smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C[N+](C)(C)CCCNC(=O)[C@@H](N)Cc1ccc(N(CCCl)CCCl)cc1 ZINC000026253061 717114234 /nfs/dbraw/zinc/11/42/34/717114234.db2.gz KWCGGXMCYJTXJX-SFHVURJKSA-O 1 3 404.406 2.053 1 50 HEGFHO C[N+](C)(C)CCCNC(=O)[C@H](N)Cc1ccc(N(CCCl)CCCl)cc1 ZINC000026253066 717114247 /nfs/dbraw/zinc/11/42/47/717114247.db2.gz KWCGGXMCYJTXJX-GOSISDBHSA-O 1 3 404.406 2.053 1 50 HEGFHO