PDB ligand accession: ADB
DrugBank: DB07343
PubChem:
ChEMBL:
InChI Key: NFNNMVVXXITVGD-UHFFFAOYSA-N
SMILES: c1cc(c(c(c1)Cl)Oc2nc(nc(n2)Nc3ccc(cc3)C#N)N)Cl
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic oxygen compounds
- Class: Organooxygen compounds
- Subclass: Ethers
- Class: Organooxygen compounds
- Superclass: Organic oxygen compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
1S9E | Download | Experimental | e1s9eA4 e1s9eB2 e1s9eA2 | Ribonuclease H-like Alpha-beta plaits Alpha-beta plaits | LigPlot |