smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CC[C@H]([N-]S(=O)(=O)c1cn(C)c(=O)n(C)c1=O)c1nccs1 ZINC000159934569 377026958 /nfs/dbraw/zinc/02/69/58/377026958.db2.gz KSOHDDJLNHOOTD-QMMMGPOBSA-N -1 1 344.418 -0.030 20 70 EBIDMM Cc1cccc(CC[N-]S(=O)(=O)c2cn(C)c(=O)n(C)c2=O)c1 ZINC000159750452 377192835 /nfs/dbraw/zinc/19/28/35/377192835.db2.gz FGFGCWKKTMLYMO-UHFFFAOYSA-N -1 1 337.401 -0.087 20 70 EBIDMM CC[C@@H]([N-]S(=O)(=O)c1cn(C)c(=O)n(C)c1=O)c1nccs1 ZINC000159934718 377027197 /nfs/dbraw/zinc/02/71/97/377027197.db2.gz KSOHDDJLNHOOTD-MRVPVSSYSA-N -1 1 344.418 -0.030 20 70 EBIDMM