PDB ligand accession: HRD
DrugBank: n/a
PubChem: 56947162;135566560;
ChEMBL: n/a
InChI Key: YOTQNVNIJNKFAK-UHFFFAOYSA-N
SMILES: CNc1[nH]c2cc3c(cc2n1)N=C(NC3=O)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 |
---|---|---|---|---|---|
3RR4 | Download | Experimental | e3rr4A1 | TIM beta/alpha-barrel | LigPlot |