /nfs/dbraw/zinc/96/12/45/1050961245.db2.gz VCFLPIZGOKJIQK-UHFFFAOYSA-N -1 3 342.395 4.418 20 0 EIADHM CC(C)(C)c1ccccc1NC(=O)Nc1cc(=O)[n-]c(C2CC2)n1 ZINC001189563636 1051012534 /nfs/dbraw/zinc/01/25/34/1051012534.db2.gz JLOOMZUCZWPUKV-UHFFFAOYSA-N -1 3 326.400 4.001 20 0 EIADHM COC(=O)c1ccc([O-])cc1NC(=O)Nc1ccccc1C(C)(C)C ZINC001189599200 1051016864 /nfs/dbraw/zinc/01/68/64/1051016864.db2.gz MHFCKTMFQUUPGT-UHFFFAOYSA-N -1 3 342.395 4.120 20 0 EIADHM CC(C)c1cccc(F)c1[N-]S(=O)(=O)Cc1cc(F)ccc1F ZINC001189699058 1051042865 /nfs/dbraw/zinc/04/28/65/1051042865.db2.gz QVDAIAZIONMJHA-UHFFFAOYSA-N -1 3 343.370 4.169 20 0 EIADHM C[C@H](Sc1nc2c(cnn2C)c(=O)[n-]1)c1cccc2ccccc21 ZINC001189738460 1051054460 /nfs/dbraw/zinc/05/44/60/1051054460.db2.gz UZFOCGIYSMVPHA-NSHDSACASA-N -1 3 336.420 4.075 20 0 EIADHM Cc1cc(S(=O)(=O)[N-]C[C@@H]2CCC[C@H](C)[C@@H]2C)sc1Cl ZINC001189793717 1051066485 /nfs/dbraw/zinc/06/64/85/1051066485.db2.gz LSHYNRZLWLYPHK-DLOVCJGASA-N -1 3 335.922 4.061 20 0 EIADHM C[C@@H](O)c1ncc(C(=O)[N-]c2ccccc2SC(F)(F)F)s1 ZINC000773904097 1051160852 /nfs/dbraw/zinc/16/08/52/1051160852.db2.gz LGGLCDMDOQDTSG-SSDOTTSWSA-N -1 3 348.371 4.061 20 0 EIADHM O=S(=O)([N-]c1ccnc(C2CCC2)c1)c1ccc(C2CC2)cc1 ZINC001190471773 1051194806 /nfs/dbraw/zinc/19/48/06/1051194806.db2.gz KZXXASAUUGGYCS-UHFFFAOYSA-N -1 3 328.437 4.027 20 0 EIADHM Cc1noc2nc(C3CC3)cc(C(=O)Nc3ccc(Cl)cc3[O-])c12 ZINC000153572360 1051198234 /nfs/dbraw/zinc/19/82/34/1051198234.db2.gz YDCKTVZTDWUXJZ-UHFFFAOYSA-N -1 3 343.770 4.020 20 0 EIADHM O=C(Nc1ccc(Cl)cc1[O-])c1cc(Br)ccc1F ZINC000153650123 1051208824 /nfs/dbraw/zinc/20/88/24/1051208824.db2.gz VQKZGKMGJPZPMT-UHFFFAOYSA-N -1 3 344.567 4.200 20 0 EIADHM [O-]c1c(F)cc(Br)cc1Nc1ccc(F)c(F)c1F ZINC001174971558 1051254805 /nfs/dbraw/zinc/25/48/05/1051254805.db2.gz HJVUPRMFKJAMHF-UHFFFAOYSA-N -1 3 336.082 4.455 20 0 EIADHM CN(C)c1cccc(Nc2cc(Br)cc(F)c2[O-])c1 ZINC001174966814 1051277488 /nfs/dbraw/zinc/27/74/88/1051277488.db2.gz OKVYCAJHRPTXNZ-UHFFFAOYSA-N -1 3 325.181 4.103 20 0 EIADHM COc1cc(F)cc(Nc2cc(Br)cc(F)c2[O-])c1 ZINC001175010843 1051294583 /nfs/dbraw/zinc/29/45/83/1051294583.db2.gz PSOJENSEXPPNRF-UHFFFAOYSA-N -1 3 330.128 4.185 20 0 EIADHM C[C@@H](Oc1cccc(Cl)c1)C(=O)Nc1cc([O-])cc(Cl)c1 ZINC001181780703 1051307022 /nfs/dbraw/zinc/30/70/22/1051307022.db2.gz JZXLGLNHGPNWAX-SECBINFHSA-N -1 3 326.179 4.105 20 0 EIADHM [O-]c1cc(F)c(Nc2ccc(F)c(Br)c2F)c(F)c1 ZINC001175099512 1051345410 /nfs/dbraw/zinc/34/54/10/1051345410.db2.gz KKSZEMMKKDPPCI-UHFFFAOYSA-N -1 3 336.082 4.455 20 0 EIADHM [O-]c1cc(F)c(Nc2cc(F)c(F)cc2Br)c(F)c1 ZINC001175099717 1051346057 /nfs/dbraw/zinc/34/60/57/1051346057.db2.gz HHPJMGLUKWMDEV-UHFFFAOYSA-N -1 3 336.082 4.455 20 0 EIADHM [O-]c1cc(F)c(Nc2ccc(OC[C@H]3CCCO3)c(F)c2)c(F)c1 ZINC001175100361 1051347339 /nfs/dbraw/zinc/34/73/39/1051347339.db2.gz QXGHMOSVIDRVAR-GFCCVEGCSA-N -1 3 339.313 4.111 20 0 EIADHM COC(=O)c1ccc(Nc2c(F)cc([O-])cc2F)cc1C(F)(F)F ZINC001175102100 1051350048 /nfs/dbraw/zinc/35/00/48/1051350048.db2.gz DKPLYDIROBDXLX-UHFFFAOYSA-N -1 3 347.239 4.219 20 0 EIADHM COc1cccc(C(=O)C(F)(F)F)c1Nc1c(F)cc([O-])cc1F ZINC001175103677 1051351978 /nfs/dbraw/zinc/35/19/78/1051351978.db2.gz VKSJWEVOSMLUEH-UHFFFAOYSA-N -1 3 347.239 4.168 20 0 EIADHM CC(=O)c1cccc([O-])c1NC(=O)CO[C@@H]1C[C@H](C)CC[C@H]1C(C)C ZINC001182147654 1051404744 /nfs/dbraw/zinc/40/47/44/1051404744.db2.gz FBFWWBDXHBKBNS-QIIPPGSGSA-N -1 3 347.455 4.011 20 0 EIADHM CCCCc1ccc(S(=O)(=O)Nc2cccc([O-])c2Cl)cc1 ZINC001191249035 1051411252 /nfs/dbraw/zinc/41/12/52/1051411252.db2.gz LVFHLWAVBFFGBR-UHFFFAOYSA-N -1 3 339.844 4.189 20 0 EIADHM O=C([N-]c1cc(-c2cccc(C(F)(F)F)c2)no1)Nc1ccccn1 ZINC001191300164 1051418623 /nfs/dbraw/zinc/41/86/23/1051418623.db2.gz WZMIPNNNMUJTRX-UHFFFAOYSA-N -1 3 348.284 4.399 20 0 EIADHM [O-]c1ccc(F)c(Nc2cc(Br)cnc2Cl)c1F ZINC001175262805 1051501970 /nfs/dbraw/zinc/50/19/70/1051501970.db2.gz LYLXVWIBTLSRLL-UHFFFAOYSA-N -1 3 335.535 4.225 20 0 EIADHM [O-]c1ccc(F)c(Nc2ccnc(Cl)c2Br)c1F ZINC001175262536 1051501806 /nfs/dbraw/zinc/50/18/06/1051501806.db2.gz IZXRGQWZHUFLLV-UHFFFAOYSA-N -1 3 335.535 4.225 20 0 EIADHM Cc1cc(Nc2c(F)ccc([O-])c2F)n(Cc2ccc(F)cc2)n1 ZINC001175266758 1051503302 /nfs/dbraw/zinc/50/33/02/1051503302.db2.gz ZSVOXGRUYNUGJK-UHFFFAOYSA-N -1 3 333.313 4.106 20 0 EIADHM COc1ccc(Nc2c(F)ccc([O-])c2F)cc1Br ZINC001175266067 1051504726 /nfs/dbraw/zinc/50/47/26/1051504726.db2.gz UOHAINWIESQXGN-UHFFFAOYSA-N -1 3 330.128 4.185 20 0 EIADHM [O-]c1c(F)cc(Br)cc1Nc1c(F)ccc(O)c1F ZINC001175270457 1051507128 /nfs/dbraw/zinc/50/71/28/1051507128.db2.gz ZMWKNFSIKGYTRZ-UHFFFAOYSA-N -1 3 334.091 4.021 20 0 EIADHM [O-]c1ccc(F)c(Nc2cccc(-c3nc(CO)cs3)c2)c1F ZINC001175270866 1051510407 /nfs/dbraw/zinc/51/04/07/1051510407.db2.gz LTTYTARUQZVPSM-UHFFFAOYSA-N -1 3 334.347 4.030 20 0 EIADHM Cc1cc(-c2ccccc2)ccc1NC([O-])=NO[C@H]1CCCCO1 ZINC000775487202 1051560795 /nfs/dbraw/zinc/56/07/95/1051560795.db2.gz KOWTXNNWBIJJAJ-SFHVURJKSA-N -1 3 326.396 4.242 20 0 EIADHM Cc1cc(-c2ccccc2)ccc1NC(=O)[N-]O[C@H]1CCCCO1 ZINC000775487202 1051560808 /nfs/dbraw/zinc/56/08/08/1051560808.db2.gz KOWTXNNWBIJJAJ-SFHVURJKSA-N -1 3 326.396 4.242 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)N1CC2CC1(c1ccccc1)C2 ZINC000621009885 1051575045 /nfs/dbraw/zinc/57/50/45/1051575045.db2.gz BALHUPDHBBCAPJ-UHFFFAOYSA-N -1 3 339.410 4.002 20 0 EIADHM Cc1ccc(C(=O)Nc2nc(-c3ccccc3F)cs2)c([O-])c1 ZINC001182452930 1051579476 /nfs/dbraw/zinc/57/94/76/1051579476.db2.gz BBAFSLXRIMEBTG-UHFFFAOYSA-N -1 3 328.368 4.216 20 0 EIADHM O=C([O-])c1ccccc1OCCNC(c1ccccc1)c1ccccc1 ZINC000183930746 1051653165 /nfs/dbraw/zinc/65/31/65/1051653165.db2.gz GIEBKKKDJQQZHQ-UHFFFAOYSA-N -1 3 347.414 4.143 20 0 EIADHM CCn1c2cc(C)ccc2nc1-c1cc(Br)ccc1[O-] ZINC001250458031 1051653875 /nfs/dbraw/zinc/65/38/75/1051653875.db2.gz JEPOBFHYWBVJRL-UHFFFAOYSA-N -1 3 331.213 4.500 20 0 EIADHM C[C@H]1C(=O)CCN(C(=O)c2ccc(C(C)(C)C)cc2[O-])C12CCCC2 ZINC001192322849 1051688890 /nfs/dbraw/zinc/68/88/90/1051688890.db2.gz QCMJVVVBGIBWTN-AWEZNQCLSA-N -1 3 343.467 4.054 20 0 EIADHM CC(C)(C)c1ccc(C(=O)N2CCc3cc(F)c(F)cc3C2)c([O-])c1 ZINC001192322680 1051689020 /nfs/dbraw/zinc/68/90/20/1051689020.db2.gz JVHKUZWDRFZIJM-UHFFFAOYSA-N -1 3 345.389 4.166 20 0 EIADHM CCOC(=O)c1nc(C)oc1[N-]C(=O)Nc1ccc2sccc2c1 ZINC001192426006 1051716584 /nfs/dbraw/zinc/71/65/84/1051716584.db2.gz FWFKSBQYCNNGMC-UHFFFAOYSA-N -1 3 345.380 4.018 20 0 EIADHM CC(C)Cc1ccc(C(=O)Nc2ncc([O-])cc2Br)cc1 ZINC001192463782 1051742600 /nfs/dbraw/zinc/74/26/00/1051742600.db2.gz RBXLSPDTDWSRCM-UHFFFAOYSA-N -1 3 349.228 4.001 20 0 EIADHM CCc1cccc(C(=O)Nc2ccc3cccc(Cl)c3n2)c1[O-] ZINC001183063269 1051781034 /nfs/dbraw/zinc/78/10/34/1051781034.db2.gz KBPJFYPPPOUSKM-UHFFFAOYSA-N -1 3 326.783 4.409 20 0 EIADHM CSc1ccc(C(=O)Nc2cc(Br)ccc2[O-])s1 ZINC001192644717 1051788716 /nfs/dbraw/zinc/78/87/16/1051788716.db2.gz XZKWHEDBDXUOOH-UHFFFAOYSA-N -1 3 344.255 4.190 20 0 EIADHM CCC1(CC)Oc2ccc(NC(=O)c3cccc(C)c3[O-])cc2O1 ZINC001183203515 1051809822 /nfs/dbraw/zinc/80/98/22/1051809822.db2.gz ZUZRFQZAXVORRN-UHFFFAOYSA-N -1 3 327.380 4.240 20 0 EIADHM C[C@@H](NC(=O)Nc1c([O-])cccc1C(F)(F)F)c1ccc(F)cc1 ZINC001193143545 1051879149 /nfs/dbraw/zinc/87/91/49/1051879149.db2.gz LKUWEOZZWLPGMB-SECBINFHSA-N -1 3 342.292 4.433 20 0 EIADHM O=C([N-]OC1CCCC1)[C@@H]1CC=CC[C@H]1c1nc2ccccc2s1 ZINC000775599088 1051928313 /nfs/dbraw/zinc/92/83/13/1051928313.db2.gz BVJFRQNFFZDMGW-HUUCEWRRSA-N -1 3 342.464 4.337 20 0 EIADHM CCCCOc1ccc(C(=O)NC[C@H]2C[C@H](C)C[C@H](C)C2)c([O-])c1 ZINC001183953060 1051931355 /nfs/dbraw/zinc/93/13/55/1051931355.db2.gz YCXAQKDXGIBQFQ-ZSHCYNCHSA-N -1 3 333.472 4.373 20 0 EIADHM CCC[C@@H](NC(=O)c1cc([O-])cc(C(F)(F)F)c1)c1ccccn1 ZINC000621856253 1051979878 /nfs/dbraw/zinc/97/98/78/1051979878.db2.gz LPFNPEKTXOUFHI-OAHLLOKOSA-N -1 3 338.329 4.077 20 0 EIADHM CCCCOc1ccc(C(=O)N[C@H]2CCc3c2cccc3F)c([O-])c1 ZINC001184324067 1051993550 /nfs/dbraw/zinc/99/35/50/1051993550.db2.gz CNFUKAIJUIXWGV-SFHVURJKSA-N -1 3 343.398 4.128 20 0 EIADHM O=C(NCc1sccc1Cl)c1ccc([O-])cc1C(F)(F)F ZINC001193759198 1051994250 /nfs/dbraw/zinc/99/42/50/1051994250.db2.gz QMTSUSHYLVDHAO-UHFFFAOYSA-N -1 3 335.734 4.056 20 0 EIADHM CCCCOc1ccc(C(=O)N[C@H](C)c2c(F)cccc2F)c([O-])c1 ZINC001184349134 1051998020 /nfs/dbraw/zinc/99/80/20/1051998020.db2.gz WOBNQQKPMSKGPD-GFCCVEGCSA-N -1 3 349.377 4.340 20 0 EIADHM Cc1ccc(C)c([C@H](C)N(C)C(=O)NCc2ccc([O-])c(F)c2)c1 ZINC000163658269 1051999655 /nfs/dbraw/zinc/99/96/55/1051999655.db2.gz JXTBVYVIDMMHGH-AWEZNQCLSA-N -1 3 330.403 4.051 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2cc(F)ccc2F)c2ccccc12 ZINC001193824614 1052005513 /nfs/dbraw/zinc/00/55/13/1052005513.db2.gz MIBSKRPDJAMPCH-UHFFFAOYSA-N -1 3 333.359 4.227 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2c(O)cccc2Cl)c2ccccc12 ZINC001193864692 1052018885 /nfs/dbraw/zinc/01/88/85/1052018885.db2.gz RYUCQJGPYRQSPS-UHFFFAOYSA-N -1 3 347.823 4.308 20 0 EIADHM Cc1ccc(Nc2cc(F)cc(N3CCOCC3)c2)c(Cl)c1[O-] ZINC001176500913 1052097019 /nfs/dbraw/zinc/09/70/19/1052097019.db2.gz GOTRXIQFNSHWDD-UHFFFAOYSA-N -1 3 336.794 4.073 20 0 EIADHM O=C(CCCC(=O)c1ccc(Cl)c(Cl)c1)[N-]OC1CCCC1 ZINC000774874931 1052234988 /nfs/dbraw/zinc/23/49/88/1052234988.db2.gz IJJPQSDYBDXZFJ-UHFFFAOYSA-N -1 3 344.238 4.337 20 0 EIADHM CCc1ccc(C(=O)N(C)[C@@H](C)Cc2ccc(Cl)cc2)c([O-])c1 ZINC000622381901 1052238116 /nfs/dbraw/zinc/23/81/16/1052238116.db2.gz FBFZAHDVHOIXOD-ZDUSSCGKSA-N -1 3 331.843 4.311 20 0 EIADHM Cc1ccc(C(C)(C)CN(C)C(=O)c2cc([O-])ccc2Cl)cc1 ZINC000622394270 1052250792 /nfs/dbraw/zinc/25/07/92/1052250792.db2.gz CVPVWICGWMYSRB-UHFFFAOYSA-N -1 3 331.843 4.404 20 0 EIADHM C[C@@H](N[C@@H](C)c1ccccn1)c1cc(Br)cc(F)c1[O-] ZINC000184845769 1052254446 /nfs/dbraw/zinc/25/44/46/1052254446.db2.gz DKBZYETYGAZOHL-ZJUUUORDSA-N -1 3 339.208 4.101 20 0 EIADHM Cc1ccc(C(=O)N2CCCC[C@@H]2c2ccc(F)cc2F)c([O-])c1 ZINC000622451666 1052272293 /nfs/dbraw/zinc/27/22/93/1052272293.db2.gz OOHBPPUOXIAFSC-QGZVFWFLSA-N -1 3 331.362 4.346 20 0 EIADHM CC(C)C[C@]1(C)CCCN1C(=O)c1cc([O-])cc(C(F)(F)F)c1 ZINC000622637637 1052360384 /nfs/dbraw/zinc/36/03/84/1052360384.db2.gz BOROODWYCVUSJP-INIZCTEOSA-N -1 3 329.362 4.452 20 0 EIADHM CC(C)c1ccc(C(=O)N2CCc3sc(Cl)cc3C2)c([O-])c1 ZINC000622735829 1052402720 /nfs/dbraw/zinc/40/27/20/1052402720.db2.gz HDTPFKITTOFBKX-UHFFFAOYSA-N -1 3 335.856 4.429 20 0 EIADHM C[C@@H](NCc1ccc(F)cc1Br)c1ccc(F)cc1[O-] ZINC000185111143 1052436106 /nfs/dbraw/zinc/43/61/06/1052436106.db2.gz BUUOGPURBWDCDR-SECBINFHSA-N -1 3 342.183 4.284 20 0 EIADHM C[C@H](NCc1ccc(F)cc1Br)c1ccc(F)cc1[O-] ZINC000185111124 1052436262 /nfs/dbraw/zinc/43/62/62/1052436262.db2.gz BUUOGPURBWDCDR-VIFPVBQESA-N -1 3 342.183 4.284 20 0 EIADHM O=C(Nc1cc(Br)ccc1[O-])c1ccc2ncsc2c1 ZINC000176188903 1052613736 /nfs/dbraw/zinc/61/37/36/1052613736.db2.gz QVEVHAJKOGBNLC-UHFFFAOYSA-N -1 3 349.209 4.017 20 0 EIADHM O=c1ccnc(C=Cc2cccc(OCCCc3ccccc3)c2)[n-]1 ZINC000764437339 1053102617 /nfs/dbraw/zinc/10/26/17/1053102617.db2.gz YVSHTLGBQKOTLV-VAWYXSNFSA-N -1 3 332.403 4.364 20 0 EIADHM Cc1c([O-])ccc2c(CN(c3ccccc3)[C@H]3C[C@@H]3C)cc(=O)oc12 ZINC001195045418 1053239830 /nfs/dbraw/zinc/23/98/30/1053239830.db2.gz IZVCKGQAAZNPIO-UGSOOPFHSA-N -1 3 335.403 4.222 20 0 EIADHM O=C([O-])CCc1cccc(CNCc2cccc(C(F)(F)F)c2)c1 ZINC000864517488 1053300862 /nfs/dbraw/zinc/30/08/62/1053300862.db2.gz GWJKAHUPTINLCS-UHFFFAOYSA-N -1 3 337.341 4.012 20 0 EIADHM [O-]c1cccc(CNCc2ccc(Br)s2)c1Cl ZINC000383135499 1053301955 /nfs/dbraw/zinc/30/19/55/1053301955.db2.gz JGNWPMBIUSRPHY-UHFFFAOYSA-N -1 3 332.650 4.159 20 0 EIADHM CCc1ccccc1[C@@H](CC(=O)[O-])NCc1cnc(C(C)C)s1 ZINC000864528320 1053306482 /nfs/dbraw/zinc/30/64/82/1053306482.db2.gz NTZSFEZOKMHRRH-MRXNPFEDSA-N -1 3 332.469 4.135 20 0 EIADHM Cc1ccc([N-]S(=O)(=O)c2cccc(C(C)C)c2)c(F)c1F ZINC001195156804 1053308217 /nfs/dbraw/zinc/30/82/17/1053308217.db2.gz RKVIBRVLVLVELO-UHFFFAOYSA-N -1 3 325.380 4.197 20 0 EIADHM COc1ccc(C(C)(C)C)cc1C(=O)Nc1c([O-])cccc1C(C)=O ZINC001195467475 1053417591 /nfs/dbraw/zinc/41/75/91/1053417591.db2.gz ZIAQTFRENARGIC-UHFFFAOYSA-N -1 3 341.407 4.153 20 0 EIADHM [O-]c1cccc(CNCc2cccc(Br)c2)c1Cl ZINC000385873072 1053555544 /nfs/dbraw/zinc/55/55/44/1053555544.db2.gz ZEYIVVQQGGBPOQ-UHFFFAOYSA-N -1 3 326.621 4.098 20 0 EIADHM [O-]c1cc(C(F)(F)F)ccc1NC(=S)NCc1ccc(F)cc1 ZINC001196489721 1053676103 /nfs/dbraw/zinc/67/61/03/1053676103.db2.gz NWBHMFGGVNFEDP-UHFFFAOYSA-N -1 3 344.333 4.037 20 0 EIADHM CC[C@H](NC(=O)c1cc([O-])c2ccccc2c1)c1ccc(OC)cc1 ZINC000471645320 1053677731 /nfs/dbraw/zinc/67/77/31/1053677731.db2.gz DYLQQUXKTQNANK-IBGZPJMESA-N -1 3 335.403 4.435 20 0 EIADHM [O-]c1cc(Cl)ccc1NC(=S)NCCCCC(F)(F)F ZINC000794980975 1053866293 /nfs/dbraw/zinc/86/62/93/1053866293.db2.gz AYXNZDLHOCCGJO-UHFFFAOYSA-N -1 3 326.771 4.065 20 0 EIADHM [O-]c1cccc2sc(NC(=S)Nc3ccc(Cl)cc3)nc21 ZINC001197299087 1053869100 /nfs/dbraw/zinc/86/91/00/1053869100.db2.gz SANHJJHAIULHOT-UHFFFAOYSA-N -1 3 335.841 4.464 20 0 EIADHM [O-]c1ccc(Br)cc1NC(=S)Nc1cccc(F)c1 ZINC001197638561 1053968981 /nfs/dbraw/zinc/96/89/81/1053968981.db2.gz RASYQWXMCSMTJB-UHFFFAOYSA-N -1 3 341.205 4.103 20 0 EIADHM [O-]c1cc(Br)ccc1NC(=S)Nc1cccc(F)c1 ZINC001197638382 1053969882 /nfs/dbraw/zinc/96/98/82/1053969882.db2.gz MHYYHFBMKDPOPU-UHFFFAOYSA-N -1 3 341.205 4.103 20 0 EIADHM CCCOc1ccc(S(=O)(=O)[N-]c2ccccc2CCC)cc1 ZINC000029048490 1053987958 /nfs/dbraw/zinc/98/79/58/1053987958.db2.gz LFUMYWJSLYHUGF-UHFFFAOYSA-N -1 3 333.453 4.229 20 0 EIADHM O=C(Nc1cc(Br)ccc1[O-])c1cccc(C2CCC2)n1 ZINC001197873116 1054012639 /nfs/dbraw/zinc/01/26/39/1054012639.db2.gz LWDDOGPSWKEBCV-UHFFFAOYSA-N -1 3 347.212 4.070 20 0 EIADHM Cc1nc(-c2ccc([C@H](C)NC(=O)c3ccccc3[O-])cc2)cs1 ZINC000030694318 1054045404 /nfs/dbraw/zinc/04/54/04/1054045404.db2.gz DJUFHPQFPAPCRH-LBPRGKRZSA-N -1 3 338.432 4.315 20 0 EIADHM Cc1ccccc1NC(=S)Nc1ccc(Br)cc1[O-] ZINC001198420357 1054140460 /nfs/dbraw/zinc/14/04/60/1054140460.db2.gz CARBSOCFAPDIST-UHFFFAOYSA-N -1 3 337.242 4.272 20 0 EIADHM CSc1ccc(CCCC(=O)[N-]OCCCC(F)(F)F)cc1 ZINC000871217159 1054169796 /nfs/dbraw/zinc/16/97/96/1054169796.db2.gz MKYKFQFXJVMAAW-UHFFFAOYSA-N -1 3 335.391 4.122 20 0 EIADHM COc1ccc([C@H]2CCN(C(=O)c3cc([O-])c4ccccc4c3)C2)cc1 ZINC000471945731 1054203948 /nfs/dbraw/zinc/20/39/48/1054203948.db2.gz YLZACCQIIPLHTE-KRWDZBQOSA-N -1 3 347.414 4.184 20 0 EIADHM O=C(N[C@H]1CCCOc2ccccc21)c1cc([O-])c2ccccc2c1 ZINC000471959299 1054204097 /nfs/dbraw/zinc/20/40/97/1054204097.db2.gz TZTUKEDFWSFWLU-SFHVURJKSA-N -1 3 333.387 4.189 20 0 EIADHM Cc1cccc(NC(=S)Nc2c([O-])cccc2Br)c1 ZINC001198687522 1054232091 /nfs/dbraw/zinc/23/20/91/1054232091.db2.gz BLQMMFXPFGFFRC-UHFFFAOYSA-N -1 3 337.242 4.272 20 0 EIADHM O=C(NCCc1cc2ccccc2o1)c1cc([O-])c2ccccc2c1 