smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CN1CCN(c2ccc(NC(=O)/C(=C/c3ccco3)c3ccccc3)cc2)CC1 ZINC000218108980 536422634 /nfs/dbraw/zinc/42/26/34/536422634.db2.gz BFOCMYFTPUVINR-PTGBLXJZSA-N 0 1 387.483 4.211 40 70 GIIBMN