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)C/C=C(/Br)[C@H](Br)C[N+](C)(C)C ZINC000001791433 717090098 /nfs/dbraw/zinc/09/00/98/717090098.db2.gz KFHVOPGJUKKXCA-PFEDMVJOSA-N 2 0 344.135 2.441 50 50 EEGARP C[N+](C)(C)C/C=C(/Br)[C@@H](Br)C[N+](C)(C)C ZINC000001791436 717090015 /nfs/dbraw/zinc/09/00/15/717090015.db2.gz KFHVOPGJUKKXCA-HUYFXPKMSA-N 2 0 344.135 2.441 50 50 EEGARP