ZINC000472202742 1054246195 /nfs/dbraw/zinc/24/61/95/1054246195.db2.gz BHCDMRPLGYMZNQ-UHFFFAOYSA-N -1 3 331.371 4.264 20 0 EIADHM O=C(CCCOc1cccc2ccccc21)[N-]OC1CCCCC1 ZINC000857492248 1054276419 /nfs/dbraw/zinc/27/64/19/1054276419.db2.gz FLBTYZMNDXTRCL-UHFFFAOYSA-N -1 3 327.424 4.379 20 0 EIADHM O=C(CCOc1ccc(Cl)cc1Cl)[N-]OC1CCCCC1 ZINC000857492473 1054278597 /nfs/dbraw/zinc/27/85/97/1054278597.db2.gz JCOXVCZWUVIBCS-UHFFFAOYSA-N -1 3 332.227 4.143 20 0 EIADHM COc1ccc(S(=O)(=O)[N-]c2ccc(-c3ccco3)cc2)c(C)c1 ZINC001198939531 1054309438 /nfs/dbraw/zinc/30/94/38/1054309438.db2.gz HDGLBWPNGHKHOF-UHFFFAOYSA-N -1 3 343.404 4.064 20 0 EIADHM O=C(OCc1nc2ccccc2s1)c1cc(Cl)c(Cl)[n-]1 ZINC000011809117 1054321489 /nfs/dbraw/zinc/32/14/89/1054321489.db2.gz VSRZBXUVCYFXCO-UHFFFAOYSA-N -1 3 327.192 4.288 20 0 EIADHM Cc1cc([C@@H](C)N2CCC(c3cccc(F)c3)CC2)oc1C(=O)[O-] ZINC000872165930 1054418742 /nfs/dbraw/zinc/41/87/42/1054418742.db2.gz OUJCMHQFLQSTBA-CYBMUJFWSA-N -1 3 331.387 4.366 20 0 EIADHM [O-]c1cc(C(F)(F)F)ccc1NC(=S)Nc1ccc(F)cc1F ZINC001200927770 1054579833 /nfs/dbraw/zinc/57/98/33/1054579833.db2.gz FPCFCILCBPIXAV-UHFFFAOYSA-N -1 3 348.296 4.498 20 0 EIADHM O=C(Nc1ccc(Nc2cc(=O)[n-]c(C3CC3)n2)cc1)c1ccccc1 ZINC001201307428 1054749783 /nfs/dbraw/zinc/74/97/83/1054749783.db2.gz PPJNDKGNQWWYDG-UHFFFAOYSA-N -1 3 346.390 4.056 20 0 EIADHM O=C([O-])c1ccc(NC2=C[C@H]3CC[C@@H](C2)N3Cc2ccccc2)cc1 ZINC001201477630 1054829968 /nfs/dbraw/zinc/82/99/68/1054829968.db2.gz JSHQVZARBOVBJC-UXHICEINSA-N -1 3 334.419 4.118 20 0 EIADHM CCCCOc1ccc(Nc2ccc(C(N)=O)c([O-])c2)cc1Cl ZINC001201481399 1054833190 /nfs/dbraw/zinc/83/31/90/1054833190.db2.gz UEKYGGIIHHXYHN-UHFFFAOYSA-N -1 3 334.803 4.067 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2cccc(COCC3CC3)c2)c(C)c1 ZINC000064938390 1054891004 /nfs/dbraw/zinc/89/10/04/1054891004.db2.gz JPKKTURKRZALLG-UHFFFAOYSA-N -1 3 345.464 4.031 20 0 EIADHM COc1ccc(CC(C)(C)NC(=O)c2cc([O-])c3ccccc3c2)cc1 ZINC000473211789 1054987011 /nfs/dbraw/zinc/98/70/11/1054987011.db2.gz DRJIUMKAKAQPOU-UHFFFAOYSA-N -1 3 349.430 4.305 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(NCC[C@@H](C)c3ccccc3)nc2)n1 ZINC000068696599 1055090411 /nfs/dbraw/zinc/09/04/11/1055090411.db2.gz NLOOHNJIHJZWLB-OAHLLOKOSA-N -1 3 348.450 4.000 20 0 EIADHM COc1cc(CNC(=O)Nc2cccc(Cl)c2)cc(Cl)c1[O-] ZINC001202253688 1055098886 /nfs/dbraw/zinc/09/88/86/1055098886.db2.gz QTEFLTIDJGXIIT-UHFFFAOYSA-N -1 3 341.194 4.029 20 0 EIADHM O=C(Nc1ccc(Br)cc1)Nc1cc([O-])cc(Cl)c1 ZINC001202337027 1055144640 /nfs/dbraw/zinc/14/46/40/1055144640.db2.gz ZUOBRZIZUOTLKE-UHFFFAOYSA-N -1 3 341.592 4.452 20 0 EIADHM O=C([N-]c1nnc(C2CCCCC2)s1)c1ncsc1C1CC1 ZINC000878075174 1055183298 /nfs/dbraw/zinc/18/32/98/1055183298.db2.gz PPITZRBXRHTRTO-UHFFFAOYSA-N -1 3 334.470 4.172 20 0 EIADHM Cc1ccc(NC(=O)Nc2cc(Br)c(C)cc2[O-])cc1 ZINC001202432506 1055183665 /nfs/dbraw/zinc/18/36/65/1055183665.db2.gz CEASTGSDHCLRQB-UHFFFAOYSA-N -1 3 335.201 4.416 20 0 EIADHM O=C([N-]c1nnc(C(F)F)s1)c1cc2cccc(Cl)c2o1 ZINC000084532883 1055213920 /nfs/dbraw/zinc/21/39/20/1055213920.db2.gz JRQFJXLIGAJBPP-UHFFFAOYSA-N -1 3 329.715 4.128 20 0 EIADHM [O-]c1ccccc1-c1nnc(CN[C@@H](c2ccccc2)C2CCC2)o1 ZINC000878238200 1055216972 /nfs/dbraw/zinc/21/69/72/1055216972.db2.gz NOHZUFWDXBGPRL-IBGZPJMESA-N -1 3 335.407 4.073 20 0 EIADHM CCCCN(C)c1ccc(NC(=O)c2c[n-]c3ccccc3c2=O)cc1 ZINC000107276937 1055220332 /nfs/dbraw/zinc/22/03/32/1055220332.db2.gz YZMOFSFANXRABC-UHFFFAOYSA-N -1 3 349.434 4.017 20 0 EIADHM CC(C)c1cccc2c1CCN(Cc1nnc(-c3ccccc3[O-])o1)C2 ZINC000878501157 1055325976 /nfs/dbraw/zinc/32/59/76/1055325976.db2.gz MIIHUBHOMOZVDJ-UHFFFAOYSA-N -1 3 349.434 4.124 20 0 EIADHM CC(C)N(Cc1nnc(-c2ccccc2[O-])o1)[C@H](C)c1ccsc1 ZINC000878722379 1055382892 /nfs/dbraw/zinc/38/28/92/1055382892.db2.gz FUPUTPGKDLTBQL-CYBMUJFWSA-N -1 3 343.452 4.475 20 0 EIADHM Cc1noc(-c2ccccc2)c1NC(=O)c1cc([O-])ccc1Cl ZINC000499396843 1055632955 /nfs/dbraw/zinc/63/29/55/1055632955.db2.gz JLMCLUWTEMYGSQ-UHFFFAOYSA-N -1 3 328.755 4.261 20 0 EIADHM CCCCc1nc(NC(=O)[C@@H](C)CC2CCCC2)c(C(=O)OCC)[n-]1 ZINC001128074518 1055714954 /nfs/dbraw/zinc/71/49/54/1055714954.db2.gz ZUDKZIUMYOYORL-ZDUSSCGKSA-N -1 3 349.475 4.084 20 0 EIADHM CCCCc1nc(NC(=O)[C@@H]2CCCCC2(C)C)c(C(=O)OCC)[n-]1 ZINC001128072954 1055716572 /nfs/dbraw/zinc/71/65/72/1055716572.db2.gz BMAHBHHHNUKLIF-ZDUSSCGKSA-N -1 3 349.475 4.084 20 0 EIADHM Cc1ccccc1[C@H]1C[C@@H](C)N(C(=O)c2cc(=O)c3ccccc3[n-]2)C1 ZINC000265717328 1055801115 /nfs/dbraw/zinc/80/11/15/1055801115.db2.gz XWBYYMDUEUUTHW-CVEARBPZSA-N -1 3 346.430 4.267 20 0 EIADHM Cc1ccccc1[C@H]1C[C@H](C)N(C(=O)c2cc(=O)c3ccccc3[n-]2)C1 ZINC000265717329 1055801481 /nfs/dbraw/zinc/80/14/81/1055801481.db2.gz XWBYYMDUEUUTHW-HOTGVXAUSA-N -1 3 346.430 4.267 20 0 EIADHM CC[C@](C)([N-]C(=O)C(F)(F)c1ccccc1F)c1nc(C)cs1 ZINC000765830493 1055809187 /nfs/dbraw/zinc/80/91/87/1055809187.db2.gz DEQXEOBINWYKHR-HNNXBMFYSA-N -1 3 342.386 4.124 20 0 EIADHM O=C(NCc1cnc2ccccc2c1)c1cc([O-])c2ccccc2c1 ZINC000353346617 1055855467 /nfs/dbraw/zinc/85/54/67/1055855467.db2.gz LYUTZHFBTJTICV-UHFFFAOYSA-N -1 3 328.371 4.024 20 0 EIADHM COc1ccc(CCC(=O)Nc2cc(Cl)ccc2[O-])cc1Cl ZINC000111210120 1056770564 /nfs/dbraw/zinc/77/05/64/1056770564.db2.gz PRGMERMLNBWIDW-UHFFFAOYSA-N -1 3 340.206 4.279 20 0 EIADHM CCOc1ccc(C(=O)CCC(=O)Nc2cc(Cl)ccc2[O-])cc1 ZINC000111210647 1056772565 /nfs/dbraw/zinc/77/25/65/1056772565.db2.gz VKASTWHZWDFCEX-UHFFFAOYSA-N -1 3 347.798 4.046 20 0 EIADHM O=C(CCOc1ccccc1)[N-]OCc1cc(Cl)ccc1Cl ZINC000742360085 1058571985 /nfs/dbraw/zinc/57/19/85/1058571985.db2.gz XFELITHXUBAWNP-UHFFFAOYSA-N -1 3 340.206 4.010 20 0 EIADHM Cc1cc(=O)[n-]c(-c2cccc(OC(=O)C[C@@H]3CCCC[C@H]3C)c2)n1 ZINC000744219274 1059333814 /nfs/dbraw/zinc/33/38/14/1059333814.db2.gz QJHGRETVJGPPBY-HIFRSBDPSA-N -1 3 340.423 4.279 20 0 EIADHM Cc1ccc(CCC(=O)Oc2cccc(-c3nc(C)cc(=O)[n-]3)c2)cc1 ZINC000744218891 1059336611 /nfs/dbraw/zinc/33/66/11/1059336611.db2.gz GHFXZXGJUKNALM-UHFFFAOYSA-N -1 3 348.402 4.004 20 0 EIADHM Cc1nonc1[N-]C(=O)c1ccc(-c2ccc(C(C)(C)C)cc2)o1 ZINC000744362349 1059439044 /nfs/dbraw/zinc/43/90/44/1059439044.db2.gz PLEAGNHVTLCRTG-UHFFFAOYSA-N -1 3 325.368 4.188 20 0 EIADHM COC(=O)Nc1ccc(C(=O)O[C@@H](C)c2ccc(Cl)cc2)cc1[O-] ZINC000745652301 1059864783 /nfs/dbraw/zinc/86/47/83/1059864783.db2.gz IAJKYZJDIAXTTJ-JTQLQIEISA-N -1 3 349.770 4.142 20 0 EIADHM COC(=O)Nc1ccc(C(=O)O[C@H](C)c2ccccc2Cl)cc1[O-] ZINC000745650671 1059865733 /nfs/dbraw/zinc/86/57/33/1059865733.db2.gz JYUCUULYBZDFRQ-SNVBAGLBSA-N -1 3 349.770 4.142 20 0 EIADHM O=C([N-]c1cccc2oc(C(F)(F)F)nc21)c1scnc1Cl ZINC000766510816 1060433423 /nfs/dbraw/zinc/43/34/23/1060433423.db2.gz WLDOCXYWCAYWQV-UHFFFAOYSA-N -1 3 347.705 4.209 20 0 EIADHM COc1ccc(-c2ccccn2)nc1Nc1ccc(Cl)c([O-])c1 ZINC001212587985 1060737413 /nfs/dbraw/zinc/73/74/13/1060737413.db2.gz DDPJJSDFXTYCKH-UHFFFAOYSA-N -1 3 327.771 4.255 20 0 EIADHM CCOc1cc(Nc2ccc(Cl)c([O-])c2)cnc1Br ZINC001212589361 1060775527 /nfs/dbraw/zinc/77/55/27/1060775527.db2.gz HPVDQDZDGDOKKS-UHFFFAOYSA-N -1 3 343.608 4.345 20 0 EIADHM Cc1cc2c(cc1C)N(C(=O)CCCc1ccc([O-])c(F)c1)CC2 ZINC000804319890 1060800305 /nfs/dbraw/zinc/80/03/05/1060800305.db2.gz JBARJASRFVBFMI-UHFFFAOYSA-N -1 3 327.399 4.060 20 0 EIADHM COC(=O)c1sc2nc(C)ccc2c1Nc1ccc(Cl)c([O-])c1 ZINC001212590310 1060818682 /nfs/dbraw/zinc/81/86/82/1060818682.db2.gz GEDDTTZQTWHNTG-UHFFFAOYSA-N -1 3 348.811 4.494 20 0 EIADHM C[C@@H]1CCc2sc(Nc3ccc(Cl)c([O-])c3)c(C(N)=O)c2C1 ZINC001212590437 1060826724 /nfs/dbraw/zinc/82/67/24/1060826724.db2.gz MLNPXMHILRKOMX-MRVPVSSYSA-N -1 3 336.844 4.074 20 0 EIADHM O=C(Nc1cccnc1)c1ccccc1Nc1ccc(Cl)c([O-])c1 ZINC001212592569 1060891499 /nfs/dbraw/zinc/89/14/99/1060891499.db2.gz WPBCGZACPJDQRT-UHFFFAOYSA-N -1 3 339.782 4.437 20 0 EIADHM O=C(c1ccccc1[O-])N1CC[C@@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000767138905 1061123682 /nfs/dbraw/zinc/12/36/82/1061123682.db2.gz QWGKHEWBFFTLPJ-CYBMUJFWSA-N -1 3 335.325 4.041 20 0 EIADHM CCN(CC)Cc1nc(=O)c2c(-c3ccccc3Cl)csc2[n-]1 ZINC000036203754 213077947 /nfs/dbraw/zinc/07/79/47/213077947.db2.gz NXKZUPVOSOPVEL-UHFFFAOYSA-N -1 3 347.871 4.147 20 0 EIADHM O=C([O-])[C@@H]1CN(Cc2ccc(-c3ccccc3)cc2)C[C@H]1C(F)(F)F ZINC000299746715 564150624 /nfs/dbraw/zinc/15/06/24/564150624.db2.gz ZINFAKZRTSBSSS-IAGOWNOFSA-N -1 3 349.352 4.049 20 0 EIADHM CC(=O)c1cccc(NC(=O)C2(C(F)(F)F)CCCCC2)c1[O-] ZINC000614861074 1032078251 /nfs/dbraw/zinc/07/82/51/1032078251.db2.gz KATJQYNLWYRGQG-UHFFFAOYSA-N -1 3 329.318 4.046 20 0 EIADHM CCCc1cc(=O)[n-]c(C(=Cc2ccc(OCC(F)F)cc2)CC)n1 ZINC000193617390 1032165548 /nfs/dbraw/zinc/16/55/48/1032165548.db2.gz JAAUKWMFCOBNDT-UVTDQMKNSA-N -1 3 348.393 4.317 20 0 EIADHM O=C(Cc1ccc([O-])c(F)c1)Nc1ccc(OC2CCCC2)c(F)c1 ZINC000449968175 1032169575 /nfs/dbraw/zinc/16/95/75/1032169575.db2.gz NCEZKQGFCNGWID-UHFFFAOYSA-N -1 3 347.361 4.173 20 0 EIADHM O=C(COc1ccc(C(F)(F)F)cc1)Nc1ccc(Cl)cc1[O-] ZINC000532836507 1032341638 /nfs/dbraw/zinc/34/16/38/1032341638.db2.gz BHTRFRCYGOIKHC-UHFFFAOYSA-N -1 3 345.704 4.082 20 0 EIADHM CCc1cccc2c(CC(=O)Nc3ccc(Cl)cc3[O-])c[nH]c21 ZINC000532838948 1032344894 /nfs/dbraw/zinc/34/48/94/1032344894.db2.gz DUXWINWBTURRMW-UHFFFAOYSA-N -1 3 328.799 4.271 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)c1ccc2c(c1)Cc1ccccc1-2 ZINC000532867458 1032366188 /nfs/dbraw/zinc/36/61/88/1032366188.db2.gz NTMBNPOPSWVNNL-UHFFFAOYSA-N -1 3 333.362 4.033 20 0 EIADHM O=C(Nc1ccc(Cl)cc1[O-])c1cccc(-c2cscn2)c1 ZINC000533160052 1032514788 /nfs/dbraw/zinc/51/47/88/1032514788.db2.gz LWTKEUQEEZJHDK-UHFFFAOYSA-N -1 3 330.796 4.421 20 0 EIADHM CCCCCOc1ccc(CNCc2cccc(C(=O)[O-])c2)cc1 ZINC000683170607 1019084387 /nfs/dbraw/zinc/08/43/87/1019084387.db2.gz JKOPMHBAUGIIBC-UHFFFAOYSA-N -1 3 327.424 4.244 20 0 EIADHM CC[C@@H](C)c1ccc(S(=O)(=O)[N-]c2cc3c(cc2C)OCO3)cc1 ZINC000510134350 1019837959 /nfs/dbraw/zinc/83/79/59/1019837959.db2.gz LJXUUSAURSBRIQ-GFCCVEGCSA-N -1 3 347.436 4.038 20 0 EIADHM C[C@@H](NCc1cc(Cl)sc1Cl)c1nc(C(F)(F)F)n[n-]1 ZINC001207666355 1032870849 /nfs/dbraw/zinc/87/08/49/1032870849.db2.gz XKBVWOZQGCJDDY-SCSAIBSYSA-N -1 3 345.177 4.043 20 0 EIADHM CC[C@](C)(NC(=O)c1cc(CCc2ccccc2)ccc1[O-])C1CC1 ZINC001167197702 1020531290 /nfs/dbraw/zinc/53/12/90/1020531290.db2.gz ZKAPHTGBZXQALP-QFIPXVFZSA-N -1 3 337.463 4.486 20 0 EIADHM CC[C@@H]1CCCCN1Cc1csc(-c2ccc(C(=O)[O-])cc2)n1 ZINC000652366631 1020533490 /nfs/dbraw/zinc/53/34/90/1020533490.db2.gz FBINOWYXQJKIMC-MRXNPFEDSA-N -1 3 330.453 4.273 20 0 EIADHM O=C([O-])C[C@H](NCc1ccc(F)c(C(F)(F)F)c1)c1cccs1 ZINC000322020739 1020563257 /nfs/dbraw/zinc/56/32/57/1020563257.db2.gz GDLYFRGMVUZYKH-LBPRGKRZSA-N -1 3 347.333 4.212 20 0 EIADHM CC(C)(C)Cc1csc([N-]C(=O)c2scnc2C(F)(F)F)n1 ZINC000410676866 1032958006 /nfs/dbraw/zinc/95/80/06/1032958006.db2.gz XNJRQRXXEWNZRJ-UHFFFAOYSA-N -1 3 349.403 4.459 20 0 EIADHM CC(C)c1ccc([C@@H](NC(=O)NCc2ncccc2[O-])C(C)C)cc1 ZINC000471523301 1021508638 /nfs/dbraw/zinc/50/86/38/1021508638.db2.gz SCULFXZNCHOEAQ-IBGZPJMESA-N -1 3 341.455 4.107 20 0 EIADHM [O-]c1cccc(Nc2ccc3nc(-c4ccccc4)nn3c2)c1Cl ZINC001210855733 1021809016 /nfs/dbraw/zinc/80/90/16/1021809016.db2.gz UDSUZBVNZRNFEH-UHFFFAOYSA-N -1 3 336.782 4.499 20 0 EIADHM O=S(=O)([N-]c1ccc(Cl)cc1F)c1ccc(C(F)F)cc1 ZINC000580369896 1021918190 /nfs/dbraw/zinc/91/81/90/1021918190.db2.gz KAPGMJOHKVXQGP-UHFFFAOYSA-N -1 3 335.734 4.218 20 0 EIADHM CCc1cc(=O)[n-]c(CSCc2csc(-c3ccsc3)n2)n1 ZINC000125601766 1022023631 /nfs/dbraw/zinc/02/36/31/1022023631.db2.gz BQGDVAGUOPGABI-UHFFFAOYSA-N -1 3 349.506 4.363 20 0 EIADHM Cc1ccc(CC(=O)[N-]O[C@@H](C)c2ncc(-c3ccccc3)o2)cc1 ZINC000178160159 1022058844 /nfs/dbraw/zinc/05/88/44/1022058844.db2.gz BKHCNOOJYMXEOW-HNNXBMFYSA-N -1 3 336.391 4.002 20 0 EIADHM CCc1cccc(C(=O)N(C)[C@H](COC)c2ccc(Cl)cc2)c1[O-] ZINC000580512604 1022140073 /nfs/dbraw/zinc/14/00/73/1022140073.db2.gz LWTHCKDXIZNZIN-QGZVFWFLSA-N -1 3 347.842 4.068 20 0 EIADHM O=C(Nc1ccc(Cl)cc1[O-])c1csc(-c2ccc(O)cc2)n1 ZINC000754497085 1022184727 /nfs/dbraw/zinc/18/47/27/1022184727.db2.gz JXTVOBMYDXBMIQ-UHFFFAOYSA-N -1 3 346.795 4.127 20 0 EIADHM CC(=O)c1csc(C(=O)[N-]c2nnc(CC3CCCCC3)s2)c1 ZINC000106651994 1022485231 /nfs/dbraw/zinc/48/52/31/1022485231.db2.gz QZRWTCAEJJBTIC-UHFFFAOYSA-N -1 3 349.481 4.177 20 0 EIADHM COc1cccc(SC)c1[N-]C(=O)c1coc(C2CCCC2)n1 ZINC000416123570 1022492192 /nfs/dbraw/zinc/49/21/92/1022492192.db2.gz QRDWBXPMIXCUKH-UHFFFAOYSA-N -1 3 332.425 4.315 20 0 EIADHM [O-]c1cccnc1CSc1nnc(-c2cccc3ccccc32)o1 ZINC000580812058 1022538914 /nfs/dbraw/zinc/53/89/14/1022538914.db2.gz HCKGDCKCCAWHGL-UHFFFAOYSA-N -1 3 335.388 4.283 20 0 EIADHM O=C(Nc1cccc([O-])c1F)c1ccc(Cl)cc1C(F)(F)F ZINC000186278807 1022554453 /nfs/dbraw/zinc/55/44/53/1022554453.db2.gz PBROYMADFGPSHC-UHFFFAOYSA-N -1 3 333.668 4.456 20 0 EIADHM Cc1ccc(C(=O)N2CCC(=Cc3cccc(F)c3)CC2)c([O-])c1 ZINC000042765207 1022810687 /nfs/dbraw/zinc/81/06/87/1022810687.db2.gz MPMKNQQWIGONEE-UHFFFAOYSA-N -1 3 325.383 4.159 20 0 EIADHM Cc1cccc2c1CC[C@H]2NCc1cccc([O-])c1Br ZINC000656497546 1023058585 /nfs/dbraw/zinc/05/85/85/1023058585.db2.gz HTFVGVILQAPZKK-OAHLLOKOSA-N -1 3 332.241 4.240 20 0 EIADHM Cc1cc(F)c(-c2noc(C=C([O-])c3ccccc3Cl)n2)cc1F ZINC001211647400 1023223447 /nfs/dbraw/zinc/22/34/47/1023223447.db2.gz NSPLPJXTSIOCRK-UHFFFAOYSA-N -1 3 348.736 4.402 20 0 EIADHM C[C@@H]1CN(Cc2ccc(Oc3ccccc3)c(F)c2)CC[C@@H]1C(=O)[O-] ZINC000659800933 1023281017 /nfs/dbraw/zinc/28/10/17/1023281017.db2.gz ANOPLTLBQCBONS-PBHICJAKSA-N -1 3 343.398 4.161 20 0 EIADHM O=C([O-])c1ccc(-c2nc(CN3CCC[C@H](C4CCC4)C3)co2)cc1 ZINC000659802859 1023286298 /nfs/dbraw/zinc/28/62/98/1023286298.db2.gz YGWOMSASASELIV-KRWDZBQOSA-N -1 3 340.423 4.052 20 0 EIADHM O=C(c1ccccc1[O-])N1CC[C@@H](Cc2ccc(C(F)F)cc2)C1 ZINC000364101109 1023294607 /nfs/dbraw/zinc/29/46/07/1023294607.db2.gz PMBDMRZGQMUDEN-AWEZNQCLSA-N -1 3 331.362 4.035 20 0 EIADHM [O-]c1ccccc1-c1nc(-c2ccc(OCc3cccnc3)cc2)no1 ZINC000182500001 1023310239 /nfs/dbraw/zinc/31/02/39/1023310239.db2.gz NQBUWFNMFYKGIY-UHFFFAOYSA-N -1 3 345.358 4.083 20 0 EIADHM CC(C)c1ccc([C@H](CC(=O)[O-])NCc2cnn(C(C)(C)C)c2)cc1 ZINC000417573504 1023359463 /nfs/dbraw/zinc/35/94/63/1023359463.db2.gz QFRSFAYBJFPISE-SFHVURJKSA-N -1 3 343.471 4.067 20 0 EIADHM Cc1ccc(C[C@@H](CNCc2c(F)cc(C)cc2Cl)C(=O)[O-])cc1 ZINC000417568190 1023361328 /nfs/dbraw/zinc/36/13/28/1023361328.db2.gz POSPMQWTILTWRX-HNNXBMFYSA-N -1 3 349.833 4.129 20 0 EIADHM CC1(C)Cc2cccc(CN[C@@H](CCC(=O)[O-])c3ccccc3)c2O1 ZINC000417605030 1023369152 /nfs/dbraw/zinc/36/91/52/1023369152.db2.gz WUMHLCCMKXRTMH-SFHVURJKSA-N -1 3 339.435 4.096 20 0 EIADHM CC(C)(C)c1ccc(-c2ccc(CN[C@H]3C=C[C@@H](C(=O)[O-])C3)o2)cc1 ZINC000417613061 1023380413 /nfs/dbraw/zinc/38/04/13/1023380413.db2.gz