smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cc1ccc(-c2n[nH]c(=S)n2N=Cc2cc(Cl)ccc2O)cc1 ZINC000004699600 563964817 /nfs/dbraw/zinc/96/48/17/563964817.db2.gz KEJKKPROIVMIRV-GIJQJNRQSA-N -2 1 344.827 4.157 50 30 EIEAML O=C([O-])CCCCCCCCC1=C([O-])C(=O)c2ccccc2C1=O ZINC000018158191 564004111 /nfs/dbraw/zinc/00/41/11/564004111.db2.gz KPVQUBVSFWCUSE-UHFFFAOYSA-N -2 1 330.380 4.083 50 30 EIEAML