smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name O=C1[N-]N(c2cccc(Cl)c2)C(=O)C1=C1C(=O)[N-]C(=O)NC1=O ZINC000005944222 304679583 /nfs/dbraw/zinc/67/95/83/304679583.db2.gz MXXNBWWLFMOSPO-UHFFFAOYSA-N -2 0 334.675 -0.620 40 10 EBCBRL O=C1[N-]N(c2ccc(Cl)cc2)C(=O)C1=C1C(=O)[N-]C(=O)NC1=O ZINC000005944849 375906590 /nfs/dbraw/zinc/90/65/90/375906590.db2.gz YLWYPFBDIOTGOM-UHFFFAOYSA-N -2 0 334.675 -0.620 40 10 EBCBRL Cc1cn([C@H]2C[C@H](N=[N+]=[N-])[C@@H](COP(=O)([O-])[O-])O2)c(=O)[nH]c1=O ZINC000012503817 211395609 /nfs/dbraw/zinc/39/56/09/211395609.db2.gz OIFWQOKDSPDILA-XLPZGREQSA-N -2 0 347.224 -0.079 40 10 in-vivo EBCBRL