smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CN(C)Cc1cc(S(=O)(=O)c2csc(S(N)(=O)=O)c2)ccc1[O-] ZINC000013727931 210084478 /nfs/dbraw/zinc/08/44/78/210084478.db2.gz GXPUOVZWZFENNJ-UHFFFAOYSA-N -1 1 376.481 0.996 1 10 GCCFMM CN(C)Cc1cc(S(=O)(=O)c2ccc(S(N)(=O)=O)s2)ccc1[O-] ZINC000001542489 209227509 /nfs/dbraw/zinc/22/75/09/209227509.db2.gz RVWWILHTBSKSKO-UHFFFAOYSA-N -1 1 376.481 0.996 1 10 GCCFMM