smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CC[NH2+]CCNc1c2ccccc2[nH+]c2ccccc21 ZINC000005807766 170142054 /nfs/dbraw/zinc/14/20/54/170142054.db2.gz CEVLVHXFAQDRLC-UHFFFAOYSA-N 2 0 265.360 3.409 1 10 CGCFRP