smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCc1nc2ccc([O-])cc2c(=O)[nH]1 160211117 538041225 /nfs/dbraw/zinc/04/12/25/538041225.db2.gz ZFIYLEPDUSQXSK-UHFFFAOYSA-N -1 3 190.202 1.191 20 70 ADIDHM CCCCCCO[N-]C(C)=O 217568362 573946141 /nfs/dbraw/zinc/94/61/41/573946141.db2.gz ZDUQAJNQCLFMPE-UHFFFAOYSA-N -1 3 159.229 1.634 20 70 ADIDHM