smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name [O-]c1ccc(Cl)cc1/C=N/c1ccccc1[O-] ZINC000002171669 183273995 /nfs/dbraw/zinc/27/39/95/183273995.db2.gz OXAVAFVYFWICKS-OVCLIPMQSA-N -2 3 247.681 3.502 40 30 BHEBHL CCCCCCCCCCCP(=O)([O-])[O-] ZINC000097976221 384583865 /nfs/dbraw/zinc/58/38/65/384583865.db2.gz GKIQHTGBORJXKZ-UHFFFAOYSA-N -2 3 236.292 3.695 40 30 BHEBHL [O-]c1ccccc1/C=N\c1cc(Cl)ccc1[O-] ZINC000104088143 183300744 /nfs/dbraw/zinc/30/07/44/183300744.db2.gz MECAZNFEEJTGNK-NVNXTCNLSA-N -2 3 247.681 3.502 40 30 BHEBHL [O-]c1ccc(Cl)cc1/C=N\c1ccccc1[O-] ZINC000104212038 183272863 /nfs/dbraw/zinc/27/28/63/183272863.db2.gz OXAVAFVYFWICKS-NVNXTCNLSA-N -2 3 247.681 3.502 40 30 BHEBHL