PDB ligand accession: LIH
DrugBank: DB03351
PubChem:
ChEMBL:
InChI Key: KMSATRJZEXNGDP-UHFFFAOYSA-N
SMILES: Cc1c(cnc2c1c(nc(n2)N)N)CNc3cccc4c3cccn4
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Quinolines and derivatives
- Subclass: Aminoquinolines and derivatives
- Class: Quinolines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
1KMS | Download | Experimental | e1kmsA1 | Dihydrofolate reductases | LigPlot |