CHXUNOOHDKMIBG-WBVHZDCISA-N -1 3 339.435 4.363 20 0 EIADHM O=C([O-])[C@@H](c1c(F)cccc1Cl)N1CCC(C2CCC2)CC1 ZINC000656758745 1023500453 /nfs/dbraw/zinc/50/04/53/1023500453.db2.gz NEBHHKFSCOXGQF-MRXNPFEDSA-N -1 3 325.811 4.117 20 0 EIADHM Cc1oc2ccccc2c1CCNC(=O)c1cc([O-])ccc1Cl ZINC000500379733 1023767932 /nfs/dbraw/zinc/76/79/32/1023767932.db2.gz HUMCLTSJIZACGD-UHFFFAOYSA-N -1 3 329.783 4.073 20 0 EIADHM Cc1ccc(Cl)c([N-]S(=O)(=O)c2cccc3c(C)ccnc32)c1 ZINC000548282843 1023818036 /nfs/dbraw/zinc/81/80/36/1023818036.db2.gz HYZOWIQAASZIBD-UHFFFAOYSA-N -1 3 346.839 4.306 20 0 EIADHM CC[C@@H](C)Oc1ccc([N-]S(=O)(=O)c2ccc(Cl)cc2)cc1 ZINC000511696840 1023829293 /nfs/dbraw/zinc/82/92/93/1023829293.db2.gz ZLEZUGDMITVOKD-GFCCVEGCSA-N -1 3 339.844 4.318 20 0 EIADHM Cc1nc(S(=O)(=O)[C@@H](C)c2ccc(F)cc2)[n-]c1-c1ccccc1 ZINC000548298911 1023834657 /nfs/dbraw/zinc/83/46/57/1023834657.db2.gz JBZQMJGIDGYUOY-ZDUSSCGKSA-N -1 3 344.411 4.059 20 0 EIADHM Cc1[n-]c(S(=O)(=O)[C@@H](C)c2ccc(F)cc2)nc1-c1ccccc1 ZINC000548298911 1023834659 /nfs/dbraw/zinc/83/46/59/1023834659.db2.gz JBZQMJGIDGYUOY-ZDUSSCGKSA-N -1 3 344.411 4.059 20 0 EIADHM Cc1cc(Cl)ccc1S(=O)(=O)[N-]c1cc(Cl)ccc1F ZINC000048653641 1024675904 /nfs/dbraw/zinc/67/59/04/1024675904.db2.gz ITHUHXRRJXKQEA-UHFFFAOYSA-N -1 3 334.199 4.242 20 0 EIADHM CC(C)c1ccc(S(=O)(=O)[N-]c2cc(F)cc(F)c2F)cc1 ZINC000431136804 1024678009 /nfs/dbraw/zinc/67/80/09/1024678009.db2.gz GLXROBYVTDKGMI-UHFFFAOYSA-N -1 3 329.343 4.028 20 0 EIADHM Cc1[nH]c2c(cc(C)cc2CNCc2c(F)ccc([O-])c2F)c1C ZINC000510874559 1024701354 /nfs/dbraw/zinc/70/13/54/1024701354.db2.gz MLMCXHSCYIDVJS-UHFFFAOYSA-N -1 3 330.378 4.367 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-][C@@H](C)c2ccccc2C(F)(F)F)s1 ZINC000511906771 1024723044 /nfs/dbraw/zinc/72/30/44/1024723044.db2.gz KMWMNYLPNRGWOD-JTQLQIEISA-N -1 3 349.399 4.115 20 0 EIADHM Cc1cc([C@@H](C)N2CCC(COc3ccccc3)CC2)oc1C(=O)[O-] ZINC000652401621 1024810051 /nfs/dbraw/zinc/81/00/51/1024810051.db2.gz RNCOGPGTBLKLQC-OAHLLOKOSA-N -1 3 343.423 4.138 20 0 EIADHM CSCCc1ccc(NC(=O)CCCc2ccc([O-])c(F)c2)cc1 ZINC000468942954 1024822258 /nfs/dbraw/zinc/82/22/58/1024822258.db2.gz MAKWCPDJAYGDCJ-UHFFFAOYSA-N -1 3 347.455 4.398 20 0 EIADHM O=C([O-])[C@@H](c1ccc(F)cc1)N1CC[C@@H](C(F)(F)F)C2(CCC2)C1 ZINC000652446936 1024836898 /nfs/dbraw/zinc/83/68/98/1024836898.db2.gz GVFILYHVNJCWIQ-ZIAGYGMSSA-N -1 3 345.336 4.006 20 0 EIADHM O=C([O-])[C@@H](NCc1ccc(Cl)c(C(F)(F)F)c1)c1ccsc1 ZINC000426820102 1024886962 /nfs/dbraw/zinc/88/69/62/1024886962.db2.gz XXHAURJJEHUARW-LBPRGKRZSA-N -1 3 349.761 4.336 20 0 EIADHM O=c1nc(CN2CCC[C@H](C3CCCCC3)C2)[n-]c2ccsc21 ZINC000662200421 1024932155 /nfs/dbraw/zinc/93/21/55/1024932155.db2.gz GKYRWDZSJUPMKL-AWEZNQCLSA-N -1 3 331.485 4.189 20 0 EIADHM O=C([O-])CCCCCCCCCCNCc1cccnc1Cl ZINC000277051023 1025012016 /nfs/dbraw/zinc/01/20/16/1025012016.db2.gz SDKUJVFEDWMSGY-UHFFFAOYSA-N -1 3 326.868 4.420 20 0 EIADHM Cc1cc(Cl)cc(Cl)c1CNc1ccccc1-c1nnn[n-]1 ZINC001167795366 1025014134 /nfs/dbraw/zinc/01/41/34/1025014134.db2.gz DOEASMLUUIVQIQ-UHFFFAOYSA-N -1 3 334.210 4.094 20 0 EIADHM Cc1cc(Cl)cc(Cl)c1CNc1ccccc1-c1nn[n-]n1 ZINC001167795366 1025014146 /nfs/dbraw/zinc/01/41/46/1025014146.db2.gz DOEASMLUUIVQIQ-UHFFFAOYSA-N -1 3 334.210 4.094 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)N1Cc2ccc(Cl)cc2C1 ZINC000458255516 1025070391 /nfs/dbraw/zinc/07/03/91/1025070391.db2.gz QOQIOQHHPRMPDK-UHFFFAOYSA-N -1 3 333.790 4.050 20 0 EIADHM Cc1ccc([O-])c(CN(C)[C@H](c2ccc(Cl)cc2)C(F)(F)F)n1 ZINC000535852169 1025110474 /nfs/dbraw/zinc/11/04/74/1025110474.db2.gz JYAHMSFDOKFEGZ-OAHLLOKOSA-N -1 3 344.764 4.484 20 0 EIADHM CC[C@@H](C)[C@H](NC(=O)NCc1ncccc1[O-])c1ccc(Cl)cc1 ZINC000471999159 1025290887 /nfs/dbraw/zinc/29/08/87/1025290887.db2.gz QEVVWUXJLUJMPX-PXAZEXFGSA-N -1 3 347.846 4.027 20 0 EIADHM CC(F)(F)CC[N-]C(=O)C(F)(F)c1cccc(Cl)c1Cl ZINC000843600298 1025499885 /nfs/dbraw/zinc/49/98/85/1025499885.db2.gz AROQDPSBCZBJKY-UHFFFAOYSA-N -1 3 332.124 4.247 20 0 EIADHM CCCCCC[C@@H](CC)CN(C)C(=O)c1cc2c(cc1[O-])OCO2 ZINC001167824641 1025583939 /nfs/dbraw/zinc/58/39/39/1025583939.db2.gz TZWYKSHBDSGVKW-CQSZACIVSA-N -1 3 335.444 4.190 20 0 EIADHM CCCOc1ccc(S(=O)(=O)[N-]c2c(C)cccc2CC)cc1 ZINC000506804871 1025786552 /nfs/dbraw/zinc/78/65/52/1025786552.db2.gz ZVTVROUQLWBAJR-UHFFFAOYSA-N -1 3 333.453 4.147 20 0 EIADHM CCc1ccc([O-])c(C(=O)N2CCC(OC3CCC(C)CC3)CC2)c1 ZINC000519418112 1025809579 /nfs/dbraw/zinc/80/95/79/1025809579.db2.gz ISYWDUNTNNPZPB-UHFFFAOYSA-N -1 3 345.483 4.155 20 0 EIADHM Cc1ccc([C@H]2C[C@@H](C)N(C(=O)c3cc(=O)c4ccccc4[n-]3)C2)cc1 ZINC000279081004 1026057125 /nfs/dbraw/zinc/05/71/25/1026057125.db2.gz SOLWMEVLQUXWDD-WBVHZDCISA-N -1 3 346.430 4.267 20 0 EIADHM Cc1ccc([C@@H]2C[C@H](C)N(C(=O)c3cc(=O)c4ccccc4[n-]3)C2)cc1 ZINC000279080988 1026057902 /nfs/dbraw/zinc/05/79/02/1026057902.db2.gz SOLWMEVLQUXWDD-DOTOQJQBSA-N -1 3 346.430 4.267 20 0 EIADHM CSc1ccc(-c2nsc([N-]C(=O)c3occc3C)n2)cc1 ZINC000440459484 1026208289 /nfs/dbraw/zinc/20/82/89/1026208289.db2.gz DYHZDOBTQZYCAY-UHFFFAOYSA-N -1 3 331.422 4.081 20 0 EIADHM CC1(C)CC[C@@H](NC(=O)c2c[n-]c3ccccc3c2=O)c2ccccc21 ZINC000344280761 1026211771 /nfs/dbraw/zinc/21/17/71/1026211771.db2.gz IZSYWSGZYREMEW-LJQANCHMSA-N -1 3 346.430 4.071 20 0 EIADHM O=C([O-])c1cccc(CN2CCC[C@H]2Cc2cccc(F)c2)c1Cl ZINC000563278357 1026318492 /nfs/dbraw/zinc/31/84/92/1026318492.db2.gz ITBOVZVDJIGBCM-INIZCTEOSA-N -1 3 347.817 4.384 20 0 EIADHM Cc1sc(C(=O)[O-])cc1CN1CC[C@H](c2c(F)cccc2F)C1 ZINC000582306231 1026429577 /nfs/dbraw/zinc/42/95/77/1026429577.db2.gz HAGAKMNIWBNAGV-NSHDSACASA-N -1 3 337.391 4.022 20 0 EIADHM Cc1cc2[nH]c(CN[C@H](CC(=O)[O-])c3ccsc3)cc2c(C)c1 ZINC000426683395 1026474942 /nfs/dbraw/zinc/47/49/42/1026474942.db2.gz RONPFXFBWNGUPR-MRXNPFEDSA-N -1 3 328.437 4.152 20 0 EIADHM COc1ccc([C@H](CCC(=O)[O-])NCc2ccccc2Cl)cc1 ZINC000426724842 1026503638 /nfs/dbraw/zinc/50/36/38/1026503638.db2.gz WHIKIUAKMYYRFG-KRWDZBQOSA-N -1 3 333.815 4.044 20 0 EIADHM Cc1ccc2cc(CN[C@@H](C(=O)[O-])c3cccc(Cl)c3)ccc2n1 ZINC000426727453 1026508374 /nfs/dbraw/zinc/50/83/74/1026508374.db2.gz OVXCGKWJEDITOD-GOSISDBHSA-N -1 3 340.810 4.112 20 0 EIADHM Cc1cc2[nH]c(CN[C@H](C(=O)[O-])c3cccc(Cl)c3)cc2c(C)c1 ZINC000426731732 1026512303 /nfs/dbraw/zinc/51/23/03/1026512303.db2.gz GEVSQCFUDMWGBB-SFHVURJKSA-N -1 3 342.826 4.354 20 0 EIADHM CC(C)Oc1ccc(CN[C@H](C(=O)[O-])c2cccc(Cl)c2)cc1 ZINC000426744278 1026526957 /nfs/dbraw/zinc/52/69/57/1026526957.db2.gz WMZIWFYBBUZGPI-KRWDZBQOSA-N -1 3 333.815 4.043 20 0 EIADHM O=C([O-])[C@@H](NCc1cccc(Cl)c1)c1ccc(Cl)c(F)c1 ZINC000426751239 1026537621 /nfs/dbraw/zinc/53/76/21/1026537621.db2.gz UMZSRVFXPFUDMS-AWEZNQCLSA-N -1 3 328.170 4.048 20 0 EIADHM C[C@@H](C(=O)[O-])[C@@H](NCc1ccc(-c2ccccc2)o1)c1ccccc1 ZINC000426753069 1026538055 /nfs/dbraw/zinc/53/80/55/1026538055.db2.gz GPADKTJTDMRFGM-FOIQADDNSA-N -1 3 335.403 4.498 20 0 EIADHM O=C([O-])[C@@H](NCc1ccc(Cl)c(Cl)c1)c1cccc(F)c1 ZINC000426820113 1026579539 /nfs/dbraw/zinc/57/95/39/1026579539.db2.gz YAUHFUPHANNJJR-AWEZNQCLSA-N -1 3 328.170 4.048 20 0 EIADHM Cc1ccc(-c2ncc(CN[C@H](CC(=O)[O-])c3ccccc3)s2)o1 ZINC000426819394 1026579906 /nfs/dbraw/zinc/57/99/06/1026579906.db2.gz IBAMENJUEUTIKO-OAHLLOKOSA-N -1 3 342.420 4.017 20 0 EIADHM Cc1ccc2nc(-c3ccc(C)c(Br)c3)[n-]c(=O)c2c1 ZINC000507035923 1026598472 /nfs/dbraw/zinc/59/84/72/1026598472.db2.gz NUFWZWBAZKWCAW-UHFFFAOYSA-N -1 3 329.197 4.382 20 0 EIADHM O=C(Nc1ccc(Cl)cc1[O-])c1ccc([C@H]2CCCOC2)cc1 ZINC000507086547 1026636574 /nfs/dbraw/zinc/63/65/74/1026636574.db2.gz HPDIAPGQSKTDCB-AWEZNQCLSA-N -1 3 331.799 4.192 20 0 EIADHM CO[C@H](C)c1nc(C)c(C(=O)[N-]c2cccc(F)c2SC)s1 ZINC000617275976 1026710777 /nfs/dbraw/zinc/71/07/77/1026710777.db2.gz RIJMBOBSPGFAIC-SECBINFHSA-N -1 3 340.445 4.272 20 0 EIADHM C[C@H](NCc1cc(=O)oc2cc([O-])ccc12)c1cc2ccccc2o1 ZINC000176677606 1026725958 /nfs/dbraw/zinc/72/59/58/1026725958.db2.gz BDJDQEAIIUTRDF-LBPRGKRZSA-N -1 3 335.359 4.096 20 0 EIADHM CCc1noc(C)c1NC(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000093246306 1026848179 /nfs/dbraw/zinc/84/81/79/1026848179.db2.gz TULMQMGFBGJMRT-UHFFFAOYSA-N -1 3 336.391 4.094 20 0 EIADHM Cc1ccc(-c2nc(NC(=O)c3cc4cccc(C)c4s3)n[n-]2)o1 ZINC000519717800 1026958724 /nfs/dbraw/zinc/95/87/24/1026958724.db2.gz BDMDHUGGPDCXQJ-UHFFFAOYSA-N -1 3 338.392 4.149 20 0 EIADHM [O-]c1cc2ccccc2cc1-c1nc(COc2ccccc2F)no1 ZINC000188333963 1027388175 /nfs/dbraw/zinc/38/81/75/1027388175.db2.gz PTJWRBCYMGPCFE-UHFFFAOYSA-N -1 3 336.322 4.314 20 0 EIADHM O=C(NCc1ccc([O-])c(F)c1)N[C@H]1CCC[C@@H](c2ccccc2)C1 ZINC000487486418 1027476245 /nfs/dbraw/zinc/47/62/45/1027476245.db2.gz POIJNTJMNCXWMY-SJORKVTESA-N -1 3 342.414 4.057 20 0 EIADHM CC(C)n1ccc(CSCc2cc(=O)[n-]c(-c3ccccc3)n2)n1 ZINC000520378292 1027489106 /nfs/dbraw/zinc/48/91/06/1027489106.db2.gz NWEVAQAKRZPZAM-UHFFFAOYSA-N -1 3 340.452 4.060 20 0 EIADHM Cc1cnc(C2CCN(C(=O)c3ccc(C(C)C)cc3[O-])CC2)s1 ZINC000277949551 1027540949 /nfs/dbraw/zinc/54/09/49/1027540949.db2.gz IKFFEWAZPYRLNF-UHFFFAOYSA-N -1 3 344.480 4.300 20 0 EIADHM Cc1sc2[n-]c(-c3cccc(F)n3)nc(=O)c2c1-c1ccccc1 ZINC000179098504 1027691885 /nfs/dbraw/zinc/69/18/85/1027691885.db2.gz IAHSCYRMEDJLPD-UHFFFAOYSA-N -1 3 337.379 4.161 20 0 EIADHM CCCc1ccccc1[N-]S(=O)(=O)c1cc(C)c(OC)cc1C ZINC000614792065 1027704002 /nfs/dbraw/zinc/70/40/02/1027704002.db2.gz SPAUOXCSUXYDDY-UHFFFAOYSA-N -1 3 333.453 4.065 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1cccc(Br)c1F ZINC000192183914 1027898525 /nfs/dbraw/zinc/89/85/25/1027898525.db2.gz OFFGIMSGBOMKRA-UHFFFAOYSA-N -1 3 344.567 4.200 20 0 EIADHM O=S(=O)([N-][C@H](c1ccccc1)c1ccc(Cl)cc1)c1ccco1 ZINC000188569213 1027984490 /nfs/dbraw/zinc/98/44/90/1027984490.db2.gz HQEHVBHPIHCFQG-QGZVFWFLSA-N -1 3 347.823 4.001 20 0 EIADHM Cc1ccccc1-c1cc(=NC(=O)C[C@H](C)c2cccc(F)c2)[nH][n-]1 ZINC000522564609 1028013686 /nfs/dbraw/zinc/01/36/86/1028013686.db2.gz FERYCGRAWLOQKE-AWEZNQCLSA-N -1 3 337.398 4.078 20 0 EIADHM COc1ccc([O-])c(C(=O)Nc2cccc(-c3nc(C)cs3)c2)c1 ZINC000522604868 1028050515 /nfs/dbraw/zinc/05/05/15/1028050515.db2.gz APVSHZLJMVFIMI-UHFFFAOYSA-N -1 3 340.404 4.085 20 0 EIADHM COc1ccc([C@H]2CCCN2C(=O)c2cc([O-])ccc2Cl)cc1 ZINC000431525593 1028194229 /nfs/dbraw/zinc/19/42/29/1028194229.db2.gz VONXZPNQWHQWQU-QGZVFWFLSA-N -1 3 331.799 4.032 20 0 EIADHM CC(C)n1ccnc1SCc1nc2c3ccccc3oc2c(=O)[n-]1 ZINC000343150751 1028394698 /nfs/dbraw/zinc/39/46/98/1028394698.db2.gz FMNPGQANKFHCJE-UHFFFAOYSA-N -1 3 340.408 4.151 20 0 EIADHM CCc1nc2c(s1)[C@@H](N(C)Cc1ccc(F)cc1C(=O)[O-])CCC2 ZINC000583327339 1028508798 /nfs/dbraw/zinc/50/87/98/1028508798.db2.gz JXAKKJKNMAVRCW-HNNXBMFYSA-N -1 3 348.443 4.052 20 0 EIADHM Cc1sc2nc(C)nc(S[C@@H](C)c3nc(C)cc(=O)[n-]3)c2c1C ZINC000346585566 1028531231 /nfs/dbraw/zinc/53/12/31/1028531231.db2.gz HENRAQPDSSOGGV-JTQLQIEISA-N -1 3 346.481 4.274 20 0 EIADHM CSc1cccnc1[N-]C(=O)c1sc(C2CCCC2)nc1C ZINC000652876880 1028725311 /nfs/dbraw/zinc/72/53/11/1028725311.db2.gz IREXMYNEGJQSHR-UHFFFAOYSA-N -1 3 333.482 4.478 20 0 EIADHM Cc1nc2sccn2c1-c1noc(-c2cc3ccccc3cc2[O-])n1 ZINC000445639432 1028826479 /nfs/dbraw/zinc/82/64/79/1028826479.db2.gz FWOIAHLWBLVYEE-UHFFFAOYSA-N -1 3 348.387 4.280 20 0 EIADHM C[C@H]1CCC[C@@H](CCN(CCC(=O)[O-])Cc2cccc(F)c2F)C1 ZINC000583758084 1029132997 /nfs/dbraw/zinc/13/29/97/1029132997.db2.gz SRGTZSJSYMWLFF-GJZGRUSLSA-N -1 3 339.426 4.458 20 0 EIADHM Cc1cccc(-c2cnc([N-]C(=O)c3c(F)ccnc3F)s2)c1 ZINC001271830965 1029168498 /nfs/dbraw/zinc/16/84/98/1029168498.db2.gz GHJZTPWMFUPUNH-UHFFFAOYSA-N -1 3 331.347 4.044 20 0 EIADHM CSCc1cccc([N-]S(=O)(=O)c2c(C)cc(C)cc2C)c1 ZINC000524691403 1029173705 /nfs/dbraw/zinc/17/37/05/1029173705.db2.gz CYRHAMCOBPJUJZ-UHFFFAOYSA-N -1 3 335.494 4.276 20 0 EIADHM CC(C)(C)[C@@H]1CCCN(C(=O)c2cc([O-])cc(Br)c2)C1 ZINC000708437329 1029495429 /nfs/dbraw/zinc/49/54/29/1029495429.db2.gz RHMLMYBYDUOSJT-GFCCVEGCSA-N -1 3 340.261 4.053 20 0 EIADHM COc1cc(-c2noc(-c3ccc(C)cc3[O-])n2)cc(Cl)c1OC ZINC000324919749 1029535848 /nfs/dbraw/zinc/53/58/48/1029535848.db2.gz KZNGVJPXCZKCGS-UHFFFAOYSA-N -1 3 346.770 4.088 20 0 EIADHM O=C([O-])CCN(CCCCc1ccccc1)Cc1cccc(F)c1F ZINC000565100934 1029575608 /nfs/dbraw/zinc/57/56/08/1029575608.db2.gz LOTPNYJMHORMLO-UHFFFAOYSA-N -1 3 347.405 4.264 20 0 EIADHM COc1cc(SC)ccc1NC(=O)CCCc1ccc([O-])c(F)c1 ZINC000446980461 1029658598 /nfs/dbraw/zinc/65/85/98/1029658598.db2.gz RSHUCBACGFZGJF-UHFFFAOYSA-N -1 3 349.427 4.223 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@@H]3CC[C@@H](C)C[C@H]3C)nc2)n1 ZINC000301248438 1029693867 /nfs/dbraw/zinc/69/38/67/1029693867.db2.gz IKGIEZTUDWAOEX-XJKCOSOUSA-N -1 3 326.444 4.043 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(N[C@@H]3CCC[C@H](CC)C3)nc2)n1 ZINC000301353766 1029715226 /nfs/dbraw/zinc/71/52/26/1029715226.db2.gz MIPRHZCLBWHJDO-XJKSGUPXSA-N -1 3 326.444 4.187 20 0 EIADHM Cc1cc(N(C)C)ccc1[N-]S(=O)(=O)c1cccc2ccccc21 ZINC000083955125 1029822250 /nfs/dbraw/zinc/82/22/50/1029822250.db2.gz VUUUKIZWEABXGX-UHFFFAOYSA-N -1 3 340.448 4.015 20 0 EIADHM CCS[C@H]1CCCCN(Cc2cc(C(=O)[O-])ccc2Cl)C1 ZINC000584415952 1029837485 /nfs/dbraw/zinc/83/74/85/1029837485.db2.gz FLVROPQGDWSFHC-AWEZNQCLSA-N -1 3 327.877 4.146 20 0 EIADHM C[C@H](c1ccc(Cl)c(Cl)c1)N1CCC(c2n[n-]c(=O)o2)CC1 ZINC000450911187 1030099965 /nfs/dbraw/zinc/09/99/65/1030099965.db2.gz CQWWUSNNMDNHND-SECBINFHSA-N -1 3 342.226 4.023 20 0 EIADHM C[C@H](c1ccc(Cl)cc1Cl)N1CCC(c2n[n-]c(=O)o2)CC1 ZINC000450915975 1030106328 /nfs/dbraw/zinc/10/63/28/1030106328.db2.gz RXNYPMIIQWMJDD-SECBINFHSA-N -1 3 342.226 4.023 20 0 EIADHM CCS[C@@H]1CCCC[C@H]1NC(=O)c1cc([O-])c2ccccc2c1 ZINC000525935498 1030128621 /nfs/dbraw/zinc/12/86/21/1030128621.db2.gz JQCSLHBGIDUXAI-SJLPKXTDSA-N -1 3 329.465 4.340 20 0 EIADHM C[C@@H]1C[C@@H](C(=O)[O-])C[C@H](C)N1CCc1cc(Cl)cc(Cl)c1 ZINC000530173129 1030192371 /nfs/dbraw/zinc/19/23/71/1030192371.db2.gz CRTFCTLAUXDXBM-PTEHBNRSSA-N -1 3 330.255 4.110 20 0 EIADHM O=C(c1ccc([O-])cc1)C1CCN(Cc2ccc3occc3c2)CC1 ZINC000685408662 1030288835 /nfs/dbraw/zinc/28/88/35/1030288835.db2.gz XXEGFXLVCLAHQK-UHFFFAOYSA-N -1 3 335.403 4.233 20 0 EIADHM CC(C)[C@@H](c1ccc(F)cc1)N(C)C(=O)Cc1ccc([O-])c(F)c1 ZINC000451510541 1030542926 /nfs/dbraw/zinc/54/29/26/1030542926.db2.gz OTMGYFFDHPHDJN-IBGZPJMESA-N -1 3 333.378 4.069 20 0 EIADHM CCS[C@@H]1CCC[C@@H](NC(=O)c2cc([O-])c3ccccc3c2)C1 ZINC000527467682 1030706764 /nfs/dbraw/zinc/70/67/64/1030706764.db2.gz PERNNFVJPBIELH-HZPDHXFCSA-N -1 3 329.465 4.340 20 0 EIADHM O=C([N-]c1ncc(Cl)s1)c1cc(-c2cccc(Cl)c2)no1 ZINC000081738278 1030737218 /nfs/dbraw/zinc/73/72/18/1030737218.db2.gz VHWLUPOTVASNLX-UHFFFAOYSA-N -1 3 340.191 4.357 20 0 EIADHM CC(=O)c1ccc(C(=O)Nc2ccc(C(=O)C(C)(C)C)cc2)cc1[O-] ZINC000611990980 1030751353 /nfs/dbraw/zinc/75/13/53/1030751353.db2.gz XFUSOCSBPDOMQL-UHFFFAOYSA-N -1 3 339.391 4.076 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2cc(-c3cccnc3)ccc2C)cc1 ZINC000475826835 1030795830 /nfs/dbraw/zinc/79/58/30/1030795830.db2.gz JBCKVKKRYNKENZ-UHFFFAOYSA-N -1 3 338.432 4.166 20 0 EIADHM CCCc1ccccc1[N-]S(=O)(=O)c1ccc(OCC)c(C)c1 ZINC000032595497 1030810550 /nfs/dbraw/zinc/81/05/50/1030810550.db2.gz AXULYLZGJGFTNX-UHFFFAOYSA-N -1 3 333.453 4.147 20 0 EIADHM Cc1ccc([N-]S(=O)(=O)c2cccc3ccc(C)nc32)c(Cl)c1 ZINC000531008147 1030833731 /nfs/dbraw/zinc/83/37/31/1030833731.db2.gz GCEMVTFEAXCKHT-UHFFFAOYSA-N -1 3 346.839 4.306 20 0 EIADHM CSc1ccc([O-])c(C(=O)N2CC[C@H](c3ccccc3)[C@@H]2C)c1 ZINC000612072110 1030847688 /nfs/dbraw/zinc/84/76/88/1030847688.db2.gz VGVYHPPRZKUVKN-BBRMVZONSA-N -1 3 327.449 4.132 20 0 EIADHM CCCOc1ccc([C@@H](C)NCc2cccc(C(=O)[O-])c2)cc1OC ZINC000263476719 1030882965 /nfs/dbraw/zinc/88/29/65/1030882965.db2.gz MTKQCYNIDLHWIG-CQSZACIVSA-N -1 3 343.423 4.033 20 0 EIADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)[C@@H]3CCC[C@H]3CC)c2)n1 ZINC000448723469 1030987610 /nfs/dbraw/zinc/98/76/10/1030987610.db2.gz HVRWBXDTIPYUBY-CXAGYDPISA-N -1 3 339.439 4.176 20 0 EIADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)[C@@]3(C)CCC[C@@H]3C)c2)n1 ZINC000448724382 1030990953 /nfs/dbraw/zinc/99/09/53/1030990953.db2.gz KZTBWRVIZDBOLZ-RBZFPXEDSA-N -1 3 339.439 4.176 20 0 EIADHM O=C(Nc1cc(Br)ccc1[O-])c1coc2ccccc12 ZINC000531254076 1031028129 /nfs/dbraw/zinc/02/81/29/1031028129.db2.gz PXEDEPTUQLNMBK-UHFFFAOYSA-N -1 3 332.153 4.153 20 0 EIADHM CCc1ccc([O-])c(C(=O)N2[C@H](C)[C@H](CC(F)(F)F)C[C@@H]2C)c1 ZINC000452648724 1031211922 /nfs/dbraw/zinc/21/19/22/1031211922.db2.gz ADXZCKMSPQHWQF-LOWVWBTDSA-N -1 3 329.362 4.146 20 0 EIADHM O=C([N-]c1nc(-c2ccsc2)ns1)c1c(F)cccc1Cl ZINC000109111265 1031296067 /nfs/dbraw/zinc/29/60/67/1031296067.db2.gz YXCSWFPURXOYDA-UHFFFAOYSA-N -1 3 339.804 4.311 20 0 EIADHM CCc1ccc([O-])c(C(=O)Nc2ccc(OCc3cccnc3)cc2)c1 ZINC000728610870 1031367592 /nfs/dbraw/zinc/36/75/92/1031367592.db2.gz NTSVNBWKIXSAGN-UHFFFAOYSA-N -1 3 348.402 4.181 20 0 EIADHM Cn1ccnc1[C@H]([N-]c1nc2cc(F)ccc2o1)c1cccc(F)c1 ZINC000114446644 1031370031 /nfs/dbraw/zinc/37/00/31/1031370031.db2.gz MGIDHYPSQSPYEQ-MRXNPFEDSA-N -1 3 340.333 4.041 20 0 EIADHM O=C(NC[C@@H]1CCCC[C@H]1C(F)(F)F)c1cc([O-])ccc1Cl ZINC000685772682 1031481472 /nfs/dbraw/zinc/48/14/72/1031481472.db2.gz DSKQDIGIXUDQIH-JOYOIKCWSA-N -1 3 335.753 4.144 20 0 EIADHM O=C(NCc1ccc(Cl)cc1Cl)c1cc([O-])ccc1Cl ZINC000431655696 1031510956 /nfs/dbraw/zinc/51/09/56/1031510956.db2.gz OZENHLGGUABMGI-UHFFFAOYSA-N -1 3 330.598 4.282 20 0 EIADHM O=C([N-]c1nc(C(F)(F)F)cs1)c1cc(-c2ccccc2)no1 ZINC000041867331 1031518867 /nfs/dbraw/zinc/51/88/67/1031518867.db2.gz PTBLIPGXAQODGF-UHFFFAOYSA-N -1 3 339.298 4.069 20 0 EIADHM O=C(Nc1ccc(Br)cc1[O-])c1cc(F)cc(Cl)c1 ZINC000531793278 1031613428 /nfs/dbraw/zinc/61/34/28/1031613428.db2.gz CTWHBDFCCCJAPY-UHFFFAOYSA-N -1 3 344.567 4.200 20 0 EIADHM CCOc1cc(CN2CCO[C@@H](c3ccccc3)C2)cc(Cl)c1[O-] ZINC000459309937 1031760305 /nfs/dbraw/zinc/76/03/05/1031760305.db2.gz LSENQWZJZOCWQE-GOSISDBHSA-N -1 3 347.842 4.018 20 0 EIADHM Cc1ccccc1OCc1nc(=O)c2c3c(sc2[n-]1)C[C@@H](C)CC3 ZINC000531935113 1031843567 /nfs/dbraw/zinc/84/35/67/1031843567.db2.gz ORYSMDUADWYCGS-NSHDSACASA-N -1 3 340.448 4.409 20 0 EIADHM CC1(C(=O)Nc2cc(Br)ccc2[O-])CCC(F)(F)CC1 ZINC000528901440 1031941356 /nfs/dbraw/zinc/94/13/56/1031941356.db2.gz IJDRBBAJNSQMAY-UHFFFAOYSA-N -1 3 348.187 4.309 20 0 EIADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)[C@@H](CC)CC(C)C)c2)n1 ZINC000449738986 1031971097 /nfs/dbraw/zinc/97/10/97/1031971097.db2.gz HRDROYUBDWATJL-AWEZNQCLSA-N -1 3 341.455 4.422 20 0 EIADHM CCc1cc(=O)[n-]c(-c2cccc(NC(=O)[C@H](CC)CC(C)C)c2)n1 ZINC000449738987 1031972208 /nfs/dbraw/zinc/97/22/08/1031972208.db2.gz HRDROYUBDWATJL-CQSZACIVSA-N -1 3 341.455 4.422 20 0 EIADHM CCN(C(=O)c1c[n-]c2c(Cl)cccc2c1=O)[C@H]1CCCC[C@H]1C ZINC001143552800 1033792966 /nfs/dbraw/zinc/79/29/66/1033792966.db2.gz DZJJKWQWSXWQMN-WBMJQRKESA-N -1 3 346.858 4.222 20 0 EIADHM COc1cccc(N(CC(C)C)C(=O)c2cc([O-])ccc2Cl)c1 ZINC000433239503 1034077836 /nfs/dbraw/zinc/07/78/36/1034077836.db2.gz HERIMQQCNQACJE-UHFFFAOYSA-N -1 3 333.815 4.357 20 0 EIADHM COc1ccc2cc(C(=O)Nc3cc(Cl)ccc3[O-])c(C)nc2c1 ZINC000512872399 1034111898 /nfs/dbraw/zinc/11/18/98/1034111898.db2.gz NIFOQRJFMMSPMJ-UHFFFAOYSA-N -1 3 342.782 4.163 20 0 EIADHM O=C(Nc1ccc(F)cc1OCC1CC1)c1cc([O-])ccc1Cl ZINC000433476118 1034506944 /nfs/dbraw/zinc/50/69/44/1034506944.db2.gz XNGYSVCATAATFH-UHFFFAOYSA-N -1 3 335.762 4.226 20 0 EIADHM CN(C)Cc1ccc(NCc2cccc([O-])c2Cl)cc1Cl ZINC000513382868 1034898616 /nfs/dbraw/zinc/89/86/16/1034898616.db2.gz ZIMKSRLHGWXYGN-UHFFFAOYSA-N -1 3 325.239 4.373 20 0 EIADHM [O-]c1ccc(F)c(CNC2CC(F)(c3cccc(Cl)c3)C2)c1F ZINC000513410154 1034913919 /nfs/dbraw/zinc/91/39/19/1034913919.db2.gz AKBQEMZPFNSPQW-UHFFFAOYSA-N -1 3 341.760 4.441 20 0 EIADHM O=C(Nc1n[n-]c(-c2cc3ccccc3o2)n1)c1ccc(Cl)cc1 ZINC000485091796 1035671021 /nfs/dbraw/zinc/67/10/21/1035671021.db2.gz GQFXXYLKIUSDLV-UHFFFAOYSA-N -1 3 338.754 4.124 20 0 EIADHM CC[C@@H](C)NC(=O)c1ccc(NCc2c(F)ccc([O-])c2F)c(C)c1 ZINC000414464677 1035788127 /nfs/dbraw/zinc/78/81/27/1035788127.db2.gz QDNGWZWMUQXEJA-GFCCVEGCSA-N -1 3 348.393 4.119 20 0 EIADHM CN(Cc1ccccc1-c1ccccc1)C(=O)c1ccc(O)cc1[O-] ZINC000195374004 1035838415 /nfs/dbraw/zinc/83/84/15/1035838415.db2.gz OKOLVQIHQXWTIJ-UHFFFAOYSA-N -1 3 333.387 4.037 20 0 EIADHM CCSc1cccc(F)c1[N-]C(=O)c1cc(C2CC2)n(CC)n1 ZINC000905711846 1035870318 /nfs/dbraw/zinc/87/03/18/1035870318.db2.gz BWVSFHRBFOOUOZ-UHFFFAOYSA-N -1 3 333.432 4.284 20 0 EIADHM C[C@H](CN1CCC(C(=O)[O-])(C(F)(F)F)CC1)c1cccc(Cl)c1 ZINC000905738358 1035879224 /nfs/dbraw/zinc/87/92/24/1035879224.db2.gz NCLJKTYNTXSZRA-LLVKDONJSA-N -1 3 349.780 4.173 20 0 EIADHM C[C@@H]1C[C@H]1c1ccc(CNCCc2cc3ccc(C(=O)[O-])cc3o2)o1 ZINC000905804007 1035898598 /nfs/dbraw/zinc/89/85/98/1035898598.db2.gz OZTGEQAJBJZFIW-SJKOYZFVSA-N -1 3 339.391 4.180 20 0 EIADHM O=C([N-]c1ccccc1SC1CCCC1)c1nccnc1Cl ZINC000906076354 1036065144 /nfs/dbraw/zinc/06/51/44/1036065144.db2.gz WJIIOPYVMUTMJW-UHFFFAOYSA-N -1 3 333.844 4.417 20 0 EIADHM CC(C)(C)c1nc(C(=O)[N-]c2nnc(-c3ccccc3)s2)cs1 ZINC000588018997 1036188870 /nfs/dbraw/zinc/18/88/70/1036188870.db2.gz ALAKEQYMXLQYNZ-UHFFFAOYSA-N -1 3 344.465 4.211 20 0 EIADHM CSCCc1ccccc1NC(=O)CCCc1ccc([O-])c(F)c1 ZINC000601717537 1036205066 /nfs/dbraw/zinc/20/50/66/1036205066.db2.gz PCKWXCAYICEQPQ-UHFFFAOYSA-N -1 3 347.455 4.398 20 0 EIADHM O=C([O-])[C@H](c1c(F)cccc1Cl)N1CCC[C@]2(CC=CCC2)C1 ZINC000572127906 1036439718 /nfs/dbraw/zinc/43/97/18/1036439718.db2.gz ZBVJPSISMDXFEN-FUHWJXTLSA-N -1 3 337.822 4.427 20 0 EIADHM O=C([O-])c1ccc(-c2nc(CN3CCC[C@H]4CCC[C@H]43)cs2)cc1 ZINC000572127671 1036440245 /nfs/dbraw/zinc/44/02/45/1036440245.db2.gz NOBKQSJUNJOHKM-CXAGYDPISA-N -1 3 342.464 4.273 20 0 EIADHM Cc1c([O-])ccc2c(CNc3ccc(OC(C)C)cc3)cc(=O)oc12 ZINC000056173605 1036501992 /nfs/dbraw/zinc/50/19/92/1036501992.db2.gz ZEILWOAHCBYMTP-UHFFFAOYSA-N -1 3 339.391 4.206 20 0 EIADHM Fc1cccc(F)c1-c1csc([N-]c2ncnc3ccncc32)n1 ZINC000502687315 1036509755 /nfs/dbraw/zinc/50/97/55/1036509755.db2.gz OHNCCAOQIFOPGD-UHFFFAOYSA-N -1 3 341.346 4.170 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1cccc(Oc2ccncc2)c1 ZINC000602940946 1036682937 /nfs/dbraw/zinc/68/29/37/1036682937.db2.gz OEZCJPSZRKETQR-UHFFFAOYSA-N -1 3 340.766 4.485 20 0 EIADHM O=C(c1cc([O-])ccc1Cl)N1CCC[C@@H]1/C=C/c1ccccc1 ZINC000498709841 1036797204 /nfs/dbraw/zinc/79/72/04/1036797204.db2.gz CJSJUPLEMRTMIV-XVJNWHFHSA-N -1 3 327.811 4.364 20 0 EIADHM Cc1nc(C2CCC2)sc1CC(=O)Nc1c([O-])cccc1Cl ZINC000908414382 1036850661 /nfs/dbraw/zinc/85/06/61/1036850661.db2.gz PGDHXDDRFZEUMY-UHFFFAOYSA-N -1 3 336.844 4.259 20 0 EIADHM CC(C)(Cc1ccccc1)C(=O)Nc1ccc(Br)cc1[O-] ZINC000605121510 1037667769 /nfs/dbraw/zinc/66/77/69/1037667769.db2.gz NOUGPFFOMVKBRS-UHFFFAOYSA-N -1 3 348.240 4.362 20 0 EIADHM Cc1ccc(C[N-]C(=O)C(F)(F)C(F)F)c(O[C@H](C)CC(C)C)c1 ZINC001127141095 1037681650 /nfs/dbraw/zinc/68/16/50/1037681650.db2.gz NVIPCEHHCKZZLW-GFCCVEGCSA-N -1 3 349.368 4.325 20 0 EIADHM O=C(CCC1CCCCC1)NCc1ccc([O-])c(Br)c1 ZINC000488690623 1037712650 /nfs/dbraw/zinc/71/26/50/1037712650.db2.gz ZLDCLJQZCMZBBB-UHFFFAOYSA-N -1 3 340.261 4.131 20 0 EIADHM O=C(Cc1ccc(-c2ccccc2)cc1)NCc1ccc([O-])c(F)c1 ZINC000606537065 1038149777 /nfs/dbraw/zinc/14/97/77/1038149777.db2.gz DBOCSPVJRJQXAO-UHFFFAOYSA-N -1 3 335.378 4.057 20 0 EIADHM Cc1ccccc1[C@H](CC(C)C)NC(=O)NCc1ccc([O-])c(F)c1 ZINC000606687467 1038224669 /nfs/dbraw/zinc/22/46/69/1038224669.db2.gz GRQOFHJVBIIULL-SFHVURJKSA-N -1 3 344.430 4.426 20 0 EIADHM CN(Cc1ccc2ccccc2c1)C(=O)NCc1ccc([O-])c(F)c1 ZINC000606715023 1038228416 /nfs/dbraw/zinc/22/84/16/1038228416.db2.gz NOLIGXRJNKHNJX-UHFFFAOYSA-N -1 3 338.382 4.026 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2ccc(CC(F)(F)F)cc2)cc1C ZINC000607615830 1038241340 /nfs/dbraw/zinc/24/13/40/1038241340.db2.gz ROPJNPTWFXKUQW-UHFFFAOYSA-N -1 3 343.370 4.209 20 0 EIADHM COc1ccccc1[C@@H]1CCN(Cc2cc(C(=O)[O-])ccc2Cl)C1 ZINC000574644221 1038315968 /nfs/dbraw/zinc/31/59/68/1038315968.db2.gz CXOSDKKHMQAKHJ-CQSZACIVSA-N -1 3 345.826 4.036 20 0 EIADHM Cc1nc(S(=O)(=O)Cc2ccccc2Cl)[n-]c1-c1ccccc1 ZINC000490414179 1038617987 /nfs/dbraw/zinc/61/79/87/1038617987.db2.gz MWBYMDAZAAHPLL-UHFFFAOYSA-N -1 3 346.839 4.012 20 0 EIADHM Cc1[n-]c(S(=O)(=O)Cc2ccccc2Cl)nc1-c1ccccc1 ZINC000490414179 1038617990 /nfs/dbraw/zinc/61/79/90/1038617990.db2.gz MWBYMDAZAAHPLL-UHFFFAOYSA-N -1 3 346.839 4.012 20 0 EIADHM Cc1[n-]c(S(=O)(=O)Cc2ccc(Cl)cc2)nc1-c1ccccc1 ZINC000490422282 1038623277 /nfs/dbraw/zinc/62/32/77/1038623277.db2.gz XMGSPNODXJGBSR-UHFFFAOYSA-N -1 3 346.839 4.012 20 0 EIADHM Cc1nc(S(=O)(=O)Cc2ccc(Cl)cc2)[n-]c1-c1ccccc1 ZINC000490422282 1038623283 /nfs/dbraw/zinc/62/32/83/1038623283.db2.gz XMGSPNODXJGBSR-UHFFFAOYSA-N -1 3 346.839 4.012 20 0 EIADHM O=C(Nc1cc(-c2cccc(Cl)c2)on1)c1cc([O-])ccc1Cl ZINC000555088729 1038866306 /nfs/dbraw/zinc/86/63/06/1038866306.db2.gz FOVSPURJGZEQJB-UHFFFAOYSA-N -1 3 349.173 4.028 20 0 EIADHM O=C(CCCc1ccc([O-])c(F)c1)NCC1CC(c2ccccc2)C1 ZINC000555173001 1038923047 /nfs/dbraw/zinc/92/30/47/1038923047.db2.gz CKPMUBYUYIUELI-UHFFFAOYSA-N -1 3 341.426 4.164 20 0 EIADHM O=C(Nc1ccc(Cl)cc1[O-])c1cccc([C@@H]2CCCOC2)c1 ZINC000534307596 1039307960 /nfs/dbraw/zinc/30/79/60/1039307960.db2.gz ONYKCXSIPFZLGM-CQSZACIVSA-N -1 3 331.799 4.192 20 0 EIADHM CC(=O)c1cccc(NC(=O)[C@@H](C)Sc2ccccc2Cl)c1[O-] ZINC000552286002 1039337366 /nfs/dbraw/zinc/33/73/66/1039337366.db2.gz IROFFAYROWMMAB-LLVKDONJSA-N -1 3 349.839 4.368 20 0 EIADHM CCCCCN(CCCCC)C(=O)c1cc(NC(C)=O)ccc1[O-] ZINC000121867627 1039473857 /nfs/dbraw/zinc/47/38/57/1039473857.db2.gz ZBWVAEVFUVRHIC-UHFFFAOYSA-N -1 3 334.460 4.173 20 0 EIADHM CCOc1c(Cl)cccc1CC(=O)Nc1cc(Cl)ccc1[O-] ZINC000478328596 1039660824 /nfs/dbraw/zinc/66/08/24/1039660824.db2.gz HFWHNZCYOLBOMC-UHFFFAOYSA-N -1 3 340.206 4.279 20 0 EIADHM O=C(CSc1ccc(F)c(F)c1)Nc1ccc(Cl)cc1[O-] ZINC000534709449 1039717492 /nfs/dbraw/zinc/71/74/92/1039717492.db2.gz QJKCGJXHSXJQAH-UHFFFAOYSA-N -1 3 329.755 4.055 20 0 EIADHM CCc1ccc([O-])c(C(=O)Nc2cc3c(cc2Cl)OCCCO3)c1 ZINC000537643203 1039784488 /nfs/dbraw/zinc/78/44/88/1039784488.db2.gz OLBJSNBAQNZQKK-UHFFFAOYSA-N -1 3 347.798 4.022 20 0 EIADHM O=C(Cc1ccc(OC(F)(F)F)cc1)Nc1c([O-])cccc1Cl ZINC000552780671 1039817230 /nfs/dbraw/zinc/81/72/30/1039817230.db2.gz KRMACDSXXHKHIT-UHFFFAOYSA-N -1 3 345.704 4.125 20 0 EIADHM CCOc1ccc(C(=O)Nc2c([O-])cccc2Cl)cc1OCC ZINC000552782464 1039817803 /nfs/dbraw/zinc/81/78/03/1039817803.db2.gz OOVURFXQYWSTBN-UHFFFAOYSA-N -1 3 335.787 4.095 20 0 EIADHM Cc1cc(Cl)ccc1OCC(=O)Nc1cc(Cl)ccc1[O-] ZINC000069693028 1039872575 /nfs/dbraw/zinc/87/25/75/1039872575.db2.gz DVXIKNKONDDIAN-UHFFFAOYSA-N -1 3 326.179 4.025 20 0 EIADHM O=C(NCc1csc(-c2ccccc2)n1)c1cc([O-])ccc1Cl ZINC000478955739 1040042332 /nfs/dbraw/zinc/04/23/32/1040042332.db2.gz GBBKIWZXHKWUOD-UHFFFAOYSA-N -1 3 344.823 4.099 20 0 EIADHM CC(=O)c1cccc(NC(=O)c2ccc(-c3ccc(C)o3)s2)c1[O-] ZINC000514752369 1040200395 /nfs/dbraw/zinc/20/03/95/1040200395.db2.gz SCPPOQPVLLYMMD-UHFFFAOYSA-N -1 3 341.388 4.477 20 0 EIADHM Cn1c2ccccc2c(Cl)c1C(=O)Nc1ccc(Cl)cc1[O-] ZINC000535419599 1040252409 /nfs/dbraw/zinc/25/24/09/1040252409.db2.gz YJKRYWNLFFZNEF-UHFFFAOYSA-N -1 3 335.190 4.443 20 0 EIADHM CCCc1cc(=O)[n-]c(C(=Cc2cccc(OC(C)C)c2)CC)n1 ZINC000435340734 1040293387 /nfs/dbraw/zinc/29/33/87/1040293387.db2.gz MKJZYIGCKORNIS-LFIBNONCSA-N -1 3 326.440 4.460 20 0 EIADHM COc1ccc([C@H](C)NCc2cccc([O-])c2Br)cc1 ZINC000315407243 1040323639 /nfs/dbraw/zinc/32/36/39/1040323639.db2.gz RACPHXOCVJWUBH-NSHDSACASA-N -1 3 336.229 4.014 20 0 EIADHM Cc1ccc(-c2nc(NC(=O)[C@@H](C)c3ccc4ccccc4c3)n[n-]2)o1 ZINC000479442604 1040348821 /nfs/dbraw/zinc/34/88/21/1040348821.db2.gz DMMJUOINPLTCBW-ZDUSSCGKSA-N -1 3 346.390 4.269 20 0 EIADHM [O-]c1cccc(CN[C@@H]2CCCc3sccc32)c1Br ZINC000315500024 1040351704 /nfs/dbraw/zinc/35/17/04/1040351704.db2.gz GUCTZBSRBBRSAT-GFCCVEGCSA-N -1 3 338.270 4.383 20 0 EIADHM Cc1cc(=O)[n-]c([C@H](C)Sc2nc3cc(F)cc(Cl)c3o2)n1 ZINC000479509431 1040427748 /nfs/dbraw/zinc/42/77/48/1040427748.db2.gz CQLXXYRMBHVEBH-ZETCQYMHSA-N -1 3 339.779 4.278 20 0 EIADHM Cc1nc2ccccc2c(C)c1C(=O)Nc1cc(Cl)ccc1[O-] ZINC000539468521 1040460346 /nfs/dbraw/zinc/46/03/46/1040460346.db2.gz OGNWQTFREMDGTG-UHFFFAOYSA-N -1 3 326.783 4.463 20 0 EIADHM COc1ccccc1C[C@@H](NC(=O)c1cc([O-])ccc1Cl)C(C)C ZINC000551701098 1040512517 /nfs/dbraw/zinc/51/25/17/1040512517.db2.gz IFUAUQSUEJFETM-QGZVFWFLSA-N -1 3 347.842 4.051 20 0 EIADHM O=C(Nc1ccc(Br)cc1[O-])c1ccc2ncsc2c1 ZINC000515205505 1040554340 /nfs/dbraw/zinc/55/43/40/1040554340.db2.gz GDVUOHXKWNCNQN-UHFFFAOYSA-N -1 3 349.209 4.017 20 0 EIADHM COc1cc(C)c([N-]S(=O)(=O)c2ccc(C(C)C)cc2)cc1C ZINC000435731137 1040562268 /nfs/dbraw/zinc/56/22/68/1040562268.db2.gz IKHVZYDIWOFOJL-UHFFFAOYSA-N -1 3 333.453 4.236 20 0 EIADHM C[C@@H](Cc1ccccc1)n1cccc1C(=O)Nc1cccc([O-])c1F ZINC000537998850 1040998714 /nfs/dbraw/zinc/99/87/14/1040998714.db2.gz UVDOVCOUZIHKMH-AWEZNQCLSA-N -1 3 338.382 4.389 20 0 EIADHM CC(C)c1cccc(S(=O)(=O)[N-]c2cncc(Cl)c2Cl)c1 ZINC000480183159 1041047832 /nfs/dbraw/zinc/04/78/32/1041047832.db2.gz WJNLZVHIZSJVCQ-UHFFFAOYSA-N -1 3 345.251 4.313 20 0 EIADHM Cc1onc(-c2cccc(Cl)c2)c1C(=O)Nc1cc(F)ccc1[O-] ZINC000480214233 1041070463 /nfs/dbraw/zinc/07/04/63/1041070463.db2.gz NHYHLFYTYAVSTC-UHFFFAOYSA-N -1 3 346.745 4.400 20 0 EIADHM Cc1ccc(C(=O)N(C)[C@H](C)c2nc3ccccc3s2)c([O-])c1 ZINC000194811100 1041212591 /nfs/dbraw/zinc/21/25/91/1041212591.db2.gz RVYUWQHPFOHXAM-GFCCVEGCSA-N -1 3 326.421 4.144 20 0 