smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C=CC[N+](CC=C)(CC=C)CCC[N+](CC=C)(CC=C)CC=C ZINC000004706374 181140106 /nfs/dbraw/zinc/14/01/06/181140106.db2.gz NSDGJSQBUBZLBZ-UHFFFAOYSA-N 2 0 316.533 4.126 40 30 DIEBRP Cc1ccccc1NC(CC[NH+]1CCCCC1)=[NH+]C(C)(C)C ZINC000017123082 182076347 /nfs/dbraw/zinc/07/63/47/182076347.db2.gz FFMFQBKLSIBWEN-UHFFFAOYSA-N 2 0 301.478 4.480 40 30 DIEBRP