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CCn1c(=O)c(=Cc2cc(Br)c([O-])c(OC)c2)sc1=C(C#N)C(=O)NCCOC ZINC000436797450 1068931445 /nfs/dbraw/zinc/93/14/45/1068931445.db2.gz NJUMPVYHGLCLAC-UHFFFAOYSA-N -1 3 482.356 0.672 20 30 JCEDHM COc1cc(C=c2sc(=C(C#N)C(=O)NC(C)C)n(C)c2=O)cc(Br)c1[O-] ZINC000436798325 1068099229 /nfs/dbraw/zinc/09/92/29/1068099229.db2.gz SQAQQYKXLDFCFK-UHFFFAOYSA-N -1 3 452.330 0.951 20 30 JCEDHM COc1cc(C=c2sc(=C(C#N)C(=O)NC[C@H]3CCCO3)n(C)c2=O)cc(Br)c1[O-] ZINC000436799734 1068930064 /nfs/dbraw/zinc/93/00/64/1068930064.db2.gz ZGSOQFHDQXOOTN-GFCCVEGCSA-N -1 3 494.367 0.722 20 30 JCEDHM COc1cc(C=c2sc(=C(C#N)C(=O)NC[C@@H]3CCCO3)n(C)c2=O)cc(Br)c1[O-] ZINC000436799735 1068930163 /nfs/dbraw/zinc/93/01/63/1068930163.db2.gz ZGSOQFHDQXOOTN-LBPRGKRZSA-N -1 3 494.367 0.722 20 30 JCEDHM Cc1[n-]c(=O)c(C#N)c(C)c1CCC(=O)NCCS(=O)(=O)N1CCN(c2ccccn2)CC1 ZINC000478671842 1067815242 /nfs/dbraw/zinc/81/52/42/1067815242.db2.gz DPXOHWOHHSFHTD-UHFFFAOYSA-N -1 3 472.571 0.872 20 30 JCEDHM 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C=CCN(C(=O)C[N-]S(=O)(=O)c1ccc(Br)s1)[C@@H]1CCS(=O)(=O)C1 ZINC000504060767 1068477308 /nfs/dbraw/zinc/47/73/08/1068477308.db2.gz PFDNLXDVFKJPKY-SNVBAGLBSA-N -1 3 457.393 0.991 20 30 JCEDHM N#CCCN(CCN1CCOCC1)C(=O)C[N-]S(=O)(=O)c1ccc(Br)s1 ZINC000504577482 1068493800 /nfs/dbraw/zinc/49/38/00/1068493800.db2.gz KQFJTXVZMMOVAE-UHFFFAOYSA-N -1 3 465.395 0.863 20 30 JCEDHM C=CCNC(=O)CN1CCN(C(=O)C[N-]S(=O)(=O)c2ccc(Br)s2)CC1 ZINC000505114433 1068505857 /nfs/dbraw/zinc/50/58/57/1068505857.db2.gz PULGQZAYNRHBNU-UHFFFAOYSA-N -1 3 465.395 0.235 20 30 JCEDHM C=CCNC(=O)CN1CCN(S(=O)(=O)c2ccc(S(=O)(=O)[N-]CC(F)(F)F)cc2)CC1 ZINC000507495814 1069388912 /nfs/dbraw/zinc/38/89/12/1069388912.db2.gz CYPXHMQGPYAIFC-UHFFFAOYSA-N -1 3 484.522 0.136 20 30 JCEDHM C=CCN([C@@H]1CCS(=O)(=O)C1)S(=O)(=O)c1ccc(S(=O)(=O)[N-]CC(F)(F)F)cc1 ZINC000509791615 1068165926 /nfs/dbraw/zinc/16/59/26/1068165926.db2.gz CADUQTFCDLYNBU-GFCCVEGCSA-N -1 3 476.520 0.891 20 30 JCEDHM 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