PDB ligand accession: 3MR
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: JKQCQYBXDQPJNC-LJAQVGFWSA-N
SMILES: CN(C1CCCCC1)C(=O)CCC(C2CCCCC2)N3Cc4cc(ccc4N=C3N)Oc5ccccc5
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 |
---|---|---|---|---|---|
2Q15 | Download | Experimental | e2q15A2 e2q15A3 | cradle loop barrel cradle loop barrel | LigPlot |