PDB ligand accession: 7RV
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: XREFXUCWSYMIOG-UHFFFAOYSA-N
SMILES: c1ccc(cc1)N2CCN(CC2)C3(CCOCC3)CNC(=O)c4cccnc4Sc5ccccc5
Drug action: n/a
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 | LigPlot |
---|---|---|---|---|---|
5U1X | Download | Experimental | e5u1xA1 | P2X purinoceptor | LigPlot |