smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name O=C([O-])c1cc([P@](=O)([O-])O)[nH]n1 169336182 169356211 /nfs/dbraw/zinc/35/62/11/169356211.db2.gz GFFKGJJZYZDPJN-UHFFFAOYSA-N -2 2 192.067 -1.089 1 0 AAAFLL O=C([O-])c1cc([P@@](=O)([O-])O)[nH]n1 169336182 169356212 /nfs/dbraw/zinc/35/62/12/169356212.db2.gz GFFKGJJZYZDPJN-UHFFFAOYSA-N -2 2 192.067 -1.089 1 0 AAAFLL