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)c1c(NC(=O)[C@@H]2[C@@H]3C=C[C@@H](C3)[C@@]2(C)C(=O)[O-])sc2c1CCCC2 ZINC000005041708 557628598 /nfs/dbraw/zinc/62/85/98/557628598.db2.gz MYCPMISCHRNPFC-HXMIXEEFSA-N -1 0 403.500 3.655 1 10 HHCFRM CCOC(=O)c1c(NC(=O)[C@H]2[C@@H]3C=C[C@@H](C3)[C@@]2(C)C(=O)[O-])sc2c1CCCC2 ZINC000005041709 557628580 /nfs/dbraw/zinc/62/85/80/557628580.db2.gz MYCPMISCHRNPFC-AYJQFZSMSA-N -1 0 403.500 3.655 1 10 HHCFRM