smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cc1nn(CC(=O)[O-])c(C)c1NS(=O)(=O)c1cccc(C(F)(F)F)c1 ZINC000065395352 205233055 /nfs/dbraw/zinc/23/30/55/205233055.db2.gz LAVRPVZUADOOPZ-UHFFFAOYSA-N -1 2 377.344 2.404 10 0 GEAELM Cc1nn(CC(=O)[O-])c(C)c1NS(=O)(=O)c1ccc(-c2cnco2)cc1 ZINC000055568803 222022810 /nfs/dbraw/zinc/02/28/10/222022810.db2.gz WZYQLALHENFBJF-UHFFFAOYSA-N -1 2 376.394 2.040 10 0 GEAELM