smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name NC(=[NH2+])NCCCCCCNC(=O)[C@H](C(=O)NCCCCNCCC[NH3+])c1ccccc1 ZINC000026734446 563036081 /nfs/dbraw/zinc/03/60/81/563036081.db2.gz ZBBNLKJDWXDHLY-HXUWFJFHSA-N 2 3 447.628 0.555 1 30 ICEFHP NCCC[NH2+]CCCCNC(=O)[C@@H](C(=O)NCCCCCCNC(N)=[NH2+])c1ccccc1 ZINC000026734446 563036079 /nfs/dbraw/zinc/03/60/79/563036079.db2.gz ZBBNLKJDWXDHLY-HXUWFJFHSA-N 2 3 447.628 0.555 1 30 ICEFHP NC(=[NH2+])NCCCCCCNC(=O)[C@@H](C(=O)NCCCCNCCC[NH3+])c1ccccc1 ZINC000026734449 563036017 /nfs/dbraw/zinc/03/60/17/563036017.db2.gz ZBBNLKJDWXDHLY-FQEVSTJZSA-N 2 3 447.628 0.555 1 30 ICEFHP NCCC[NH2+]CCCCNC(=O)[C@H](C(=O)NCCCCCCNC(N)=[NH2+])c1ccccc1 ZINC000026734449 563036016 /nfs/dbraw/zinc/03/60/16/563036016.db2.gz ZBBNLKJDWXDHLY-FQEVSTJZSA-N 2 3 447.628 0.555 1 30 ICEFHP