smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name O=C([O-])c1ccc(NC=C2C(=O)[N-]C(=O)NC2=O)cc1O ZINC000019597194 351350925 /nfs/dbraw/zinc/35/09/25/351350925.db2.gz WUHCDCKCJILPAY-UHFFFAOYSA-N -2 0 291.219 -0.248 40 10 CBCBRL O=C([O-])c1ccc(C=C2C(=O)[N-]C(=O)NC2=O)o1 ZINC000069593590 304239949 /nfs/dbraw/zinc/23/99/49/304239949.db2.gz VKHFUOVPHZIMCF-UHFFFAOYSA-N -2 0 250.166 -0.273 40 10 CBCBRL CN1C(=O)[N-]C(=O)C(=CNCCCC(=O)[O-])C1=O ZINC000408531538 353927279 /nfs/dbraw/zinc/92/72/79/353927279.db2.gz KRYOCJHYSFTZKQ-AATRIKPKSA-N -2 0 255.230 -0.967 40 10 CBCBRL O=C([O-])c1cc(NC=C2C(=O)[N-]C(=O)NC2=O)ccc1O ZINC000016385543 518201526 /nfs/dbraw/zinc/20/15/26/518201526.db2.gz KDCDFEDHIYVTMM-UHFFFAOYSA-N -2 0 291.219 -0.248 40 10 CBCBRL