EIADHM CSc1cnn(-c2ccccc2)c1[N-]C(=O)c1ccc(C(F)F)o1 ZINC001126976961 1041217294 /nfs/dbraw/zinc/21/72/94/1041217294.db2.gz VYRGREVNGYRDEG-UHFFFAOYSA-N -1 3 349.362 4.377 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2ccc(-c3ccc[nH]3)cc2)c(C)c1 ZINC000538258717 1041221593 /nfs/dbraw/zinc/22/15/93/1041221593.db2.gz DKDOAXNTLHDPCD-UHFFFAOYSA-N -1 3 326.421 4.099 20 0 EIADHM CCc1ccc(-c2nc(-c3ccccc3NC(=O)C3CC3)no2)c([O-])c1 ZINC000515914973 1041260058 /nfs/dbraw/zinc/26/00/58/1041260058.db2.gz JWGANVCHLRKLJF-UHFFFAOYSA-N -1 3 349.390 4.020 20 0 EIADHM Cc1cccc(C(C)C)c1[N-]S(=O)(=O)c1ccc2c(c1)C[C@H](C)O2 ZINC000540205168 1041266780 /nfs/dbraw/zinc/26/67/80/1041266780.db2.gz ZAPMKWSPYIAXAE-AWEZNQCLSA-N -1 3 345.464 4.243 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2c(C)cccc2Cl)c(Cl)c1 ZINC000461169248 1041274440 /nfs/dbraw/zinc/27/44/40/1041274440.db2.gz UHXXRYSLQCDCEF-UHFFFAOYSA-N -1 3 330.236 4.411 20 0 EIADHM O=C(c1ccc(O)cc1[O-])N1CCCC[C@H]1CCCc1ccccc1 ZINC000436521512 1041304913 /nfs/dbraw/zinc/30/49/13/1041304913.db2.gz NDXVLHGTILAYIK-KRWDZBQOSA-N -1 3 339.435 4.115 20 0 EIADHM COc1ccccc1[C@H]1CCN(C(=O)c2ccc(C(C)C)cc2[O-])C1 ZINC000436528880 1041312545 /nfs/dbraw/zinc/31/25/45/1041312545.db2.gz MSYYVKJVYNTPGQ-INIZCTEOSA-N -1 3 339.435 4.154 20 0 EIADHM O=C([O-])CC1CC(NCc2c(Cl)cccc2Oc2ccccc2)C1 ZINC000904062793 1041313284 /nfs/dbraw/zinc/31/32/84/1041313284.db2.gz SGVZKRVEEVGSGJ-UHFFFAOYSA-N -1 3 345.826 4.475 20 0 EIADHM Cc1occc1CN(C)C(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436548381 1041323407 /nfs/dbraw/zinc/32/34/07/1041323407.db2.gz MDKQUHPAICDSJD-UHFFFAOYSA-N -1 3 337.375 4.358 20 0 EIADHM COc1ccc(CCCN(C)C(=O)c2ccc(C(C)C)cc2[O-])cc1 ZINC000436548292 1041326494 /nfs/dbraw/zinc/32/64/94/1041326494.db2.gz QGZWPLOJMAYAKA-UHFFFAOYSA-N -1 3 341.451 4.229 20 0 EIADHM CSc1cccc(N(C)C(=O)c2ccc3c(c2[O-])OC(C)(C)C3)c1 ZINC000436544268 1041337975 /nfs/dbraw/zinc/33/79/75/1041337975.db2.gz OHTLWCAOAVSFEE-UHFFFAOYSA-N -1 3 343.448 4.104 20 0 EIADHM CO[C@H](C)CN(C(=O)c1cc(Oc2ccccc2)ccc1[O-])C(C)C ZINC000436565269 1041345854 /nfs/dbraw/zinc/34/58/54/1041345854.db2.gz UTMLDYALOLKEQE-OAHLLOKOSA-N -1 3 343.423 4.070 20 0 EIADHM COc1ccc(C(=O)N(C)[C@@H]2CCC[C@H]2c2ccc(C)cc2)c([O-])c1 ZINC000436591722 1041351484 /nfs/dbraw/zinc/35/14/84/1041351484.db2.gz RDQARSDKHGXNDB-PKOBYXMFSA-N -1 3 339.435 4.118 20 0 EIADHM CC(C)c1ccc(C(=O)N2CC[C@H](COc3ccccc3)C2)c([O-])c1 ZINC000436598037 1041355139 /nfs/dbraw/zinc/35/51/39/1041355139.db2.gz YDEBKEUOVOCSFR-INIZCTEOSA-N -1 3 339.435 4.057 20 0 EIADHM O=C(c1cc(CCc2ccccc2)ccc1[O-])N1C[C@@H]2CCC[C@H]2C1 ZINC000436585948 1041361594 /nfs/dbraw/zinc/36/15/94/1041361594.db2.gz RUCUWSVFEVJDIC-OALUTQOASA-N -1 3 335.447 4.050 20 0 EIADHM O=C(Nc1cnn(C2CCCC2)c1)N([O-])Cc1ccccc1Cl ZINC000904202468 1041384535 /nfs/dbraw/zinc/38/45/35/1041384535.db2.gz HUQRDYSIVQJUKD-UHFFFAOYSA-N -1 3 334.807 4.075 20 0 EIADHM CC(=O)c1cc(F)c([N-]C(=O)c2cc(C)c(F)cc2F)c(F)c1 ZINC000538542812 1041402650 /nfs/dbraw/zinc/40/26/50/1041402650.db2.gz IPPOHUKMISVXKG-UHFFFAOYSA-N -1 3 325.261 4.006 20 0 EIADHM CCC(C)(C)C1CCC(NC(=O)c2cc(OC)c([O-])c(OC)c2)CC1 ZINC000436663877 1041403457 /nfs/dbraw/zinc/40/34/57/1041403457.db2.gz NFYSKTTXKFYDRM-UHFFFAOYSA-N -1 3 349.471 4.134 20 0 EIADHM O=c1[nH]c(-c2ccc([O-])cc2Cl)nc2cc(Cl)c(Cl)cc12 ZINC000436670303 1041409242 /nfs/dbraw/zinc/40/92/42/1041409242.db2.gz DWWJAVBJRXATNG-UHFFFAOYSA-N -1 3 341.581 4.256 20 0 EIADHM Cc1cccc(CO[N-]C(=O)CCCCCO[C@@H]2CCC[C@H](C)C2)n1 ZINC000898933765 1041414392 /nfs/dbraw/zinc/41/43/92/1041414392.db2.gz GKADXCANTQBIIH-QFBILLFUSA-N -1 3 348.487 4.094 20 0 EIADHM CCCCOc1ccc(NC(=O)c2cc(OC)ccc2[O-])c(C)c1 ZINC000436690482 1041424960 /nfs/dbraw/zinc/42/49/60/1041424960.db2.gz QTHYDKVQJZNODU-UHFFFAOYSA-N -1 3 329.396 4.140 20 0 EIADHM CCCCN(C(=O)c1cc(OC)c([O-])c(OC)c1)[C@H]1CCC[C@@H](C)C1 ZINC000436701712 1041433692 /nfs/dbraw/zinc/43/36/92/1041433692.db2.gz ALKHCYJWSXBUIP-ZBFHGGJFSA-N -1 3 349.471 4.230 20 0 EIADHM COc1cccc(C(=O)N2CCc3cc(-c4ccccc4)ccc32)c1[O-] ZINC000436719717 1041443108 /nfs/dbraw/zinc/44/31/08/1041443108.db2.gz PSHBKVKLOZHSQI-UHFFFAOYSA-N -1 3 345.398 4.271 20 0 EIADHM CC(C)c1ccc(C(=O)NCc2cc(-c3ccccc3)on2)c([O-])c1 ZINC000436731201 1041454188 /nfs/dbraw/zinc/45/41/88/1041454188.db2.gz ZZJVKZXVIFPADL-UHFFFAOYSA-N -1 3 336.391 4.101 20 0 EIADHM CCN(C(=O)c1ccc(C)cc1[O-])c1ccc(Br)cc1 ZINC000436758225 1041455669 /nfs/dbraw/zinc/45/56/69/1041455669.db2.gz WILFLBYFTORQDE-UHFFFAOYSA-N -1 3 334.213 4.130 20 0 EIADHM CCOc1ccc([C@@H]2CCCN2C(=O)c2ccc(C)cc2[O-])cc1 ZINC000436758410 1041457833 /nfs/dbraw/zinc/45/78/33/1041457833.db2.gz XXRPBAJTZMKBKZ-SFHVURJKSA-N -1 3 325.408 4.077 20 0 EIADHM C[C@H](c1ccco1)N(C)C(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC000436761741 1041460207 /nfs/dbraw/zinc/46/02/07/1041460207.db2.gz OJVFPTKRWISPME-OAHLLOKOSA-N -1 3 335.403 4.409 20 0 EIADHM C[C@H]1c2cccn2CCN1C(=O)c1cc(Oc2ccccc2)ccc1[O-] ZINC000436753168 1041465402 /nfs/dbraw/zinc/46/54/02/1041465402.db2.gz COUWNZQIFRDGHY-HNNXBMFYSA-N -1 3 348.402 4.203 20 0 EIADHM COc1ccc(C(=O)N2CCCCC[C@@H]2c2ccccc2)c([O-])c1 ZINC000436803666 1041489209 /nfs/dbraw/zinc/48/92/09/1041489209.db2.gz MAWQCRAFTAIDGQ-GOSISDBHSA-N -1 3 325.408 4.158 20 0 EIADHM CCC(=O)Nc1ccc(Cl)c(NC(=O)c2ccc(CC)cc2[O-])c1 ZINC000436808323 1041491873 /nfs/dbraw/zinc/49/18/73/1041491873.db2.gz OOMFGWSWCZOKHV-UHFFFAOYSA-N -1 3 346.814 4.209 20 0 EIADHM Cc1ccc(C(=O)Nc2cc3c(cc2Cl)OCCCO3)c([O-])c1C ZINC000538745874 1041521363 /nfs/dbraw/zinc/52/13/63/1041521363.db2.gz HMCVCTJSLWBLGF-UHFFFAOYSA-N -1 3 347.798 4.076 20 0 EIADHM CCN(C)[C@@H](c1nc(-c2ccc([O-])cc2Cl)no1)c1ccccc1 ZINC000436870224 1041527844 /nfs/dbraw/zinc/52/78/44/1041527844.db2.gz GZZSGNUWGFOXNA-MRXNPFEDSA-N -1 3 343.814 4.137 20 0 EIADHM Cc1cccnc1-c1noc(-c2cc(Cc3ccccc3)ccc2[O-])n1 ZINC000436894698 1041536217 /nfs/dbraw/zinc/53/62/17/1041536217.db2.gz RPRZDLQWJHVOKV-UHFFFAOYSA-N -1 3 343.386 4.403 20 0 EIADHM COc1cc(-c2nc(C3CCC(C)(C)CC3)no2)cc(OC)c1[O-] ZINC000436887267 1041541903 /nfs/dbraw/zinc/54/19/03/1041541903.db2.gz WPWFUCJORGVIOU-UHFFFAOYSA-N -1 3 332.400 4.143 20 0 EIADHM COc1cccc(C(=O)N2C[C@@H](c3ccccc3)c3ccccc32)c1[O-] ZINC000436885680 1041542314 /nfs/dbraw/zinc/54/23/14/1041542314.db2.gz IPTQEDOPLNVYNM-SFHVURJKSA-N -1 3 345.398 4.193 20 0 EIADHM CCSc1cccc(F)c1[N-]C(=O)c1cccc(OC(C)C)n1 ZINC000484936868 1041543163 /nfs/dbraw/zinc/54/31/63/1041543163.db2.gz NZQRSBIIEAAOHX-UHFFFAOYSA-N -1 3 334.416 4.372 20 0 EIADHM Cc1ccc(C(=O)N2CC=C(c3cccc(Cl)c3)CC2)c([O-])c1 ZINC000436892471 1041545636 /nfs/dbraw/zinc/54/56/36/1041545636.db2.gz JOQYHRVNZWHAOT-UHFFFAOYSA-N -1 3 327.811 4.284 20 0 EIADHM [O-]c1ccccc1-c1nc(-c2ccc(Oc3cccnc3)cc2)no1 ZINC000436914839 1041556253 /nfs/dbraw/zinc/55/62/53/1041556253.db2.gz NADVCSWQKQDIPH-UHFFFAOYSA-N -1 3 331.331 4.297 20 0 EIADHM COc1ccc([O-])c(-c2nc(CCCc3ccccc3Cl)no2)c1 ZINC000436926880 1041561671 /nfs/dbraw/zinc/56/16/71/1041561671.db2.gz LWYDWQWFTNYHNU-UHFFFAOYSA-N -1 3 344.798 4.280 20 0 EIADHM CC[C@@H](C)Oc1ccc(-c2noc(-c3cc(OC)ccc3[O-])n2)cc1 ZINC000436934545 1041564997 /nfs/dbraw/zinc/56/49/97/1041564997.db2.gz HAQXZPULWRLAEQ-GFCCVEGCSA-N -1 3 340.379 4.295 20 0 EIADHM CCCN(C(=O)c1cc(CC)ccc1[O-])[C@H]1CCCc2cccnc21 ZINC000436954635 1041574368 /nfs/dbraw/zinc/57/43/68/1041574368.db2.gz HXYORFPIXNGKQM-SFHVURJKSA-N -1 3 338.451 4.279 20 0 EIADHM C[C@H]1C[C@H](C)CN(C(=O)c2cc(Oc3ccccc3)ccc2[O-])C1 ZINC000436953454 1041575486 /nfs/dbraw/zinc/57/54/86/1041575486.db2.gz POMGSFSTXOFEEH-GJZGRUSLSA-N -1 3 325.408 4.303 20 0 EIADHM C[C@@H]1C[C@@H](c2ccccc2)CCN1C(=O)NCc1ccc([O-])c(F)c1 ZINC000542184827 1042324581 /nfs/dbraw/zinc/32/45/81/1042324581.db2.gz FTXRKAJAJSWZGJ-PBHICJAKSA-N -1 3 342.414 4.009 20 0 EIADHM CN(Cc1cc2ccccc2o1)C(=O)CCCc1ccc([O-])c(F)c1 ZINC000469428486 1042473120 /nfs/dbraw/zinc/47/31/20/1042473120.db2.gz QVUPNDZURIWETA-UHFFFAOYSA-N -1 3 341.382 4.259 20 0 EIADHM CC(=O)c1ccc(C(=O)N[C@@H](C)CC(C)(C)c2ccccc2)cc1[O-] ZINC000439059402 1042478070 /nfs/dbraw/zinc/47/80/70/1042478070.db2.gz NLEROAUIPSUGOW-AWEZNQCLSA-N -1 3 339.435 4.081 20 0 EIADHM CCc1ccc([O-])c(C(=O)N(C)[C@H]2CC[C@@H](C(F)(F)F)CC2)c1 ZINC000426468890 1042738144 /nfs/dbraw/zinc/73/81/44/1042738144.db2.gz GUFQILRQCZFMMU-BETUJISGSA-N -1 3 329.362 4.148 20 0 EIADHM O=C([N-]c1cc(-c2ccccc2)on1)c1cnc(-c2ccco2)s1 ZINC000175868181 1042786695 /nfs/dbraw/zinc/78/66/95/1042786695.db2.gz KRCDXENEYFUVPI-UHFFFAOYSA-N -1 3 337.360 4.310 20 0 EIADHM O=C(Nc1cc(F)ccc1[O-])c1cccc(Br)c1Cl ZINC000184130294 1043081140 /nfs/dbraw/zinc/08/11/40/1043081140.db2.gz YFVHUGRTNCSNAL-UHFFFAOYSA-N -1 3 344.567 4.200 20 0 EIADHM COc1cccc(F)c1[N-]C(=O)c1cc(-c2cccc(Cl)c2)no1 ZINC000184484651 1043101703 /nfs/dbraw/zinc/10/17/03/1043101703.db2.gz NQDWGVOTVYCXRD-UHFFFAOYSA-N -1 3 346.745 4.395 20 0 EIADHM CSc1cccc(C)c1[N-]C(=O)c1cnc([C@@H]2CCCO2)s1 ZINC000184600268 1043111828 /nfs/dbraw/zinc/11/18/28/1043111828.db2.gz MWVFXZDIZLMHCN-NSHDSACASA-N -1 3 334.466 4.277 20 0 EIADHM Cc1ccc(NC(=O)C(C)(C)C)cc1NC(=O)c1c(C)cccc1[O-] ZINC000625500033 1043166281 /nfs/dbraw/zinc/16/62/81/1043166281.db2.gz ODOWRVIQSJICDB-UHFFFAOYSA-N -1 3 340.423 4.246 20 0 EIADHM Cc1ccc(Cl)c([N-]S(=O)(=O)c2c[nH]c3cccc(F)c32)c1 ZINC000185274434 1043169144 /nfs/dbraw/zinc/16/91/44/1043169144.db2.gz ZWYMEKAEVQHNDG-UHFFFAOYSA-N -1 3 338.791 4.070 20 0 EIADHM Cc1ccc(C)c2sc(NC(=O)c3c[n-]c4ccccc4c3=O)nc21 ZINC000076993421 1043199200 /nfs/dbraw/zinc/19/92/00/1043199200.db2.gz LNLMZNAMXDHOPH-UHFFFAOYSA-N -1 3 349.415 4.007 20 0 EIADHM O=C(CCCCCc1ccc(F)cc1)NCc1ccc([O-])c(F)c1 ZINC000427760715 1043199626 /nfs/dbraw/zinc/19/96/26/1043199626.db2.gz GNABHMUWLLFUSC-UHFFFAOYSA-N -1 3 333.378 4.090 20 0 EIADHM O=C(Nc1nc2ccsc2s1)c1cc([O-])c2ccccc2c1 ZINC000525923195 1043234596 /nfs/dbraw/zinc/23/45/96/1043234596.db2.gz NWAQLNXGCREXPO-UHFFFAOYSA-N -1 3 326.402 4.469 20 0 EIADHM COc1ccc([C@@H](C)NC(=O)c2cc([O-])c3ccccc3c2)cc1F ZINC000525923696 1043235134 /nfs/dbraw/zinc/23/51/34/1043235134.db2.gz CSEQEKDULYGXQV-GFCCVEGCSA-N -1 3 339.366 4.184 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N1CC[C@@H](Cc2ccccc2)C1 ZINC000525934108 1043236593 /nfs/dbraw/zinc/23/65/93/1043236593.db2.gz BBLCALAEUGTLBH-KRWDZBQOSA-N -1 3 331.415 4.250 20 0 EIADHM Cc1ccccc1[C@@H]1CCN(C(=O)c2cc([O-])c3ccccc3c2)C1 ZINC000526890464 1043243941 /nfs/dbraw/zinc/24/39/41/1043243941.db2.gz KWVLMSZYKXLMGV-QGZVFWFLSA-N -1 3 331.415 4.484 20 0 EIADHM CC(C)(CNC(=O)c1cc([O-])c2ccccc2c1)Oc1ccccc1 ZINC000526895322 1043244571 /nfs/dbraw/zinc/24/45/71/1043244571.db2.gz RVOFKMUPQZOQMG-UHFFFAOYSA-N -1 3 335.403 4.133 20 0 EIADHM C[C@H](CCCC(F)(F)F)NC(=O)c1cc([O-])c2ccccc2c1 ZINC000526934807 1043246152 /nfs/dbraw/zinc/24/61/52/1043246152.db2.gz IDPOFAPLXIVDRC-LLVKDONJSA-N -1 3 325.330 4.396 20 0 EIADHM O=C(Nc1nnc(-c2ccccc2)s1)c1cc([O-])c2ccccc2c1 ZINC000527160274 1043251514 /nfs/dbraw/zinc/25/15/14/1043251514.db2.gz OKXABNMCJFRHIH-UHFFFAOYSA-N -1 3 347.399 4.316 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N1CC[C@@H](Cc2ccc(F)cc2)C1 ZINC000527164083 1043251622 /nfs/dbraw/zinc/25/16/22/1043251622.db2.gz XVFAVSKIFVZIQJ-INIZCTEOSA-N -1 3 349.405 4.389 20 0 EIADHM O=C(N[C@@H](c1ccccc1)[C@H]1CCCO1)c1cc([O-])c2ccccc2c1 ZINC000527450144 1043260128 /nfs/dbraw/zinc/26/01/28/1043260128.db2.gz PVUKNIALENOKBG-RTWAWAEBSA-N -1 3 347.414 4.196 20 0 EIADHM C[C@@H]1CO[C@@H](c2ccccc2)CN1C(=O)c1cc([O-])c2ccccc2c1 ZINC000527449292 1043261532 /nfs/dbraw/zinc/26/15/32/1043261532.db2.gz XXDORCKWLWIVIH-QVKFZJNVSA-N -1 3 347.414 4.148 20 0 EIADHM C[C@H]1CN(C(=O)c2cc([O-])c3ccccc3c2)[C@H](c2ccccc2)CO1 ZINC000527467088 1043262040 /nfs/dbraw/zinc/26/20/40/1043262040.db2.gz CLGBJWCFUCWNSZ-YWZLYKJASA-N -1 3 347.414 4.148 20 0 EIADHM COc1ccccc1C[C@@H](C)N(C)C(=O)c1cc([O-])c2ccccc2c1 ZINC000527467776 1043263557 /nfs/dbraw/zinc/26/35/57/1043263557.db2.gz GPIWFVZDUXSFNW-OAHLLOKOSA-N -1 3 349.430 4.257 20 0 EIADHM O=C(Nc1cc2c(cc1Cl)OCO2)c1cc([O-])c2ccccc2c1 ZINC000527461179 1043263595 /nfs/dbraw/zinc/26/35/95/1043263595.db2.gz PPTAINJFPXBSMZ-UHFFFAOYSA-N -1 3 341.750 4.180 20 0 EIADHM C[C@H](c1cccc(Cl)c1)N(C)C(=O)NCc1ccc([O-])c(F)c1 ZINC000163778107 1043264013 /nfs/dbraw/zinc/26/40/13/1043264013.db2.gz CFFCHCGGZNDCCL-LLVKDONJSA-N -1 3 336.794 4.087 20 0 EIADHM Cc1cc(N2CCCCCC2)ccc1[N-]S(=O)(=O)c1ccccc1 ZINC000508100735 1043272672 /nfs/dbraw/zinc/27/26/72/1043272672.db2.gz HVYCNAXIJDHQAS-UHFFFAOYSA-N -1 3 344.480 4.176 20 0 EIADHM [O-]c1c(F)cc(F)cc1Nc1nc(Cl)ccc1Br ZINC001212481883 1043455795 /nfs/dbraw/zinc/45/57/95/1043455795.db2.gz OUTJRGSJTDFORN-UHFFFAOYSA-N -1 3 335.535 4.225 20 0 EIADHM CSc1ccncc1[N-]C(=O)c1nc(-c2ccco2)sc1C ZINC000674257100 1043504231 /nfs/dbraw/zinc/50/42/31/1043504231.db2.gz RUHDCOLBXBZIFF-UHFFFAOYSA-N -1 3 331.422 4.081 20 0 EIADHM Cc1ccc(Br)c(C(=O)Nc2c([O-])cccc2Cl)c1 ZINC000521119560 1043554555 /nfs/dbraw/zinc/55/45/55/1043554555.db2.gz KJNIJTINXTTXAZ-UHFFFAOYSA-N -1 3 340.604 4.369 20 0 EIADHM Cc1ccc(-c2nsc([N-]C(=O)c3cc(F)ccc3F)n2)s1 ZINC000066413194 1043688063 /nfs/dbraw/zinc/68/80/63/1043688063.db2.gz LTDZBIBMCNSHNN-UHFFFAOYSA-N -1 3 337.376 4.106 20 0 EIADHM CCSc1ccc(Cl)cc1[N-]C(=O)c1cn(C(C)(C)C)nn1 ZINC000191273235 1043804216 /nfs/dbraw/zinc/80/42/16/1043804216.db2.gz LATQXROZBCXJNF-UHFFFAOYSA-N -1 3 338.864 4.051 20 0 EIADHM Cc1ccc(-n2ccnc2Sc2nc3ccccc3c(=O)[n-]2)c(C)c1 ZINC000731917289 1043845315 /nfs/dbraw/zinc/84/53/15/1043845315.db2.gz PXOADACFMYOSJC-UHFFFAOYSA-N -1 3 348.431 4.289 20 0 EIADHM O=C(Nc1cc(Br)ccc1[O-])c1cc2occc2s1 ZINC000674744765 1043860149 /nfs/dbraw/zinc/86/01/49/1043860149.db2.gz RHWDWYKNQVJQPC-UHFFFAOYSA-N -1 3 338.182 4.215 20 0 EIADHM Cc1sc2[n-]c([C@@H](C)OC(=O)/C=C/C(C)(C)C)nc(=O)c2c1C ZINC000732401428 1043915354 /nfs/dbraw/zinc/91/53/54/1043915354.db2.gz GEICICHGHMWWQT-QROSGCPLSA-N -1 3 334.441 4.220 20 0 EIADHM CC1(C)CN(Cc2nc3c4ccccc4oc3c(=O)[n-]2)c2ccccc21 ZINC000675127068 1044039482 /nfs/dbraw/zinc/03/94/82/1044039482.db2.gz ZUEWKWHDDQSXEC-UHFFFAOYSA-N -1 3 345.402 4.379 20 0 EIADHM C[C@H](Oc1c([O-])cc(Cl)cc1F)c1ccc(Br)nc1 ZINC001234448464 1044055765 /nfs/dbraw/zinc/05/57/65/1044055765.db2.gz SHQFRAICNKHOFV-ZETCQYMHSA-N -1 3 346.583 4.482 20 0 EIADHM Cc1sc(-c2ccco2)nc1C(=O)[N-]c1nc(C(C)(C)C)ns1 ZINC000068072790 1044125106 /nfs/dbraw/zinc/12/51/06/1044125106.db2.gz MWICMLASZNXJPV-UHFFFAOYSA-N -1 3 348.453 4.113 20 0 EIADHM Cc1cc(CSc2nc(=O)cc([O-])n2C2CCCC2)c(C)s1 ZINC000194323878 1044287789 /nfs/dbraw/zinc/28/77/89/1044287789.db2.gz MUFUYSMCEDTRCW-UHFFFAOYSA-N -1 3 336.482 4.035 20 0 EIADHM O=C(CCC1CCCCC1)[N-]OCc1cc(-c2ccc(F)cc2)no1 ZINC000733997826 1044455066 /nfs/dbraw/zinc/45/50/66/1044455066.db2.gz GJZYXWJUSWLNCD-UHFFFAOYSA-N -1 3 346.402 