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+])N1CCC[C@H](NC(=O)CN2CCCC[C@]([NH3+])(Cc3ccccc3)C2=O)[C@@H]1O ZINC000026489851 581097237 /nfs/dbraw/zinc/09/72/37/581097237.db2.gz HZXNJMYMOIYCPJ-MDKPJZGXSA-N 2 0 416.526 -0.268 1 0 HBAFRP NC(=[NH2+])N1CCC[C@H](NC(=O)CN2CCCC[C@]([NH3+])(Cc3ccccc3)C2=O)[C@H]1O ZINC000026489857 581097272 /nfs/dbraw/zinc/09/72/72/581097272.db2.gz HZXNJMYMOIYCPJ-CDXJDZJCSA-N 2 0 416.526 -0.268 1 0 HBAFRP NC(=[NH2+])N1CCC[C@H](NC(=O)CN2CCCC[C@@]([NH3+])(Cc3ccccc3)C2=O)[C@@H]1O ZINC000026493770 581097294 /nfs/dbraw/zinc/09/72/94/581097294.db2.gz HZXNJMYMOIYCPJ-DJPFJPOOSA-N 2 0 416.526 -0.268 1 0 HBAFRP NC(=[NH2+])N1CCC[C@H](NC(=O)CN2CCCC[C@@]([NH3+])(Cc3ccccc3)C2=O)[C@H]1O ZINC000026493774 581097301 /nfs/dbraw/zinc/09/73/01/581097301.db2.gz HZXNJMYMOIYCPJ-YRISNDGFSA-N 2 0 416.526 -0.268 1 0 HBAFRP