smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCOC(=O)Nc1ccc2cc3ccc(NC)c(CO)c3[nH+]c2c1 ZINC000028095680 202165386 /nfs/dbraw/zinc/16/53/86/202165386.db2.gz FPWGOJYFYJHMMB-UHFFFAOYSA-N 1 2 325.368 3.490 1 5 EGBFLO O=[N+]([O-])c1ccc(-c2nn(CNc3cccc[nH+]3)c(=S)o2)cc1 ZINC000103290899 219285235 /nfs/dbraw/zinc/28/52/35/219285235.db2.gz BYEFTLYJWRVGMW-UHFFFAOYSA-N 1 2 329.341 3.245 1 5 EGBFLO