PDB ligand accession: XK0
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: VKHSIJFRPDEMHV-LBPRGKRZSA-N
SMILES: CC1(CCSC(=N1)N)c2ccc(cc2)OC
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Phenol ethers
- Subclass: Anisoles
- Class: Phenol ethers
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4BEK | Download | Experimental | e4bekA2 e4bekA3 | cradle loop barrel cradle loop barrel | LigPlot |