4.389 20 0 EIADHM CSc1ccc([O-])c(C(=O)N[C@@H](C)Cc2ccccc2Cl)c1 ZINC001141750290 1044505706 /nfs/dbraw/zinc/50/57/06/1044505706.db2.gz HSJFKHMRWNGTNH-NSHDSACASA-N -1 3 335.856 4.129 20 0 EIADHM Cc1cccc(CN(Cc2ccccn2)C(=O)c2ccc(C)cc2[O-])c1 ZINC000094106304 1044527438 /nfs/dbraw/zinc/52/74/38/1044527438.db2.gz OFIBKJYROXXCBY-UHFFFAOYSA-N -1 3 346.430 4.247 20 0 EIADHM CCCOc1ccc(S(=O)(=O)[N-]c2cccc(Cl)c2C)cc1 ZINC000029046290 1044675437 /nfs/dbraw/zinc/67/54/37/1044675437.db2.gz FRPQPBBFRNESNK-UHFFFAOYSA-N -1 3 339.844 4.238 20 0 EIADHM [O-]c1cc2ccccc2cc1-c1nc(Cc2ccc(F)cc2F)no1 ZINC000327132765 1044680137 /nfs/dbraw/zinc/68/01/37/1044680137.db2.gz TVWOLUSABFQAJN-UHFFFAOYSA-N -1 3 338.313 4.464 20 0 EIADHM CCc1cc2c(CSc3ccc(OC)cc3)cc(=O)oc2cc1[O-] ZINC000007294703 1044726745 /nfs/dbraw/zinc/72/67/45/1044726745.db2.gz XZENMKAKBOEHPA-UHFFFAOYSA-N -1 3 342.416 4.362 20 0 EIADHM C[C@@H](c1cccc(Cl)c1)N(C)C(=O)c1cc(=O)c2ccccc2[n-]1 ZINC000053457618 1044812243 /nfs/dbraw/zinc/81/22/43/1044812243.db2.gz WDIMMLBCIHUARC-LBPRGKRZSA-N -1 3 340.810 4.015 20 0 EIADHM C[C@@H](OC(=O)c1cc2ccsc2[n-]1)c1nc(-c2cccs2)no1 ZINC000914890496 1044852092 /nfs/dbraw/zinc/85/20/92/1044852092.db2.gz ARBIJPLMKWJGSZ-MRVPVSSYSA-N -1 3 345.405 4.259 20 0 EIADHM CCc1cc(=O)[n-]c(CSC[C@@H](OC)c2ccc(Cl)cc2)n1 ZINC000508997731 1044893422 /nfs/dbraw/zinc/89/34/22/1044893422.db2.gz AHWAZGZZKSPXFC-CQSZACIVSA-N -1 3 338.860 4.019 20 0 EIADHM Cc1ccc(C)c(NNC(=O)c2cn[n-]c2-c2ccc(Cl)s2)c1 ZINC000187087453 1044955541 /nfs/dbraw/zinc/95/55/41/1044955541.db2.gz UTUZSWGSZDAMKZ-UHFFFAOYSA-N -1 3 346.843 4.165 20 0 EIADHM Cc1ccc(C)c(NNC(=O)c2c[n-]nc2-c2ccc(Cl)s2)c1 ZINC000187087453 1044955554 /nfs/dbraw/zinc/95/55/54/1044955554.db2.gz UTUZSWGSZDAMKZ-UHFFFAOYSA-N -1 3 346.843 4.165 20 0 EIADHM Cc1cc(C)n(-c2cccc(NCc3c(F)ccc([O-])c3F)c2)n1 ZINC000509348622 1044999419 /nfs/dbraw/zinc/99/94/19/1044999419.db2.gz RZSWBZYASAPUBU-UHFFFAOYSA-N -1 3 329.350 4.085 20 0 EIADHM COC(=O)CCCN(Cc1ccccc1)Cc1cccc([O-])c1Cl ZINC000509077135 1045076171 /nfs/dbraw/zinc/07/61/71/1045076171.db2.gz IOPRYMJLLIHKBO-UHFFFAOYSA-N -1 3 347.842 4.001 20 0 EIADHM O=C([N-]c1cc(Cl)cnc1Cl)c1scnc1C(F)(F)F ZINC001129310948 1045237852 /nfs/dbraw/zinc/23/78/52/1045237852.db2.gz VIDICXOAAKCMTO-UHFFFAOYSA-N -1 3 342.129 4.116 20 0 EIADHM CC(C)(C)[C@H](NC(=O)NCc1ccc([O-])c(F)c1)c1cccc(F)c1 ZINC000489614394 1045287890 /nfs/dbraw/zinc/28/78/90/1045287890.db2.gz BLUJYBFIHDFYJV-QGZVFWFLSA-N -1 3 348.393 4.257 20 0 EIADHM CC(C)C(C)(C)Sc1nc2c(cnn2-c2ccccc2)c(=O)[n-]1 ZINC000763028044 1045490927 /nfs/dbraw/zinc/49/09/27/1045490927.db2.gz POSLPYRTOMMZPI-UHFFFAOYSA-N -1 3 328.441 4.048 20 0 EIADHM O=C(Nc1nc2c(s1)CSCC2)c1cc2sccc2c([O-])c1 ZINC000804360141 1045628298 /nfs/dbraw/zinc/62/82/98/1045628298.db2.gz RJTKYPNTWSBZLJ-UHFFFAOYSA-N -1 3 348.474 4.105 20 0 EIADHM CC(=O)Nc1cc(NC(=O)c2cc3sccc3c([O-])c2)ccc1C ZINC000791326125 1045722304 /nfs/dbraw/zinc/72/23/04/1045722304.db2.gz JEIIGVHFCRVZIE-UHFFFAOYSA-N -1 3 340.404 4.126 20 0 EIADHM O=C(c1cc2sccc2c([O-])c1)N1CCc2c1cccc2Cl ZINC000791385346 1045728908 /nfs/dbraw/zinc/72/89/08/1045728908.db2.gz FVIWLIQTBZWOQR-UHFFFAOYSA-N -1 3 329.808 4.463 20 0 EIADHM CCCO[C@@H]1CCCN(C(=O)c2cc3sccc3c([O-])c2)CC1 ZINC000791361897 1045730705 /nfs/dbraw/zinc/73/07/05/1045730705.db2.gz XKIUVAUVYNNAGB-CQSZACIVSA-N -1 3 333.453 4.028 20 0 EIADHM CCc1ccc(Cl)c(CC)c1NC([O-])=NO[C@@H]1CCCCO1 ZINC000763266472 1045803245 /nfs/dbraw/zinc/80/32/45/1045803245.db2.gz FUNCPMWMRUBBQJ-CQSZACIVSA-N -1 3 326.824 4.045 20 0 EIADHM CCc1ccc(Cl)c(CC)c1NC(=O)[N-]O[C@@H]1CCCCO1 ZINC000763266472 1045803251 /nfs/dbraw/zinc/80/32/51/1045803251.db2.gz FUNCPMWMRUBBQJ-CQSZACIVSA-N -1 3 326.824 4.045 20 0 EIADHM COc1ccc(Nc2ccc([O-])c(F)c2F)c(Br)c1 ZINC001212007399 1045826864 /nfs/dbraw/zinc/82/68/64/1045826864.db2.gz ASHLXFXUDKQRDD-UHFFFAOYSA-N -1 3 330.128 4.185 20 0 EIADHM [O-]c1ccc(Nc2ccc3cnn([C@H]4CCCCO4)c3c2)c(F)c1F ZINC001212009909 1045832116 /nfs/dbraw/zinc/83/21/16/1045832116.db2.gz YMKQUCJIVJRTEL-MRXNPFEDSA-N -1 3 345.349 4.463 20 0 EIADHM CCOC(=O)c1ccc2ccc(Nc3ccc([O-])c(F)c3F)cc2n1 ZINC001212013682 1045834788 /nfs/dbraw/zinc/83/47/88/1045834788.db2.gz DQPPYPOTDOQVOJ-UHFFFAOYSA-N -1 3 344.317 4.139 20 0 EIADHM Cc1cccc(Nc2ccc([O-])c(F)c2F)c1N1CCCCC1=O ZINC001212013654 1045834827 /nfs/dbraw/zinc/83/48/27/1045834827.db2.gz CMBVCENQJRCUGI-UHFFFAOYSA-N -1 3 332.350 4.239 20 0 EIADHM Cc1cc(NC(=O)NCc2ncccc2[O-])ccc1-c1ccccc1 ZINC000791867435 1045837407 /nfs/dbraw/zinc/83/74/07/1045837407.db2.gz WETFWCXYUQQGBH-UHFFFAOYSA-N -1 3 333.391 4.084 20 0 EIADHM [O-]c1ccc(Nc2cccc(F)c2OC[C@H]2CCCO2)c(F)c1F ZINC001212016324 1045839585 /nfs/dbraw/zinc/83/95/85/1045839585.db2.gz KEOJYDCSEJTEKX-SNVBAGLBSA-N -1 3 339.313 4.111 20 0 EIADHM O=C([O-])[C@@H]1CCN(Cc2ccc(Cl)cc2Cl)[C@H]2CCC[C@H]21 ZINC000629373028 1045855065 /nfs/dbraw/zinc/85/50/65/1045855065.db2.gz IWHVDFYMMOBKRM-GUTXKFCHSA-N -1 3 328.239 4.069 20 0 EIADHM CCOc1ccc([C@H](C)NC(=O)c2cc([O-])c3ccccc3c2)cc1 ZINC000792035787 1045855200 /nfs/dbraw/zinc/85/52/00/1045855200.db2.gz NJRKYCOEKFESGR-AWEZNQCLSA-N -1 3 335.403 4.435 20 0 EIADHM CC[C@@H](C)Oc1ccccc1/C=C\C(=O)NCc1ccc([O-])c(F)c1 ZINC000769554786 1046018929 /nfs/dbraw/zinc/01/89/29/1046018929.db2.gz LUGKQKYLTVJNIE-RBJHHQRMSA-N -1 3 343.398 4.038 20 0 EIADHM CCCCN(C(=O)c1cc2c(cc1[O-])OCO2)[C@H](C)c1ccc(C)o1 ZINC000769739129 1046063898 /nfs/dbraw/zinc/06/38/98/1046063898.db2.gz SJGQTNNCRYPFJP-CYBMUJFWSA-N -1 3 345.395 4.026 20 0 EIADHM CCc1ccc([O-])c(C(=O)N2CC[C@@H](c3cccc(Cl)c3)C2)c1 ZINC000496866999 1046086493 /nfs/dbraw/zinc/08/64/93/1046086493.db2.gz IMMKMPGFVHCQOH-OAHLLOKOSA-N -1 3 329.827 4.238 20 0 EIADHM CN(C)[C@@H](C/N=C/c1cc(Cl)ccc1[O-])c1ccccc1Cl ZINC000005291744 1046229391 /nfs/dbraw/zinc/22/93/91/1046229391.db2.gz SDDBBTRPAHAOMY-UWSDUSPXSA-N -1 3 337.250 4.421 20 0 EIADHM O=C([O-])c1ccc(CN2CCC(=Cc3ccc(F)c(F)c3)CC2)cc1 ZINC000263381380 1046279352 /nfs/dbraw/zinc/27/93/52/1046279352.db2.gz BRJBKGGSHPTASC-UHFFFAOYSA-N -1 3 343.373 4.342 20 0 EIADHM COc1cc([C@H](C)NCc2ccc(C(=O)[O-])cc2)ccc1OC(C)C ZINC000263467213 1046292191 /nfs/dbraw/zinc/29/21/91/1046292191.db2.gz KJHBFOYAQUFPJJ-AWEZNQCLSA-N -1 3 343.423 4.031 20 0 EIADHM CCOc1cc(CNc2ccc(OC)c(F)c2)cc(Cl)c1[O-] ZINC000916841943 1046384457 /nfs/dbraw/zinc/38/44/57/1046384457.db2.gz LTFZVNVZZQFWKD-UHFFFAOYSA-N -1 3 325.767 4.204 20 0 EIADHM Cc1ccc(C(=O)N2CCC[C@@H]2c2nc3ccccc3s2)c([O-])c1 ZINC000126039188 1046428877 /nfs/dbraw/zinc/42/88/77/1046428877.db2.gz MUJJXHBBOFJNFL-OAHLLOKOSA-N -1 3 338.432 4.288 20 0 EIADHM Cc1ccc(C(=O)N2CCC[C@H]2c2nc3ccccc3s2)c([O-])c1 ZINC000126039411 1046431741 /nfs/dbraw/zinc/43/17/41/1046431741.db2.gz MUJJXHBBOFJNFL-HNNXBMFYSA-N -1 3 338.432 4.288 20 0 EIADHM Cc1onc(-c2cccs2)c1C(=O)[N-]c1ccnc(Cl)c1F ZINC001129621603 1046608027 /nfs/dbraw/zinc/60/80/27/1046608027.db2.gz WOFVPPIJTOVQJT-UHFFFAOYSA-N -1 3 337.763 4.151 20 0 EIADHM Cc1cccnc1[C@@H](NCc1cccc([O-])c1Br)C(C)C ZINC000459416902 1046643502 /nfs/dbraw/zinc/64/35/02/1046643502.db2.gz TYXAGGZSINWLCX-INIZCTEOSA-N -1 3 349.272 4.345 20 0 EIADHM CCc1ccc(NC(=O)c2c(C)nc(C(C)C)[n-]c2=O)cc1Cl ZINC000804648819 1046705097 /nfs/dbraw/zinc/70/50/97/1046705097.db2.gz LQCGTKPOWFUEMQ-UHFFFAOYSA-N -1 3 333.819 4.082 20 0 EIADHM C[C@@H](c1ccccc1)N(C)Cc1cc(=O)oc2cc([O-])c(Cl)cc12 ZINC000917180204 1046800655 /nfs/dbraw/zinc/80/06/55/1046800655.db2.gz ORZDCXHFTJSARI-LBPRGKRZSA-N -1 3 343.810 4.345 20 0 EIADHM CC(C)c1ccccc1NC(=O)[C@@H](C)OC(=O)c1cc2occc2[n-]1 ZINC000786029860 1046803718 /nfs/dbraw/zinc/80/37/18/1046803718.db2.gz QZBRFIZWIXMFIJ-GFCCVEGCSA-N -1 3 340.379 4.068 20 0 EIADHM O=C([N-]CCCSC/C=C/c1ccc(Cl)cc1)C(F)(F)F ZINC000786802496 1046874820 /nfs/dbraw/zinc/87/48/20/1046874820.db2.gz WBZWCSFGKDOSKS-HNQUOIGGSA-N -1 3 337.794 4.155 20 0 EIADHM Cc1cnc(Cl)c([N-]S(=O)(=O)c2ccccc2C(C)(C)C)c1 ZINC000786881708 1046882070 /nfs/dbraw/zinc/88/20/70/1046882070.db2.gz XQKHSFQWOPIVFS-UHFFFAOYSA-N -1 3 338.860 4.142 20 0 EIADHM Cc1ccc(N[C@H](c2ccc(F)cc2)C(C)C)cc1-c1nn[n-]n1 ZINC001170067825 1046910179 /nfs/dbraw/zinc/91/01/79/1046910179.db2.gz XHFPDIJYYFVOQE-KRWDZBQOSA-N -1 3 325.391 4.123 20 0 EIADHM Cc1ccc(N[C@H](c2ccc(F)cc2)C(C)C)cc1-c1nnn[n-]1 ZINC001170067825 1046910163 /nfs/dbraw/zinc/91/01/63/1046910163.db2.gz XHFPDIJYYFVOQE-KRWDZBQOSA-N -1 3 325.391 4.123 20 0 EIADHM Cc1ccc([C@H]([N-]C(=O)C(F)F)c2ccc(F)cc2Cl)cc1 ZINC000787337635 1047002040 /nfs/dbraw/zinc/00/20/40/1047002040.db2.gz NJVVKOBJKXJKFK-AWEZNQCLSA-N -1 3 327.733 4.258 20 0 EIADHM CC(C)c1ccc(C(=O)NC[C@@H](C)c2nc3ccccc3o2)c([O-])c1 ZINC000746700701 1047036273 /nfs/dbraw/zinc/03/62/73/1047036273.db2.gz ATHHJVVJVOYDEJ-CYBMUJFWSA-N -1 3 338.407 4.190 20 0 EIADHM CCCc1nc(COC(=O)CCCc2ccc([O-])c(F)c2)cs1 ZINC000787847514 1047058096 /nfs/dbraw/zinc/05/80/96/1047058096.db2.gz GTOKVINDGKBDRL-UHFFFAOYSA-N -1 3 337.416 4.006 20 0 EIADHM CCc1cccc(C(=O)N(CC2CC2)c2ccc(C)c(F)c2)c1[O-] ZINC001170081322 1047096146 /nfs/dbraw/zinc/09/61/46/1047096146.db2.gz XNZXDXSEDXXSBU-UHFFFAOYSA-N -1 3 327.399 4.459 20 0 EIADHM Cc1onc(OC(F)F)c1[N-]C(=O)c1cc(Cl)ccc1Cl ZINC000788113281 1047120081 /nfs/dbraw/zinc/12/00/81/1047120081.db2.gz YVPKJFJGQRYVMS-UHFFFAOYSA-N -1 3 337.109 4.144 20 0 EIADHM O=C(N[C@@H]1[C@H]2CCc3ccccc3[C@@H]12)c1cc2sccc2c([O-])c1 ZINC000788310133 1047164941 /nfs/dbraw/zinc/16/49/41/1047164941.db2.gz ZIWRVZKJFZWULI-KFKAGJAMSA-N -1 3 335.428 4.065 20 0 EIADHM O=C(Nc1cccc([O-])c1F)c1cc(-c2cccc(Cl)c2)no1 ZINC000129123880 1047307444 /nfs/dbraw/zinc/30/74/44/1047307444.db2.gz UVFMVGWCBUXFOC-UHFFFAOYSA-N -1 3 332.718 4.092 20 0 EIADHM O=C(Nc1cccc([O-])c1F)C1(c2cccc(C(F)(F)F)c2)CC1 ZINC000129129911 1047308802 /nfs/dbraw/zinc/30/88/02/1047308802.db2.gz MLTHIJXDCIGTTE-UHFFFAOYSA-N -1 3 339.288 4.220 20 0 EIADHM C/C(=C\C(=O)Nc1ccc(Br)cc1[O-])c1ccccc1 ZINC000918125816 1047343994 /nfs/dbraw/zinc/34/39/94/1047343994.db2.gz UODJHRJWAJPHRS-PKNBQFBNSA-N -1 3 332.197 4.197 20 0 EIADHM C[C@@H](Oc1cccc(C(C)(C)C)c1)C(=O)Nc1cccc([O-])c1F ZINC000129306775 1047348849 /nfs/dbraw/zinc/34/88/49/1047348849.db2.gz JYLAUHPMQKJJDR-GFCCVEGCSA-N -1 3 331.387 4.235 20 0 EIADHM O=C(Nc1ccc([O-])c(C(F)(F)F)c1)c1coc(-c2ccccc2)n1 ZINC000476147255 1047375739 /nfs/dbraw/zinc/37/57/39/1047375739.db2.gz JCRSLHHGVUKUNI-UHFFFAOYSA-N -1 3 348.280 4.318 20 0 EIADHM O=C(CCc1ccc(-c2ccccc2)o1)Nc1cccc([O-])c1F ZINC000129447026 1047391816 /nfs/dbraw/zinc/39/18/16/1047391816.db2.gz YUNDSJASKFFMBY-UHFFFAOYSA-N -1 3 325.339 4.363 20 0 EIADHM Cc1nc(-c2ccc([C@@H](C)[N-]C(=O)C(F)(F)C(F)F)cc2)cs1 ZINC000749342291 1047481684 /nfs/dbraw/zinc/48/16/84/1047481684.db2.gz OLJUCBDWBQMHMY-MRVPVSSYSA-N -1 3 346.349 4.196 20 0 EIADHM C[C@@H]1CCc2c(sc3[n-]c(COc4ccc(F)cc4)nc(=O)c23)C1 ZINC000556488978 1047787384 /nfs/dbraw/zinc/78/73/84/1047787384.db2.gz KBZKBVGZNAJWEH-SNVBAGLBSA-N -1 3 344.411 4.240 20 0 EIADHM CC(C)CCc1nnc([N-]C(=O)c2sccc2C(F)F)s1 ZINC000824364861 1047861679 /nfs/dbraw/zinc/86/16/79/1047861679.db2.gz BRBXOMIWBGHXFE-UHFFFAOYSA-N -1 3 331.413 4.378 20 0 EIADHM COc1cccc([O-])c1C(=O)N[C@H]1C[C@@H](C(C)C)c2ccccc21 ZINC001171070399 1047978998 /nfs/dbraw/zinc/97/89/98/1047978998.db2.gz SYPSGEJZMKDBPM-HOTGVXAUSA-N -1 3 325.408 4.015 20 0 EIADHM CCSCC[C@@H](C)NC(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC001137012770 1048063790 /nfs/dbraw/zinc/06/37/90/1048063790.db2.gz KDEKZGXPZXPBHK-OAHLLOKOSA-N -1 3 343.492 4.245 20 0 EIADHM CCCCC[C@](C)(CC)C(=O)NCc1cc(=O)[n-]c(C2CCC2)n1 ZINC000825305358 1048067760 /nfs/dbraw/zinc/06/77/60/1048067760.db2.gz XWHGZHHJOIAZRO-IBGZPJMESA-N -1 3 333.476 4.063 20 0 EIADHM CCCCC[C@@](C)(CC)C(=O)NCc1cc(=O)[n-]c(C2CCC2)n1 ZINC000825305359 1048068568 /nfs/dbraw/zinc/06/85/68/1048068568.db2.gz XWHGZHHJOIAZRO-LJQANCHMSA-N -1 3 333.476 4.063 20 0 EIADHM O=C([N-]c1ccnc(F)c1F)c1occc1CSc1ccccc1 ZINC001131428386 1048071984 /nfs/dbraw/zinc/07/19/84/1048071984.db2.gz AIYQEWDQOONETB-UHFFFAOYSA-N -1 3 346.358 4.497 20 0 EIADHM CC(=O)c1cccc(NC(=O)[C@@H](C)Cc2ccccc2Cl)c1[O-] ZINC000556892575 1048136391 /nfs/dbraw/zinc/13/63/91/1048136391.db2.gz MRLXRGVEZNYSQJ-NSHDSACASA-N -1 3 331.799 4.066 20 0 EIADHM O=C(Nc1ccc(F)c([O-])c1)c1[nH]c2ccccc2c1Br ZINC001143816046 1048214796 /nfs/dbraw/zinc/21/47/96/1048214796.db2.gz XSEIVDZYKASRHR-UHFFFAOYSA-N -1 3 349.159 4.027 20 0 EIADHM O=C(Cc1cc(F)c(F)cc1F)Nc1ccc([O-])c(C(F)(F)F)c1 ZINC000132253798 1048235469 /nfs/dbraw/zinc/23/54/69/1048235469.db2.gz GUPJUIOJFCGWAV-UHFFFAOYSA-N -1 3 349.230 4.010 20 0 EIADHM CCOC(=O)c1cccc2[n-]c(NC(=O)CC3CCCCCC3)nc21 ZINC001134753393 1048254277 /nfs/dbraw/zinc/25/42/77/1048254277.db2.gz LOLZQAMJENHIDP-UHFFFAOYSA-N -1 3 343.427 4.039 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1cscc1Br ZINC000556935975 1048286175 /nfs/dbraw/zinc/28/61/75/1048286175.db2.gz NGDMHNOPEMKKJB-UHFFFAOYSA-N -1 3 332.606 4.122 20 0 EIADHM CC(F)(F)C(=O)[N-][C@@H](c1ccc(F)cc1)c1ccccc1Cl ZINC000815047395 1048303595 /nfs/dbraw/zinc/30/35/95/1048303595.db2.gz FWYYHUYPNSBBEK-AWEZNQCLSA-N -1 3 327.733 4.340 20 0 EIADHM O=C(Cc1coc2ccccc12)Nc1cc(Br)ccc1[O-] ZINC000556961015 1048320975 /nfs/dbraw/zinc/32/09/75/1048320975.db2.gz GKFJBYNSXOISMM-UHFFFAOYSA-N -1 3 346.180 4.082 20 0 EIADHM C[C@@H](CC(=O)[N-]OCc1ccccc1)c1ccc(C(F)(F)F)cc1 ZINC000920031476 1048396417 /nfs/dbraw/zinc/39/64/17/1048396417.db2.gz ATHYHVZVUKKCKA-ZDUSSCGKSA-N -1 3 337.341 4.447 20 0 EIADHM [O-]C(=NO[C@H]1CCCCO1)Nc1cc(Cl)c(Cl)c(Cl)c1 ZINC000844786986 1048501808 /nfs/dbraw/zinc/50/18/08/1048501808.db2.gz PKQJITDZKAVCFT-JTQLQIEISA-N -1 3 339.606 4.227 20 0 EIADHM O=C([N-]O[C@H]1CCCCO1)Nc1cc(Cl)c(Cl)c(Cl)c1 ZINC000844786986 1048501823 /nfs/dbraw/zinc/50/18/23/1048501823.db2.gz PKQJITDZKAVCFT-JTQLQIEISA-N -1 3 339.606 4.227 20 0 EIADHM C[C@@H]1CO[C@H](c2ccccc2)[C@H](C)N1C(=O)c1cc([O-])ccc1Cl ZINC000815553564 1048505487 /nfs/dbraw/zinc/50/54/87/1048505487.db2.gz CYZFXESYNWPMNL-VBHSOAQHSA-N -1 3 345.826 4.036 20 0 EIADHM Cc1nc(-c2ccc(NC(=O)c3cc([O-])ccc3Cl)cc2)co1 ZINC000810057850 1048613092 /nfs/dbraw/zinc/61/30/92/1048613092.db2.gz LJTIIRLVVHIQNH-UHFFFAOYSA-N -1 3 328.755 4.261 20 0 EIADHM CC(C)c1csc(SCc2noc(-c3ccccc3[O-])n2)n1 ZINC000845330284 1048641818 /nfs/dbraw/zinc/64/18/18/1048641818.db2.gz MEIDKSMJZHXYID-UHFFFAOYSA-N -1 3 333.438 4.314 20 0 EIADHM CCCOc1ccccc1[N-]S(=O)(=O)/C=C\c1ccc(F)cc1 ZINC000747596599 1048677525 /nfs/dbraw/zinc/67/75/25/1048677525.db2.gz PWJQOSMASFOWPY-QBFSEMIESA-N -1 3 335.400 4.027 20 0 EIADHM O=C(c1cc(Oc2ccccc2)ccc1[O-])N1CCC=C(Cl)C1 ZINC001144483760 1048692960 /nfs/dbraw/zinc/69/29/60/1048692960.db2.gz YONXSMDMAKERIU-UHFFFAOYSA-N -1 3 329.783 4.153 20 0 EIADHM CC1(C)CCCc2sc(NC(=O)[N-]OCc3ccccc3)nc21 ZINC000810313719 1048759973 /nfs/dbraw/zinc/75/99/73/1048759973.db2.gz JIJVBKXCYJIFQR-UHFFFAOYSA-N -1 3 331.441 4.010 20 0 EIADHM O=C(Cc1ccc([O-])c(F)c1)Nc1ccc(C(F)(F)F)cc1Cl ZINC001144628740 1048763445 /nfs/dbraw/zinc/76/34/45/1048763445.db2.gz FALZAILNJMBRGP-UHFFFAOYSA-N -1 3 347.695 4.385 20 0 EIADHM O=C(Cc1ccc([O-])c(F)c1)Nc1cc(C2CCCCC2)ccc1O ZINC001144631018 1048764512 /nfs/dbraw/zinc/76/45/12/1048764512.db2.gz BWLNDHSTPOEISA-UHFFFAOYSA-N -1 3 343.398 4.466 20 0 EIADHM O=C(Nc1cnn(-c2ccccc2Cl)c1)c1cc([O-])ccc1Cl ZINC000810359785 1048769350 /nfs/dbraw/zinc/76/93/50/1048769350.db2.gz UMSGTOZZLFCETG-UHFFFAOYSA-N -1 3 348.189 4.137 20 0 EIADHM COc1ccc(C2CCN(Cc3cc(F)c([O-])cc3F)CC2)cc1 ZINC001144665663 1048782673 /nfs/dbraw/zinc/78/26/73/1048782673.db2.gz CKLRDPYAUJDNKA-UHFFFAOYSA-N -1 3 333.378 4.059 20 0 EIADHM CN(CCc1ccc(C(F)(F)F)cc1)Cc1cc(F)c([O-])cc1F ZINC001144663779 1048783188 /nfs/dbraw/zinc/78/31/88/1048783188.db2.gz ISOZGBCIRDZFBF-UHFFFAOYSA-N -1 3 345.311 4.364 20 0 EIADHM CC(=O)c1ccc(C(=O)Nc2ccc3c(c2)Cc2ccccc2-3)cc1[O-] ZINC001135551532 1048786000 /nfs/dbraw/zinc/78/60/00/1048786000.db2.gz GEBZKLHGQWMDMA-UHFFFAOYSA-N -1 3 343.382 4.418 20 0 EIADHM O=C([O-])c1ccsc1CN1CCC(c2ccc(F)cc2F)CC1 ZINC001144685082 1048805829 /nfs/dbraw/zinc/80/58/29/1048805829.db2.gz WGGYSXXTKSXVFO-UHFFFAOYSA-N -1 3 337.391 4.104 20 0 EIADHM CC1(C)[C@@H]2OCCC[C@H]2[C@@H]1OC(=O)c1cc2cc(Cl)sc2[n-]1 ZINC000810597245 1048827523 /nfs/dbraw/zinc/82/75/23/1048827523.db2.gz ZYTHVSVKKJDROE-WQAKAFBOSA-N -1 3 339.844 4.243 20 0 EIADHM [O-]c1ccc(F)c(CNc2ccc3c(cnn3C(F)F)c2)c1F ZINC000816564237 1048835053 /nfs/dbraw/zinc/83/50/53/1048835053.db2.gz YMMGHNSYCXTDIR-UHFFFAOYSA-N -1 3 325.265 4.027 20 0 EIADHM CCC1(COC(=O)c2cc3cc(Cl)sc3[n-]2)CCOCC1 ZINC000810663492 1048849273 /nfs/dbraw/zinc/84/92/73/1048849273.db2.gz WOKJVPVNVQTBFF-UHFFFAOYSA-N -1 3 327.833 4.246 20 0 EIADHM CCc1ccc(-c2csc([N-]C(=O)c3c(F)ccnc3F)n2)cc1 ZINC000816833119 1048865086 /nfs/dbraw/zinc/86/50/86/1048865086.db2.gz XZLZSMOFOHXSQA-UHFFFAOYSA-N -1 3 345.374 4.298 20 0 EIADHM CC[C@H](C)CO[N-]C(=O)C12C[C@H]3C[C@@H](C1)CC(C(F)(F)F)(C3)C2 ZINC000816976362 1048884157 /nfs/dbraw/zinc/88/41/57/1048884157.db2.gz BRMOXCQZEPQZAM-WBEQXNMMSA-N -1 3 333.394 4.229 20 0 EIADHM CC1(C)CN(C(=O)c2cc3sccc3c([O-])c2)[C@H]1c1ccncc1 ZINC000817179609 1048907637 /nfs/dbraw/zinc/90/76/37/1048907637.db2.gz AOVFESLPWCSEJM-KRWDZBQOSA-N -1 3 338.432 4.225 20 0 EIADHM CSc1ccc([O-])c(C(=O)N(CCc2ccccc2)CC(C)C)c1 ZINC001136155071 1049188973 /nfs/dbraw/zinc/18/89/73/1049188973.db2.gz ALKMHADKCTVRSF-UHFFFAOYSA-N -1 3 343.492 4.455 20 0 EIADHM C[C@@H]1CC[C@H](C)N(C(=O)c2cc(Oc3ccccc3)ccc2[O-])C1 ZINC001147861901 1049230407 /nfs/dbraw/zinc/23/04/07/1049230407.db2.gz RWMXMGLHMCDZMZ-CABCVRRESA-N -1 3 325.408 4.445 20 0 EIADHM CCc1ccc([O-])c(C(=O)N2C[C@@H](C)C[C@H]2c2cccc(F)c2)c1 ZINC001148097862 1049263701 /nfs/dbraw/zinc/26/37/01/1049263701.db2.gz XEUVMJPRIGKGJG-UGSOOPFHSA-N -1 3 327.399 4.317 20 0 EIADHM CCCCOc1ccc(OC)cc1NC(=O)c1cccc(CC)c1[O-] ZINC001136193409 1049263946 /nfs/dbraw/zinc/26/39/46/1049263946.db2.gz SDZYMUXVOYXMCB-UHFFFAOYSA-N -1 3 343.423 4.394 20 0 EIADHM O=C(Nc1ccn(-c2ccccc2)n1)c1cc2sccc2c([O-])c1 ZINC001148616333 1049345562 /nfs/dbraw/zinc/34/55/62/1049345562.db2.gz LALKEJHLCSVAED-UHFFFAOYSA-N -1 3 335.388 4.045 20 0 EIADHM CC(=O)c1cc(C(=O)N[C@H](C)c2ccc(C(C)C)cc2)ccc1[O-] ZINC001148669792 1049358043 /nfs/dbraw/zinc/35/80/43/1049358043.db2.gz COSWHYWDUXPFQF-CYBMUJFWSA-N -1 3 325.408 4.209 20 0 EIADHM CC[C@@H](NC(=O)c1ccc([O-])c(C(C)=O)c1)c1ccc(C)cc1C ZINC001148670705 1049359424 /nfs/dbraw/zinc/35/94/24/1049359424.db2.gz MDMBICJPUCMKER-GOSISDBHSA-N -1 3 325.408 4.093 20 0 EIADHM Cc1sc2[n-]c([C@H](C)OC(=O)[C@@H]3CCCC[C@@H]3C)nc(=O)c2c1C ZINC000820938532 1049577803 /nfs/dbraw/zinc/57/78/03/1049577803.db2.gz CJGRQVYQXDSZBZ-XHVZSJERSA-N -1 3 348.468 4.444 20 0 EIADHM Cc1ccc2nc(NC(=O)CCCc3ccc([O-])c(F)c3)sc2c1 ZINC001136591318 1049767619 /nfs/dbraw/zinc/76/76/19/1049767619.db2.gz QBUMNZHQKZQDFY-UHFFFAOYSA-N -1 3 344.411 4.411 20 0 EIADHM CCc1ccc([O-])c(C(=O)Nc2ccnn2-c2cccc(Cl)c2)c1 ZINC001136644162 1049807588 /nfs/dbraw/zinc/80/75/88/1049807588.db2.gz KMXKXMSEVQFIOO-UHFFFAOYSA-N -1 3 341.798 4.046 20 0 EIADHM O=C(OC[C@@H]1CC[C@H](c2ccccc2)O1)c1cc(Cl)c(Cl)[n-]1 ZINC000814056480 1049866081 /nfs/dbraw/zinc/86/60/81/1049866081.db2.gz POGKPWQNSNMMNW-SMDDNHRTSA-N -1 3 340.206 4.399 20 0 EIADHM CCC[C@@H]1SCCN1C(=O)c1cc(Cc2ccccc2)ccc1[O-] ZINC001136820246 1049896733 /nfs/dbraw/zinc/89/67/33/1049896733.db2.gz PRKSFSAVKLFDRW-IBGZPJMESA-N -1 3 341.476 4.298 20 0 EIADHM [O-]c1ccc(CNCc2cc(Cl)ccc2Br)cc1F ZINC000080544271 1049900777 /nfs/dbraw/zinc/90/07/77/1049900777.db2.gz VMBGGWIXJRZKQR-UHFFFAOYSA-N -1 3 344.611 4.237 20 0 EIADHM CN(C(=O)c1c[n-]c2ccccc2c1=O)C1CC(C)(C)CC(C)(C)C1 ZINC000618071923 1050229490 /nfs/dbraw/zinc/22/94/90/1050229490.db2.gz SGPJDAHKOJASGG-UHFFFAOYSA-N -1 3 340.467 4.205 20 0 EIADHM Cc1cc(-c2ncccc2NC(=O)Cc2ccc([O-])c(F)c2)cs1 ZINC001177527126 1050240465 /nfs/dbraw/zinc/24/04/65/1050240465.db2.gz TYOIHJFQHFYDLC-UHFFFAOYSA-N -1 3 342.395 4.144 20 0 EIADHM [O-]c1cncc(-c2nc(-c3cc(C(F)(F)F)ccc3Cl)no2)c1 ZINC001212708636 1050330606 /nfs/dbraw/zinc/33/06/06/1050330606.db2.gz MSKVQGPJQGOCGL-UHFFFAOYSA-N -1 3 341.676 4.176 20 0 EIADHM CCC[C@H]1CCCC[C@H]1[N-]S(=O)(=O)c1cc(C)c(Cl)s1 ZINC001186566988 1050363065 /nfs/dbraw/zinc/36/30/65/1050363065.db2.gz QNNWTVNPJKYVON-NWDGAFQWSA-N -1 3 335.922 4.347 20 0 EIADHM CC(=O)c1cccc([O-])c1NC(=O)C=Cc1c[nH]c2cc(C)ccc12 ZINC001178492456 1050483356 /nfs/dbraw/zinc/48/33/56/1050483356.db2.gz CTJNXUZYYGDCQQ-VQHVLOKHSA-N -1 3 334.375 4.036 20 0 EIADHM CCc1ccccc1NC(=O)Nc1cc(Cl)cc(C(=O)OC)c1[O-] ZINC001187641702 1050585467 /nfs/dbraw/zinc/58/54/67/1050585467.db2.gz OSJGBOVIFRAUSR-UHFFFAOYSA-N -1 3 348.786 4.039 20 0 EIADHM COc1cc(Br)c([O-])c(Nc2cccc(C(C)=O)c2)c1 ZINC001173900953 1050615644 /nfs/dbraw/zinc/61/56/44/1050615644.db2.gz HYKJWLMMRCGQKU-UHFFFAOYSA-N -1 3 336.185 4.110 20 0 EIADHM O=C(c1ccc(Nc2c(F)cc([O-])cc2F)cc1)N1CCCCC1 ZINC001174074980 1050746937 /nfs/dbraw/zinc/74/69/37/1050746937.db2.gz XWGGYWFNVPTWNI-UHFFFAOYSA-N -1 3 332.350 4.040 20 0 EIADHM CC1CCN(C(=O)c2ccc(Nc3cc(F)c([O-])c(F)c3)cc2)CC1 ZINC001174161716 1050802483 /nfs/dbraw/zinc/80/24/83/1050802483.db2.gz MOTNEVOIBPMJRK-UHFFFAOYSA-N -1 3 346.377 4.286 20 0 EIADHM Cc1cccc([O-])c1C(=O)N1CC[C@H](c2ccc(C(F)(F)F)cc2)C1 ZINC001188646190 1050812646 /nfs/dbraw/zinc/81/26/46/1050812646.db2.gz ASLGMGXONQVJOU-AWEZNQCLSA-N -1 3 349.352 4.349 20 0 EIADHM COc1ccc(-c2ccccc2NC(=O)c2c(C)cccc2[O-])nc1 ZINC001188654720 1050814065 /nfs/dbraw/zinc/81/40/65/1050814065.db2.gz GNGNOMMQCITQEK-UHFFFAOYSA-N -1 3 334.375 4.024 20 0 EIADHM COc1cccc([C@@H](NC(=O)c2c(C)cccc2[O-])c2ccccc2)c1 ZINC001188660084 1050814553 /nfs/dbraw/zinc/81/45/53/1050814553.db2.gz VTOLPFFUHJJQGH-NRFANRHFSA-N -1 3 347.414 4.229 20 0 EIADHM CC(C)c1ccc(C(=O)N[C@@H]2Cc3ccc(Cl)cc3C2)c([O-])c1 ZINC001180252716 1050935427 /nfs/dbraw/zinc/93/54/27/1050935427.db2.gz ORGUDLRZWWHIEO-MRXNPFEDSA-N -1 3 329.827 4.066 20 0 EIADHM CC(C)CCn1cc(Nc2cc(Br)cc(F)c2[O-])cn1 ZINC001174417932 1050952604 /nfs/dbraw/zinc/95/26/04/1050952604.db2.gz KUECSAAGFKWJJL-UHFFFAOYSA-N -1 3 342.212 4.280 20 0 EIADHM Cc1ccc([N-]S(=O)(=O)c2ccc(F)c3ccccc32)c(F)c1 ZINC001189347943 1050969367 /nfs/dbraw/zinc/96/93/67/1050969367.db2.gz NOCJYRXPOQFRTM-UHFFFAOYSA-N -1 3 333.359 4.227 20 0 EIADHM Cc1ccc(NC2=CCN(C(=O)OC(C)(C)C)CC2)c(Cl)c1[O-] ZINC001174441136 1050972824 /nfs/dbraw/zinc/97/28/24/1050972824.db2.gz WIMDOISLUFUWTA-UHFFFAOYSA-N -1 3 338.835 4.291 20 0 EIADHM C[C@@H](NCc1c(F)cccc1OC(F)F)c1cc([O-])cc(F)c1 ZINC000925484769 1051000435 /nfs/dbraw/zinc/00/04/35/1051000435.db2.gz HZEYTKMAUQQGOZ-SECBINFHSA-N -1 3 329.293 4.123 20 0 EIADHM O=C(COc1cccc2ccccc21)Nc1cc([O-])cc(Cl)c1 ZINC001180535809 1051020323 /nfs/dbraw/zinc/02/03/23/1051020323.db2.gz RXEYYUOXVGXOTQ-UHFFFAOYSA-N -1 3 327.767 4.216 20 0 EIADHM [O-]c1c(Cl)cc(Br)cc1Nc1ccc2c[nH]nc2c1 ZINC001174502411 1051036871 /nfs/dbraw/zinc/03/68/71/1051036871.db2.gz NMLVSEAFCSCZDH-UHFFFAOYSA-N -1 3 338.592 4.428 20 0 EIADHM Cc1cccc2cccc([N-]S(=O)(=O)Cc3cc(F)ccc3F)c12 ZINC001189698662 1051042339 /nfs/dbraw/zinc/04/23/39/1051042339.db2.gz JIOQUTVEQFQNNW-UHFFFAOYSA-N -1 3 347.386 4.368 20 0 EIADHM Cc1ccc(C(=O)c2ccccc2C(=O)Nc2ccc([O-])cc2F)cc1 ZINC000183267394 1051053052 /nfs/dbraw/zinc/05/30/52/1051053052.db2.gz VRKFSIHNQLYUHT-UHFFFAOYSA-N -1 3 349.361 4.323 20 0 EIADHM O=C(Nc1ccc2ccncc2c1)c1cccc(OC(F)(F)F)c1[O-] ZINC001189765988 1051057234 /nfs/dbraw/zinc/05/72/34/1051057234.db2.gz GWNGWDLDOYVPJQ-UHFFFAOYSA-N -1 3 348.280 4.091 20 0 EIADHM COc1ccc(Cn2cc(Nc3cccc(Cl)c3[O-])c(C)n2)cc1 ZINC001174579340 1051064106 /nfs/dbraw/zinc/06/41/06/1051064106.db2.gz ZRUPYIDTURTVNH-UHFFFAOYSA-N -1 3 343.814 4.351 20 0 EIADHM COc1cc2ccccc2cc1C(=O)Nc1cc(Cl)ccc1[O-] ZINC000620207360 1051064841 /nfs/dbraw/zinc/06/48/41/1051064841.db2.gz SCNTXKSSSHJTOB-UHFFFAOYSA-N -1 3 327.767 4.460 20 0 EIADHM CCC(C)(C)c1ccc(S(=O)(=O)[N-]c2ccc(C)nc2F)cc1 ZINC001190423910 1051180283 /nfs/dbraw/zinc/18/02/83/1051180283.db2.gz QJIIDJRSXRJAIE-UHFFFAOYSA-N -1 3 336.432 4.018 20 0 EIADHM CCC(C)(C)c1ccc(S(=O)(=O)[N-]c2cc(O)ccc2F)cc1 ZINC001190447092 1051189893 /nfs/dbraw/zinc/18/98/93/1051189893.db2.gz HIIWKEJFZGUCPI-UHFFFAOYSA-N -1 3 337.416 4.020 20 0 EIADHM Cc1ccc(-c2nc(CC(=O)Nc3ccc(Cl)cc3[O-])cs2)o1 ZINC000153648452 1051210144 /nfs/dbraw/zinc/21/01/44/1051210144.db2.gz DUZYVTSNEWYUOT-UHFFFAOYSA-N -1 3 348.811 4.252 20 0 EIADHM CN(C)c1ccc(Nc2cc(Br)cc(F)c2[O-])cc1 ZINC001174879114 1051229637 /nfs/dbraw/zinc/22/96/37/1051229637.db2.gz QDSCHZHHHWWELG-UHFFFAOYSA-N -1 3 325.181 4.103 20 0 EIADHM CCC1(C)CCN(Cc2cc(=O)oc3cc([O-])c(Cl)cc23)CC1 ZINC001190690327 1051258915 /nfs/dbraw/zinc/25/89/15/1051258915.db2.gz DOWCMKDMQIDECC-UHFFFAOYSA-N -1 3 335.831 4.164 20 0 EIADHM O=C(Nc1ccc(OC(F)(F)F)cc1)Nc1cc(F)ccc1[O-] ZINC001190737469 1051266981 /nfs/dbraw/zinc/26/69/81/1051266981.db2.gz NEGLNXMBNSBXGG-UHFFFAOYSA-N -1 3 330.237 4.074 20 0 EIADHM Cc1cccc(CNC(=O)Nc2cc(Br)c(C)cc2[O-])c1 ZINC001191000717 1051321320 /nfs/dbraw/zinc/32/13/20/1051321320.db2.gz AIGJQDCHMRLOJE-UHFFFAOYSA-N -1 3 349.228 4.093 20 0 EIADHM [O-]c1cc(F)c(Nc2cccc(I)c2)c(F)c1 ZINC001175099633 1051344888 /nfs/dbraw/zinc/34/48/88/1051344888.db2.gz AQVBDWWUAXXYCE-UHFFFAOYSA-N -1 3 347.102 4.019 20 0 EIADHM COc1cc(Nc2c(F)cc([O-])cc2F)c(C)cc1Br ZINC001175099340 1051345672 /nfs/dbraw/zinc/34/56/72/1051345672.db2.gz BAYPOVAWEPDWNB-UHFFFAOYSA-N -1 3 344.155 4.494 20 0 EIADHM COc1ccc(Nc2c(F)cc([O-])cc2F)c(Br)c1 ZINC001175099940 1051348087 /nfs/dbraw/zinc/34/80/87/1051348087.db2.gz HZVIHPLBOAPWKP-UHFFFAOYSA-N -1 3 330.128 4.185 20 0 EIADHM Cc1cc(N)c(Nc2c(F)cc([O-])cc2F)c(Br)c1 ZINC001175096678 1051380331 /nfs/dbraw/zinc/38/03/31/1051380331.db2.gz HYDYJCDHUXJSJS-UHFFFAOYSA-N -1 3 329.144 4.067 20 0 EIADHM CCCCc1ccc(S(=O)(=O)[N-]c2cc(F)cc(F)c2F)cc1 ZINC001191248511 1051411278 /nfs/dbraw/zinc/41/12/78/1051411278.db2.gz DXAGDDTYQFEFRQ-UHFFFAOYSA-N -1 3 343.370 4.247 20 0 EIADHM CCc1cc(=O)[n-]c(-c2ccc(NC[C@@H]3CCCC3(C)C)nc2)n1 ZINC000572583884 1051420191 /nfs/dbraw/zinc/42/01/91/1051420191.db2.gz WHFASHUTTVZIFZ-AWEZNQCLSA-N -1 3 326.444 4.045 20 0 EIADHM CCO[C@@H]1C[C@H](N(C)C(=O)c2cc3sccc3c([O-])c2)C12CCC2 ZINC000774064206 1051438794 /nfs/dbraw/zinc/43/87/94/1051438794.db2.gz CVDRFLMHMSBRPU-DLBZAZTESA-N -1 3 345.464 4.027 20 0 EIADHM C[C@@H]([N-]S(=O)(=O)c1cccc(Cl)c1Cl)C1CCCCC1 ZINC001191615721 1051491769 /nfs/dbraw/zinc/49/17/69/1051491769.db2.gz WPPOVTFXXWMEBJ-SNVBAGLBSA-N -1 3 336.284 4.241 20 0 EIADHM COc1ccc(Br)cc1Nc1c(F)ccc([O-])c1F ZINC001175265389 1051500159 /nfs/dbraw/zinc/50/01/59/1051500159.db2.gz NHLFHIATGVFZLO-UHFFFAOYSA-N -1 3 330.128 4.185 20 0 EIADHM CCOC(=O)c1cnc2c(cccc2Nc2c(F)ccc([O-])c2F)c1 ZINC001175270005 1051505894 /nfs/dbraw/zinc/50/58/94/1051505894.db2.gz RDCODHDSDRQGSV-UHFFFAOYSA-N -1 3 344.317 4.139 20 0 EIADHM Cc1ccc(-c2nc(C)c(C(=O)[N-]c3c(C)noc3C3CC3)s2)o1 ZINC000156676096 1051554008 /nfs/dbraw/zinc/55/40/08/1051554008.db2.gz MEGHLCIBNKDHBW-UHFFFAOYSA-N -1 3 343.408 4.446 20 0 EIADHM COc1ccc2cc(S(=O)(=O)[N-]c3c(C)cccc3F)ccc2c1 ZINC001191966043 1051601958 /nfs/dbraw/zinc/60/19/58/1051601958.db2.gz FGOSLPSXSWEJCR-UHFFFAOYSA-N -1 3 345.395 4.097 20 0 EIADHM CC(=O)c1cccc([O-])c1NC(=O)c1cccc(-c2ccc(C)cc2)n1 ZINC001192063808 1051628310 /nfs/dbraw/zinc/62/83/10/1051628310.db2.gz BKKCCUWVPWEEEW-UHFFFAOYSA-N -1 3 346.386 4.218 20 0 EIADHM CSc1cc(C(=O)[N-]c2nc(Sc3ccccc3)ns2)co1 ZINC001182655968 1051669891 /nfs/dbraw/zinc/66/98/91/1051669891.db2.gz FYUVJXDGLUJHFF-UHFFFAOYSA-N -1 3 349.462 4.257 20 0 EIADHM CN(C(=O)c1ccc(C(C)(C)C)cc1[O-])[C@@H](C1CCC1)C(F)(F)F ZINC001192322838 1051689620 /nfs/dbraw/zinc/68/96/20/1051689620.db2.gz PTOWLTLAGWBQLX-HNNXBMFYSA-N -1 3 343.389 4.493 20 0 EIADHM O=C([N-]c1cc(C2CCCC2)no1)c1nc(C(F)(F)F)cs1 ZINC001192447122 1051736565 /nfs/dbraw/zinc/73/65/65/1051736565.db2.gz LHEROTVYZDLYGM-UHFFFAOYSA-N -1 3 331.319 4.060 20 0 EIADHM Brc1ccc2oc([N-]c3cnn(C4CCC4)c3)nc2c1 ZINC001175755407 1051768367 /nfs/dbraw/zinc/76/83/67/1051768367.db2.gz YRSLFAWZJJGOTM-UHFFFAOYSA-N -1 3 333.189 4.255 20 0 EIADHM O=C(N[C@H]1CCc2ccc(-c3ccccc3)cc21)c1c([O-])cccc1O ZINC001183240155 1051812397 /nfs/dbraw/zinc/81/23/97/1051812397.db2.gz YCYJALCXXHSBJY-SFHVURJKSA-N -1 3 345.398 4.182 20 0 EIADHM Cc1cc(S(=O)(=O)[N-]CC[C@@H]2CCCC2(C)C)sc1Cl ZINC001192857900 1051825039 /nfs/dbraw/zinc/82/50/39/1051825039.db2.gz SJIPDOGIZRVOHD-NSHDSACASA-N -1 3 335.922 4.205 20 0 EIADHM O=C(Nc1c([O-])cccc1C(F)(F)F)N[C@@H]1CCc2ccccc21 ZINC001192994247 1051843527 /nfs/dbraw/zinc/84/35/27/1051843527.db2.gz QCWCTQYUZABHBP-CYBMUJFWSA-N -1 3 336.313 4.220 20 0 EIADHM CCc1ccc(C(C)(C)C(=O)Nc2c([O-])cccc2C(C)=O)cc1 ZINC001183509861 1051859823 /nfs/dbraw/zinc/85/98/23/1051859823.db2.gz AYTPUUVAXUQJND-UHFFFAOYSA-N -1 3 325.408 4.074 20 0 EIADHM Cc1nnc(-c2cccc(Nc3cccc([O-])c3Br)c2)o1 ZINC001175997711 1051867865 /nfs/dbraw/zinc/86/78/65/1051867865.db2.gz WHWQKEVLRYMYJO-UHFFFAOYSA-N -1 3 346.184 4.257 20 0 EIADHM CC[C@@H](C)Sc1ccc(NC([O-])=NO[C@H]2CCCCO2)c(C)c1 ZINC000775581690 1051890906 /nfs/dbraw/zinc/89/09/06/1051890906.db2.gz INJUTYGRWDRXMS-CJNGLKHVSA-N -1 3 338.473 4.465 20 0 EIADHM CC[C@@H](C)Sc1ccc(NC(=O)[N-]O[C@H]2CCCCO2)c(C)c1 ZINC000775581690 1051890911 /nfs/dbraw/zinc/89/09/11/1051890911.db2.gz INJUTYGRWDRXMS-CJNGLKHVSA-N -1 3 338.473 4.465 20 0 EIADHM CC(C)(C)c1nnc([N-]C(=O)c2cscc2C(F)(F)F)s1 ZINC000621704361 1051913034 /nfs/dbraw/zinc/91/30/34/1051913034.db2.gz KIQZAQGRVYWPSV-UHFFFAOYSA-N -1 3 335.376 4.168 20 0 EIADHM O=C([N-]OC1CCCC1)[C@H]1CC=CC[C@@H]1c1nc2ccccc2s1 ZINC000775599087 1051929204 /nfs/dbraw/zinc/92/92/04/1051929204.db2.gz BVJFRQNFFZDMGW-GJZGRUSLSA-N -1 3 342.464 4.337 20 