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[nH]1)C(C)=O ZINC000104131525 170263532 /nfs/dbraw/zinc/26/35/32/170263532.db2.gz CKVZNOVMUMOYLX-RTMNIEFYSA-N -1 2 226.196 -0.196 40 10 BBCBLM CCOC(=O)C(=NN=c1[n-]nn[nH]1)C(C)=O ZINC000104131528 170263050 /nfs/dbraw/zinc/26/30/50/170263050.db2.gz CKVZNOVMUMOYLX-SDUABBNRSA-N -1 2 226.196 -0.196 40 10 BBCBLM CCOC(=O)C(=NN=c1[n-]nn[nH]1)C(C)=O ZINC000104131530 170244865 /nfs/dbraw/zinc/24/48/65/170244865.db2.gz CKVZNOVMUMOYLX-YMWGPOAQSA-N -1 2 226.196 -0.196 40 10 BBCBLM CCOC(=O)C(=NN=c1[n-]nn[nH]1)C(C)=O ZINC000104131533 170244717 /nfs/dbraw/zinc/24/47/17/170244717.db2.gz CKVZNOVMUMOYLX-RSDZFERUSA-N -1 2 226.196 -0.196 40 10 BBCBLM