PDB ligand accession: 6JX
DrugBank: n/a
PubChem: 126961708;135567183;
ChEMBL: n/a
InChI Key: SKMZNGUSNLOOPQ-UHFFFAOYSA-N
SMILES: CNc1[nH]c2cc3c(cc2n1)C(=O)NC(=N3)NC(=O)OCC=C
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 |
---|---|---|---|---|---|
5JGO | Download | Experimental | e5jgoA1 | TIM beta/alpha-barrel | LigPlot |