PDB ligand accession: RCG
DrugBank: DB15495
InChI Key: DAPAQENNNINUPW-IDAMAFBJSA-N
SMILES: CN(C)C(=O)C1C(C2(C(C1O)(c3c(cc(cc3OC)OC)O2)O)c4ccc(cc4)OC)c5ccccc5
Drug action: inhibitor
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Benzofurans
- Subclass: Flavaglines
- Class: Benzofurans
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name |
---|---|---|---|---|
Q99623 | Download | Predicted | Q99623_F1_nD2 | T-fold |
6IQE | Predicted |