smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name O=S(=O)([N-]c1ccc2ccc3cccc4ccc1c2c34)c1ccccc1 ZINC000001573337 570502066 /nfs/dbraw/zinc/50/20/66/570502066.db2.gz HYVGZKMKDJGPNL-UHFFFAOYSA-N -1 1 357.434 5.385 40 5 FKBBMM