smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name FC(F)c1n[nH]c(SCc2ccc3ccccc3c2)n1 ZINC000216926772 570306895 /nfs/dbraw/zinc/30/68/95/570306895.db2.gz DTJRUXVSVYQRCJ-UHFFFAOYSA-N -1 1 291.326 4.188 40 70 CIIBMM