smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CSc1cccc(NCc2cc(Cl)cc(Cl)c2[O-])c1 ZINC000020018910 182179180 /nfs/dbraw/zinc/17/91/80/182179180.db2.gz WOWWNNWUJXPHRF-UHFFFAOYSA-N -1 0 314.237 5.033 20 10 DKCDRM