smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CC(=O)c1c(O)cc([O-])c(-c2c(C)cc(O)c3c2C(=O)c2cccc(O)c2C3=O)c1O ZINC000005922776 291232552 /nfs/dbraw/zinc/23/25/52/291232552.db2.gz ANEQQIJCYHLALG-UHFFFAOYSA-N -1 0 420.373 3.168 1 10 biogenic,in-vitro HGCFRM