smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name COc1ccc(/C=C/C(=O)Nc2ccc3[nH+]c(N4CCOCC4)cc(C)c3c2)cc1 ZINC000003649843 132267715 /nfs/dbraw/zinc/26/77/15/132267715.db2.gz GZXQNWJYYPQVSJ-BJMVGYQFSA-N 1 2 403.482 4.040 1 10 HICFLO