0 EIADHM Cn1ccc2cc(NC(=O)c3ccc([O-])cc3C(F)(F)F)ccc21 ZINC001193746130 1051991242 /nfs/dbraw/zinc/99/12/42/1051991242.db2.gz PUHXAMWFMIAOTG-UHFFFAOYSA-N -1 3 334.297 4.155 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2ccc(F)cc2F)c2ccccc12 ZINC001193824672 1052004647 /nfs/dbraw/zinc/00/46/47/1052004647.db2.gz OAEXJTVKFXUQEF-UHFFFAOYSA-N -1 3 333.359 4.227 20 0 EIADHM Cc1cc(O)cc([O-])c1C(=O)N(C)[C@H](C)c1cccc2ccccc21 ZINC001193928425 1052020781 /nfs/dbraw/zinc/02/07/81/1052020781.db2.gz BVJBFFVZLNAACQ-CQSZACIVSA-N -1 3 335.403 4.393 20 0 EIADHM CC(=O)OCc1cccc(Cl)c1[N-]c1nnc(C(C)(C)C)s1 ZINC001212774740 1052049322 /nfs/dbraw/zinc/04/93/22/1052049322.db2.gz YRSZDBVFUASTQL-UHFFFAOYSA-N -1 3 339.848 4.296 20 0 EIADHM CCC1(C(=O)Nc2c([O-])cccc2C(C)=O)CCC(F)(F)CC1 ZINC001184650280 1052069911 /nfs/dbraw/zinc/06/99/11/1052069911.db2.gz TVFHEXCDIZZNOE-UHFFFAOYSA-N -1 3 325.355 4.139 20 0 EIADHM O=C(Nc1cncc([O-])c1)c1ccc(-c2ccc(C(F)(F)F)cc2)o1 ZINC001194228808 1052097604 /nfs/dbraw/zinc/09/76/04/1052097604.db2.gz UZXAMODRVUNYAI-UHFFFAOYSA-N -1 3 348.280 4.318 20 0 EIADHM CCN(CC)C(=O)c1cc(Nc2cc(F)c([O-])c(F)c2)ccc1F ZINC001176518231 1052106393 /nfs/dbraw/zinc/10/63/93/1052106393.db2.gz RUFPOFURKNSIIL-UHFFFAOYSA-N -1 3 338.329 4.035 20 0 EIADHM Cc1cc(Br)ccc1NC(=O)Nc1ccc([O-])c(F)c1 ZINC001184817451 1052111553 /nfs/dbraw/zinc/11/15/53/1052111553.db2.gz RDZXYUDEHKGXEL-UHFFFAOYSA-N -1 3 339.164 4.246 20 0 EIADHM O=C(Nc1ccc(F)c(F)c1)Nc1c([O-])cccc1C(F)(F)F ZINC001185098520 1052167934 /nfs/dbraw/zinc/16/79/34/1052167934.db2.gz ZLUZOHWTKLKDCV-UHFFFAOYSA-N -1 3 332.228 4.333 20 0 EIADHM CC(C)Oc1ncccc1Nc1cc(Br)cc(F)c1[O-] ZINC001176737700 1052177343 /nfs/dbraw/zinc/17/73/43/1052177343.db2.gz QJRWKVQEDNJUCH-UHFFFAOYSA-N -1 3 341.180 4.220 20 0 EIADHM Cc1cc(OC(F)F)ccc1[N-]S(=O)(=O)c1c(C)cccc1C ZINC001194634275 1052182013 /nfs/dbraw/zinc/18/20/13/1052182013.db2.gz PLGIWXRQSYYDGB-UHFFFAOYSA-N -1 3 341.379 4.014 20 0 EIADHM Cc1cccc(C)c1S(=O)(=O)[N-]c1c(F)cccc1OC(C)C ZINC001194642689 1052183239 /nfs/dbraw/zinc/18/32/39/1052183239.db2.gz LMLSFOAYUYXWSZ-UHFFFAOYSA-N -1 3 337.416 4.031 20 0 EIADHM CCCOc1cccc(NC(=O)c2cc([O-])cc(C(F)(F)F)c2)c1 ZINC000622305291 1052187830 /nfs/dbraw/zinc/18/78/30/1052187830.db2.gz HOTXLKRFFLRDGY-UHFFFAOYSA-N -1 3 339.313 4.452 20 0 EIADHM CC(C)c1csc(NC(=O)c2cc([O-])cc(C(F)(F)F)c2)n1 ZINC000622324291 1052198688 /nfs/dbraw/zinc/19/86/88/1052198688.db2.gz JZFHRADLMYBOOE-UHFFFAOYSA-N -1 3 330.331 4.243 20 0 EIADHM CCCCC[C@@H](C)[N-]S(=O)(=O)c1ccc(F)cc1C(F)(F)F ZINC001185231786 1052200263 /nfs/dbraw/zinc/20/02/63/1052200263.db2.gz DHOMQQYZJSYHRP-SNVBAGLBSA-N -1 3 341.370 4.092 20 0 EIADHM Cc1cccc(OC(F)F)c1NC(=O)c1cc2c(cc1[O-])CCCC2 ZINC000622341869 1052208562 /nfs/dbraw/zinc/20/85/62/1052208562.db2.gz RXDNMVBVGNPFDP-UHFFFAOYSA-N -1 3 347.361 4.433 20 0 EIADHM O=C([N-]c1cc(-c2cccs2)no1)Nc1ccc(F)c(F)c1F ZINC001185293967 1052212844 /nfs/dbraw/zinc/21/28/44/1052212844.db2.gz FPJCMPNZHFKSFF-UHFFFAOYSA-N -1 3 339.298 4.464 20 0 EIADHM CCCN(CCc1cccc(F)c1)C(=O)c1cccc(CC)c1[O-] ZINC000622371347 1052234714 /nfs/dbraw/zinc/23/47/14/1052234714.db2.gz KMYJJAXEUXRKIJ-UHFFFAOYSA-N -1 3 329.415 4.189 20 0 EIADHM CCC1(CC)CN(C(=O)Cc2ccc([O-])c(F)c2)c2ccccc21 ZINC000622459425 1052275120 /nfs/dbraw/zinc/27/51/20/1052275120.db2.gz WMCVUNJHQOUPIM-UHFFFAOYSA-N -1 3 327.399 4.178 20 0 EIADHM CCc1ccc([O-])c(C(=O)N2CCC[C@@H]2c2ccc(F)cc2C)c1 ZINC000622667781 1052382276 /nfs/dbraw/zinc/38/22/76/1052382276.db2.gz SMNDVVIJHUVWGN-GOSISDBHSA-N -1 3 327.399 4.379 20 0 EIADHM O=S(=O)([N-]c1ccccc1Cl)c1ccc(Cl)cc1Cl ZINC000169505015 1052392234 /nfs/dbraw/zinc/39/22/34/1052392234.db2.gz RPUYROCGHIKUCV-UHFFFAOYSA-N -1 3 336.627 4.448 20 0 EIADHM Cc1ccc([O-])c(C(=O)Nc2cc(Cl)ccc2OC(F)F)c1 ZINC000622733618 1052399098 /nfs/dbraw/zinc/39/90/98/1052399098.db2.gz HDESZVDKVAPMQH-UHFFFAOYSA-N -1 3 327.714 4.208 20 0 EIADHM COc1ccc(N(C)C(=O)c2cc(Cc3ccccc3)ccc2[O-])cc1 ZINC000622739855 1052412360 /nfs/dbraw/zinc/41/23/60/1052412360.db2.gz CLIGFLVWONEPTE-UHFFFAOYSA-N -1 3 347.414 4.268 20 0 EIADHM Cc1c2cccc(F)c2oc1C(=O)[N-]c1cc([N+](=O)[O-])ccc1F ZINC000072603247 1052493847 /nfs/dbraw/zinc/49/38/47/1052493847.db2.gz QGOGITDBTZEKRP-UHFFFAOYSA-N -1 3 332.262 4.180 20 0 EIADHM O=C(Nc1cc(Br)ccc1[O-])c1ccc(F)cc1Cl ZINC000176432141 1052622629 /nfs/dbraw/zinc/62/26/29/1052622629.db2.gz ABJQKXAZXWOBAV-UHFFFAOYSA-N -1 3 344.567 4.200 20 0 EIADHM Cc1cc(=O)[n-]c([C@H](C)N[C@@H](Cc2ccccc2)c2cccs2)n1 ZINC000192777947 1052638335 /nfs/dbraw/zinc/63/83/35/1052638335.db2.gz XMZHGPWPKWZASD-HOCLYGCPSA-N -1 3 339.464 4.187 20 0 EIADHM CC(C)(NC(=O)/C(C#N)=C\c1ccc([O-])cc1)c1cccc(Cl)c1 ZINC000185696484 1052681454 /nfs/dbraw/zinc/68/14/54/1052681454.db2.gz IHFPPAVBUYYLFR-UVTDQMKNSA-N -1 3 340.810 4.004 20 0 EIADHM CC(C)(C)c1ccc(NC(=O)c2[n-]cnc2C(F)(F)F)cc1F ZINC000921504614 1052763616 /nfs/dbraw/zinc/76/36/16/1052763616.db2.gz VDECRCVDUUANEN-UHFFFAOYSA-N -1 3 329.297 4.117 20 0 EIADHM CC(C)(C)c1ccc(NC(=O)c2nc[n-]c2C(F)(F)F)cc1F ZINC000921504614 1052763621 /nfs/dbraw/zinc/76/36/21/1052763621.db2.gz VDECRCVDUUANEN-UHFFFAOYSA-N -1 3 329.297 4.117 20 0 EIADHM CCc1cc(=O)[n-]c(CN[C@@H](c2ccc(Cl)cc2F)C(C)C)n1 ZINC000180263756 1052790895 /nfs/dbraw/zinc/79/08/95/1052790895.db2.gz ACAGRZDEXZYUBQ-QGZVFWFLSA-N -1 3 337.826 4.024 20 0 EIADHM CCCCc1nnc([N-]C(=O)c2ccc(F)c(Cl)c2F)s1 ZINC000181096959 1052875856 /nfs/dbraw/zinc/87/58/56/1052875856.db2.gz LHRMSJMDSRBXDO-UHFFFAOYSA-N -1 3 331.775 4.065 20 0 EIADHM Cc1ccc(C(=O)CC(C)(C)CC(=O)Nc2cccc([O-])c2F)cc1 ZINC000184244774 1052995804 /nfs/dbraw/zinc/99/58/04/1052995804.db2.gz IAYRNUDVBMQYFN-UHFFFAOYSA-N -1 3 343.398 4.468 20 0 EIADHM Cc1nn(-c2cc(C)ccc2C)c(Cl)c1C=Cc1nccc(=O)[n-]1 ZINC000764433176 1053100249 /nfs/dbraw/zinc/10/02/49/1053100249.db2.gz DJZJRVNZUKJEOD-VOTSOKGWSA-N -1 3 340.814 4.117 20 0 EIADHM Cc1cc(F)c([N-]S(=O)(=O)c2cccc(C(C)C)c2)cc1F ZINC001195158629 1053310205 /nfs/dbraw/zinc/31/02/05/1053310205.db2.gz CEZPBVUQTGDXGU-UHFFFAOYSA-N -1 3 325.380 4.197 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])[C@H](O)c1cc(Cl)cc(Cl)c1 ZINC000765198215 1053464056 /nfs/dbraw/zinc/46/40/56/1053464056.db2.gz KOBBEFUTYUZQSI-CYBMUJFWSA-N -1 3 346.597 4.025 20 0 EIADHM COc1ccc(NC(=S)Nc2c([O-])cccc2C(F)(F)F)cc1 ZINC001195709477 1053466291 /nfs/dbraw/zinc/46/62/91/1053466291.db2.gz TXWGIDBMIXYMOE-UHFFFAOYSA-N -1 3 342.342 4.229 20 0 EIADHM Cc1ccc(-c2ccc([N-]S(=O)(=O)c3ccc(O)cc3)cc2)cc1 ZINC001195803042 1053493020 /nfs/dbraw/zinc/49/30/20/1053493020.db2.gz UUVJXGUDXURNTJ-UHFFFAOYSA-N -1 3 339.416 4.168 20 0 EIADHM CCc1ccc2c(c1)[C@H](OC(=O)c1cccc(Cl)c1[O-])CCO2 ZINC001127886249 1053625997 /nfs/dbraw/zinc/62/59/97/1053625997.db2.gz MQMUAYNKGNUZDZ-MRXNPFEDSA-N -1 3 332.783 4.289 20 0 EIADHM O=c1[n-]c(CN2CCC[C@H]2c2ccccc2)nc2c3ccccc3oc21 ZINC000021417316 1053734873 /nfs/dbraw/zinc/73/48/73/1053734873.db2.gz BPELHQHTADCRSC-INIZCTEOSA-N -1 3 345.402 4.419 20 0 EIADHM O=C(Nc1cc([O-])cc(Cl)c1)c1cncc(-c2ccccc2F)c1 ZINC001196867943 1053800208 /nfs/dbraw/zinc/80/02/08/1053800208.db2.gz NEORSBYBUUQCNC-UHFFFAOYSA-N -1 3 342.757 4.499 20 0 EIADHM CC(C)Oc1c(F)ccc(C(=O)Nc2cc([O-])cc(Cl)c2)c1F ZINC001196921517 1053801990 /nfs/dbraw/zinc/80/19/90/1053801990.db2.gz WSDCFHSHAYSPOV-UHFFFAOYSA-N -1 3 341.741 4.363 20 0 EIADHM [O-]c1ccc(NC(=S)Nc2cccc(Br)c2)cc1F ZINC001197001979 1053820195 /nfs/dbraw/zinc/82/01/95/1053820195.db2.gz HNCZZURLTUBBAS-UHFFFAOYSA-N -1 3 341.205 4.103 20 0 EIADHM Cc1nc(-c2ccc(NC(=O)N(CC(C)C)C(C)C)cc2)cc(=O)[n-]1 ZINC000339076514 1053839991 /nfs/dbraw/zinc/83/99/91/1053839991.db2.gz WULNAUKLUCBEKK-UHFFFAOYSA-N -1 3 342.443 4.056 20 0 EIADHM CCCCc1nc(NC(=O)C=CC2CCCCC2)c(C(=O)OCC)[n-]1 ZINC001127967333 1053903251 /nfs/dbraw/zinc/90/32/51/1053903251.db2.gz WNTVNGVDGFWWOL-OUKQBFOZSA-N -1 3 347.459 4.004 20 0 EIADHM C[C@@H](CN(Cc1cc(C(F)(F)F)ccc1Cl)C1CC1)C(=O)[O-] ZINC000901993445 1053923812 /nfs/dbraw/zinc/92/38/12/1053923812.db2.gz UFACUXDDRUXGMT-VIFPVBQESA-N -1 3 335.753 4.044 20 0 EIADHM O=S(=O)(Cc1cccc(Cl)c1Cl)[N-]c1ccccc1F ZINC001197716805 1053970105 /nfs/dbraw/zinc/97/01/05/1053970105.db2.gz TVYONRQLYNNMDC-UHFFFAOYSA-N -1 3 334.199 4.074 20 0 EIADHM CCO[N-]C(=O)CCc1c2cc(F)ccc2[nH]c1-c1ccc(F)cc1 ZINC000017821565 1054030628 /nfs/dbraw/zinc/03/06/28/1054030628.db2.gz VFWHOSHIYBNEFF-UHFFFAOYSA-N -1 3 344.361 4.113 20 0 EIADHM CCN(C(=O)Nc1ccc(-c2cc(=O)[n-]c(C)n2)cc1)[C@H](C)C(C)C ZINC000339104724 1054111934 /nfs/dbraw/zinc/11/19/34/1054111934.db2.gz GPVUTWSURWDQFA-CYBMUJFWSA-N -1 3 342.443 4.056 20 0 EIADHM O=C([O-])CC[C@H](NCc1cccnc1)c1ccc(Cl)c(Cl)c1 ZINC000871065562 1054149642 /nfs/dbraw/zinc/14/96/42/1054149642.db2.gz HWIHIRZELRNJJN-HNNXBMFYSA-N -1 3 339.222 4.084 20 0 EIADHM O=C(c1cc2sccc2c([O-])c1)N1CCC[C@@H](C(F)(F)F)C1 ZINC000871073781 1054151975 /nfs/dbraw/zinc/15/19/75/1054151975.db2.gz KBDAJWNGSGNZCR-SNVBAGLBSA-N -1 3 329.343 4.021 20 0 EIADHM O=C([N-]OCCCC(F)(F)F)C1(Cc2ccccc2Cl)CC1 ZINC000871214699 1054169169 /nfs/dbraw/zinc/16/91/69/1054169169.db2.gz JLIIREHNHYBUIZ-UHFFFAOYSA-N -1 3 335.753 4.053 20 0 EIADHM Cc1cccnc1C[N-]C(=O)C(F)(F)c1cccc(Cl)c1Cl ZINC000857448044 1054247168 /nfs/dbraw/zinc/24/71/68/1054247168.db2.gz RNWVPMGFUJVMBF-UHFFFAOYSA-N -1 3 345.176 4.105 20 0 EIADHM O=C(c1cc([O-])c2ccccc2c1)N(CC1CCC1)CC(F)(F)F ZINC000472240205 1054250460 /nfs/dbraw/zinc/25/04/60/1054250460.db2.gz JYRNJXKVMDKHMN-UHFFFAOYSA-N -1 3 337.341 4.350 20 0 EIADHM Cc1ccn(-c2ccccc2NC(=O)c2cc([O-])c3ccccc3c2)n1 ZINC000472328608 1054287118 /nfs/dbraw/zinc/28/71/18/1054287118.db2.gz RCGMVNFQNHLKPJ-UHFFFAOYSA-N -1 3 343.386 4.292 20 0 EIADHM CCCC(=O)Nc1ccc(CN[C@H](C)c2cccc([O-])c2F)cc1 ZINC000872021934 1054336061 /nfs/dbraw/zinc/33/60/61/1054336061.db2.gz GLVBDWIKHWBUGT-CYBMUJFWSA-N -1 3 330.403 4.121 20 0 EIADHM C[C@H](NCc1ccnc(OC2CCCC2)c1)c1cccc([O-])c1F ZINC000872021952 1054338330 /nfs/dbraw/zinc/33/83/30/1054338330.db2.gz GONHAOBNWSKYMA-ZDUSSCGKSA-N -1 3 330.403 4.099 20 0 EIADHM CCCC(=O)Nc1ccc(CN[C@@H](C)c2cccc([O-])c2F)cc1 ZINC000872021935 1054338967 /nfs/dbraw/zinc/33/89/67/1054338967.db2.gz GLVBDWIKHWBUGT-ZDUSSCGKSA-N -1 3 330.403 4.121 20 0 EIADHM COc1cc(F)c([C@@H](C)N[C@H](C)c2cccc([O-])c2F)cc1OC ZINC000872033352 1054350201 /nfs/dbraw/zinc/35/02/01/1054350201.db2.gz CNMMYDDXZFOSEQ-GHMZBOCLSA-N -1 3 337.366 4.099 20 0 EIADHM CCOc1ccc2c(c1)[C@@H](N[C@H](C)c1cccc([O-])c1F)CCO2 ZINC000872062897 1054372628 /nfs/dbraw/zinc/37/26/28/1054372628.db2.gz LNTGNQMQZCIEEA-WBMJQRKESA-N -1 3 331.387 4.104 20 0 EIADHM Cc1ccc([O-])c(C(=O)Nc2cccc(COCc3ccco3)c2)c1 ZINC000046675930 1054396924 /nfs/dbraw/zinc/39/69/24/1054396924.db2.gz NFATWKLEBZRXBA-UHFFFAOYSA-N -1 3 337.375 4.263 20 0 EIADHM CC(C)c1ncc(CN2CCC(C(=O)c3ccc([O-])cc3)CC2)s1 ZINC000124029425 1054433467 /nfs/dbraw/zinc/43/34/67/1054433467.db2.gz WTYUTOPJAAXMBR-UHFFFAOYSA-N -1 3 344.480 4.067 20 0 EIADHM [O-]c1cc(Br)ccc1NC(=S)NC1CCCCCC1 ZINC001199968247 1054506471 /nfs/dbraw/zinc/50/64/71/1054506471.db2.gz POAZYAPFUCTBMC-UHFFFAOYSA-N -1 3 343.290 4.164 20 0 EIADHM Cc1cccc([O-])c1C(=O)N1CCC(c2cc3ccccc3[nH]2)CC1 ZINC000858852841 1054578282 /nfs/dbraw/zinc/57/82/82/1054578282.db2.gz MOQGAQJHHNBNIB-UHFFFAOYSA-N -1 3 334.419 4.202 20 0 EIADHM COc1cccc([N-]S(=O)(=O)c2c(C)c(C)c(C)c(C)c2C)c1C ZINC001201799871 1054909140 /nfs/dbraw/zinc/90/91/40/1054909140.db2.gz SSYDQOQJGDBVID-UHFFFAOYSA-N -1 3 347.480 4.347 20 0 EIADHM O=C(Nc1cc([O-])cc(Cl)c1)Nc1ccccc1Br ZINC001201978379 1054955061 /nfs/dbraw/zinc/95/50/61/1054955061.db2.gz AMYGYTVAXVDNNI-UHFFFAOYSA-N -1 3 341.592 4.452 20 0 EIADHM O=C(Nc1ccc([O-])c(Br)c1)Nc1ccc(F)cc1F ZINC001202019633 1054982420 /nfs/dbraw/zinc/98/24/20/1054982420.db2.gz CISOOXPXRRQTFM-UHFFFAOYSA-N -1 3 343.127 4.077 20 0 EIADHM COc1cc(CNC(=O)Nc2ccccc2Cl)cc(Cl)c1[O-] ZINC001202072128 1055011593 /nfs/dbraw/zinc/01/15/93/1055011593.db2.gz QLKFTKPZCQDGRW-UHFFFAOYSA-N -1 3 341.194 4.029 20 0 EIADHM CC[C@H](C)[C@@H](NC(=O)c1cc([O-])c2ccccc2c1)C(F)(F)F ZINC000473229205 1055014014 /nfs/dbraw/zinc/01/40/14/1055014014.db2.gz IERJHJZCMZWPLI-ZUZCIYMTSA-N -1 3 325.330 4.252 20 0 EIADHM Cc1c2cc(F)ccc2oc1C(=O)[N-]c1nc(C(C)(C)C)ns1 ZINC000068073695 1055067513 /nfs/dbraw/zinc/06/75/13/1055067513.db2.gz CQIVSPWIOAOHGA-UHFFFAOYSA-N -1 3 333.388 4.282 20 0 EIADHM CN(C(=O)CCCc1ccc([O-])c(F)c1)C(C)(C)c1ccccc1 ZINC000671893445 1055613655 /nfs/dbraw/zinc/61/36/55/1055613655.db2.gz AKPBQBZNPUCEFB-UHFFFAOYSA-N -1 3 329.415 4.248 20 0 EIADHM COc1ccc2oc(C(=O)Nc3cc(Cl)ccc3[O-])c(C)c2c1 ZINC000060636252 1056506199 /nfs/dbraw/zinc/50/61/99/1056506199.db2.gz JKAQKDBCHUADEA-UHFFFAOYSA-N -1 3 331.755 4.361 20 0 EIADHM CCc1csc(CC2CCN([C@@H](C)c3ccc(C(=O)[O-])o3)CC2)n1 ZINC000656191417 1056688949 /nfs/dbraw/zinc/68/89/49/1056688949.db2.gz UMWTWSZHXZCLON-LBPRGKRZSA-N -1 3 348.468 4.012 20 0 EIADHM O=C(Nc1cc(Cl)ccc1[O-])c1ccn(Cc2ccccc2)c1 ZINC000542887935 1056698683 /nfs/dbraw/zinc/69/86/83/1056698683.db2.gz QDWZUFZIKOYXMV-UHFFFAOYSA-N -1 3 326.783 4.148 20 0 EIADHM Cc1cc(=O)[n-]c(-c2cccc(OC(=O)C[C@H]3CCCC[C@@H]3C)c2)n1 ZINC000744219273 1059334803 /nfs/dbraw/zinc/33/48/03/1059334803.db2.gz QJHGRETVJGPPBY-DZGCQCFKSA-N -1 3 340.423 4.279 20 0 EIADHM Cc1cc(=O)[n-]c(-c2cccc(OC(=O)C[C@H]3CCCC[C@H]3C)c2)n1 ZINC000744219275 1059336536 /nfs/dbraw/zinc/33/65/36/1059336536.db2.gz QJHGRETVJGPPBY-UKRRQHHQSA-N -1 3 340.423 4.279 20 0 EIADHM Cc1sc2[n-]c([C@@H](C)OC(=O)[C@H](C)c3ccco3)nc(=O)c2c1C ZINC000745134098 1059737785 /nfs/dbraw/zinc/73/77/85/1059737785.db2.gz ZAYCZDSKALCJKV-NXEZZACHSA-N -1 3 346.408 4.015 20 0 EIADHM C[C@H]1CCC[C@H](OCCCCCC(=O)[N-]OCc2ccccc2)C1 ZINC000766329477 1059821029 /nfs/dbraw/zinc/82/10/29/1059821029.db2.gz MVNKYJJQCWHXQS-HKUYNNGSSA-N -1 3 333.472 4.390 20 0 EIADHM [O-]c1cc(Nc2cnc3ccc(Br)cn23)ccc1Cl ZINC001212589643 1060786155 /nfs/dbraw/zinc/78/61/55/1060786155.db2.gz WWVOAMKVSBEOAR-UHFFFAOYSA-N -1 3 338.592 4.199 20 0 EIADHM Cc1cc(Nc2ccc(Cl)c([O-])c2)n(Cc2cccc(F)c2)n1 ZINC001212590479 1060831990 /nfs/dbraw/zinc/83/19/90/1060831990.db2.gz ODENTNDSWGBGPU-UHFFFAOYSA-N -1 3 331.778 4.482 20 0 EIADHM Cc1c(Br)ccc(N)c1Nc1ccc(Cl)c([O-])c1 ZINC001212592557 1060890875 /nfs/dbraw/zinc/89/08/75/1060890875.db2.gz WGJMQTKLJZTYTE-UHFFFAOYSA-N -1 3 327.609 4.442 20 0 EIADHM COc1cccc(OC)c1-c1ccccc1NCc1ncccc1[O-] ZINC001169732552 1060934887 /nfs/dbraw/zinc/93/48/87/1060934887.db2.gz LHAZAVNDPJTWML-UHFFFAOYSA-N -1 3 336.391 4.084 20 0 EIADHM Cc1cc(C(=O)Nc2ncccc2[O-])sc1-c1ccc(F)cc1 ZINC000072083441 216005053 /nfs/dbraw/zinc/00/50/53/216005053.db2.gz CFKCNNNVILMEPN-UHFFFAOYSA-N -1 3 328.368 4.216 20 0 EIADHM Cc1ccc(S(=O)(=O)[N-]c2ccc(OC(F)(F)F)cc2)c(C)c1 ZINC000007055980 208579513 /nfs/dbraw/zinc/57/95/13/208579513.db2.gz CBJZTMJNSPOXKD-UHFFFAOYSA-N -1 3 345.342 4.003 20 0 EIADHM