smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cn1cc[n+](C)c1COc1ccc(C=NNC2=NCCCN2)cc1 ZINC000026838691 202149395 /nfs/dbraw/zinc/14/93/95/202149395.db2.gz GKOBARRPMUTLMY-UDWIEESQSA-N 1 3 327.412 0.701 1 30 ECEFHO