smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCOC(=O)C(=NN=c1[n-]nn[n-]1)C(C)=O ZINC000104131525 170263531 /nfs/dbraw/zinc/26/35/31/170263531.db2.gz CKVZNOVMUMOYLX-RTMNIEFYSA-N -2 0 226.196 -0.196 40 10 BBCBRL CCOC(=O)C(=NN=c1[n-]nn[n-]1)C(C)=O ZINC000104131528 170263049 /nfs/dbraw/zinc/26/30/49/170263049.db2.gz CKVZNOVMUMOYLX-SDUABBNRSA-N -2 0 226.196 -0.196 40 10 BBCBRL CCOC(=O)C(=NN=c1[n-]nn[n-]1)C(C)=O ZINC000104131530 170244863 /nfs/dbraw/zinc/24/48/63/170244863.db2.gz CKVZNOVMUMOYLX-YMWGPOAQSA-N -2 0 226.196 -0.196 40 10 BBCBRL CCOC(=O)C(=NN=c1[n-]nn[n-]1)C(C)=O ZINC000104131533 170244716 /nfs/dbraw/zinc/24/47/16/170244716.db2.gz CKVZNOVMUMOYLX-RSDZFERUSA-N -2 0 226.196 -0.196 40 10 BBCBRL