smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name COc1ccc(-c2c3ccc(O)cc3oc3cc(=O)ccc2-3)c(C)c1 ZINC000034849678 564024461 /nfs/dbraw/zinc/02/44/61/564024461.db2.gz ZJQWKLCFUMLLGQ-UHFFFAOYSA-N 0 2 332.355 4.587 10 5 EJBELN O=[N+]([O-])c1ccc(Oc2ccc(C(F)(F)F)cc2Cl)cc1O ZINC000038614235 213218242 /nfs/dbraw/zinc/21/82/42/213218242.db2.gz WYTRKEWETULQOA-UHFFFAOYSA-N 0 2 333.649 4.765 10 5 EJBELN