PDB ligand accession: CV6
DrugBank: DB11712
PubChem:
ChEMBL:
InChI Key: MJUVRTYWUMPBTR-MRXNPFEDSA-N
SMILES: CC(C)(CO)c1cc2cc(c(cc2n1CC(CO)O)F)NC(=O)C3(CC3)c4ccc5c(c4)OC(O5)(F)F
Drug action: positive allosteric modulator
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Indoles and derivatives
- Subclass: N-alkylindoles
- Class: Indoles and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
8EIQ | Download | Experimental | e8eiqA3 | Type II ABC exporter transmembrane domain fold | LigPlot |
7SV7 | Download | Experimental | e7sv7A1 | Type II ABC exporter transmembrane domain fold | LigPlot |