smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cn1c(O)c(C=CC=CC=C2C(=O)N(C)C(=O)N(C)C2=O)c(=O)n(C)c1=O ZINC000111892277 210245613 /nfs/dbraw/zinc/24/56/13/210245613.db2.gz ADOYXFANPHNXNV-KQQUZDAGSA-N 0 1 374.353 -0.258 10 10 FBCEMN