PDB ligand accession: 99B
DrugBank: DB12981
PubChem: n/a
ChEMBL:
InChI Key: LHGWWAFKVCIILM-HLRQEUIKSA-N
SMILES: CCC(C)Nc1cc(c(cc1C(=O)N)C)C(=O)NC2CC3CCC(C2)N3c4ccc(cn4)C(=O)C5CC5
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Alkaloids and derivatives
- Class: Tropane alkaloids
- Subclass: None
- Class: Tropane alkaloids
- Superclass: Alkaloids and derivatives
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4AWO | Download | Experimental | e4awoA1 e4awoB2 | ATPase domain of HSP90 chaperone/DNA topoisomerase II/histidine kinase-like ATPase domain of HSP90 chaperone/DNA topoisomerase II/histidine kinase-like | LigPlot |