smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C[C@@H](NC(=O)NCc1ccc([O-])c(F)c1)c1nc(-c2ccccc2)cs1 ZINC000159372086 568216250 /nfs/dbraw/zinc/21/62/50/568216250.db2.gz SWPVARLOAISYMY-GFCCVEGCSA-N -1 3 371.437 4.215 20 70 FIIDHM C[C@H](NC(=O)NCc1ccc([O-])c(F)c1)c1nc(-c2ccccc2)cs1 ZINC000159371964 568216262 /nfs/dbraw/zinc/21/62/62/568216262.db2.gz SWPVARLOAISYMY-LBPRGKRZSA-N -1 3 371.437 4.215 20 70 FIIDHM CSc1ccc(C)c(C(=O)Nc2ccc(-c3nc(C)cc(=O)[n-]3)cc2)c1 ZINC000161184536 567880346 /nfs/dbraw/zinc/88/03/46/567880346.db2.gz YAOGZGHJZQHHQN-UHFFFAOYSA-N -1 3 365.458 4.028 20 70 FIIDHM