PDB ligand accession: 134
DrugBank: DB06856
PubChem:
ChEMBL: n/a
InChI Key: HUYQYLFFFNSAAX-BUXKBTBVSA-N
SMILES: [H]N=C(c1cc2cc([nH]c2cc1F)c3cccc(c3O)OC4CCCCC4C)N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Indoles and derivatives
- Subclass: Indoles
- Class: Indoles and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
1GJ9 | Download | Experimental | e1gj9.1 | cradle loop barrel | LigPlot |