smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C[NH+](C)CCC/N=C1\CC(C)(C)Cc2c1c(=O)c1cc(Cl)ccc1n2O ZINC000027097100 207322561 /nfs/dbraw/zinc/32/25/61/207322561.db2.gz ZBIXLUZIDAKTEL-PXLXIMEGSA-N 1 3 375.900 3.605 1 30 GHEFHO