PDB ligand accession: PMD
DrugBank: DB08406
PubChem:
ChEMBL:
InChI Key: NXCCIJQEAKMFGW-UHFFFAOYSA-N
SMILES: c1ccc2c(c1)C=Cc3ccccc3N2Cc4cnc5c(n4)c(nc(n5)N)N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Benzazepines
- Subclass: Dibenzazepines
- Class: Benzazepines
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
1KLK | Download | Experimental | e1klkA1 | Dihydrofolate reductases | LigPlot |