smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C=CCSC(=S)[N-]N(C)c1cc(C)nc(NC(=O)[N-]S(=O)(=O)c2ccccc2Cl)n1 ZINC000020353404 555781162 /nfs/dbraw/zinc/78/11/62/555781162.db2.gz SAZMXHMGZQSHFZ-UHFFFAOYSA-N -2 1 487.032 3.298 10 30 JGEEML C=CCSC(=S)[N-]N(C)c1cc(C)nc(NC([O-])=NS(=O)(=O)c2ccccc2Cl)n1 ZINC000020353404 555781166 /nfs/dbraw/zinc/78/11/66/555781166.db2.gz SAZMXHMGZQSHFZ-UHFFFAOYSA-N -2 1 487.032 3.298 10 30 JGEEML