PDB ligand accession: TQ5
DrugBank: DB01958
PubChem:
ChEMBL:
InChI Key: MNYDVPDMLAJJPB-UHFFFAOYSA-N
SMILES: CC(C)(C)c1ccc(cc1)Sc2cccc3c2c(nc(n3)N)N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Diazanaphthalenes
- Subclass: Benzodiazines
- Class: Diazanaphthalenes
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
1IA3 | Download | Experimental | e1ia3A1 e1ia3B1 | Dihydrofolate reductases Dihydrofolate reductases | LigPlot |