PDB ligand accession: 62D
DrugBank: n/a
PubChem: 57383469;135566592;
ChEMBL: n/a
InChI Key: SJNDGKATIKMROA-UHFFFAOYSA-N
SMILES: CCNC1=Nc2cc3c(cc2C(=O)N1)nc([nH]3)NC
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 |
---|---|---|---|---|---|
3TLL | Download | Experimental | e3tllA1 | TIM beta/alpha-barrel | LigPlot |