smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C=C1[C@H](n2ccc(N)nc2=O)O[C@H](CO[P@](=O)([O-])O[P@](=O)([O-])O)[C@H]1O ZINC000013905979 212098222 /nfs/dbraw/zinc/09/82/22/212098222.db2.gz VZVCBQNYRNQQAR-BWVDBABLSA-N -2 1 399.189 -1.134 1 30 GAEFML C=C1[C@H](n2ccc(N)nc2=O)O[C@H](CO[P@](=O)([O-])O[P@@](=O)([O-])O)[C@H]1O ZINC000013905979 212098216 /nfs/dbraw/zinc/09/82/16/212098216.db2.gz VZVCBQNYRNQQAR-BWVDBABLSA-N -2 1 399.189 -1.134 1 30 GAEFML