smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCCC[C@@H](CC)/C(=N\[O-])c1cc(C)ccc1O ZINC000005420855 342763645 /nfs/dbraw/zinc/76/36/45/342763645.db2.gz KZKCLFCDMYXMQQ-IUDBQGPFSA-N -1 1 249.354 4.095 40 30 BIEBMM CCCC[C@H](CC)/C(=N\[O-])c1cc(C)ccc1O ZINC000005421094 342763664 /nfs/dbraw/zinc/76/36/64/342763664.db2.gz KZKCLFCDMYXMQQ-VVLLMFOMSA-N -1 1 249.354 4.095 40 30 BIEBMM