PDB ligand accession: 79Z
DrugBank: DB07238
PubChem:
ChEMBL:
InChI Key: WTDWVLJJJOTABN-UHFFFAOYSA-N
SMILES: CNC(=O)c1c2cc(c(cc2oc1c3ccc(cc3)F)N(CCO)S(=O)(=O)C)C4CC4
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Phenylpropanoids and polyketides
- Class: 2-arylbenzofuran flavonoids
- Subclass: None
- Class: 2-arylbenzofuran flavonoids
- Superclass: Phenylpropanoids and polyketides
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3FQK | Download | Experimental | e3fqkA1 e3fqkA2 e3fqkB1 e3fqkB2 | helical bundle domain in reverse transcriptase-like polymerases Alpha-beta plaits helical bundle domain in reverse transcriptase-like polymerases Alpha-beta plaits | LigPlot |