smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name [O-]c1c(Br)cccc1CNc1cc(Cl)ccc1Cl ZINC000103950154 204091027 /nfs/dbraw/zinc/09/10/27/204091027.db2.gz DMVNNNCKFZEXKX-UHFFFAOYSA-N -1 1 347.039 5.074 10 10 EKCEMM