PDB ligand accession: XRA
DrugBank: DB00457
InChI Key: IENZQIKPVFGBNW-UHFFFAOYSA-N
SMILES: COc1cc2c(cc1OC)nc(nc2N)N3CCN(CC3)C(=O)c4ccco4
Drug action: antagonist
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Diazinanes
- Subclass: Piperazines
- Class: Diazinanes
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name |
---|---|---|---|---|
P35348 | Download | Predicted | P35348_F1_nD1 | Family A G protein-coupled receptor-like |