PDB ligand accession: MSD
DrugBank: DB08212
PubChem: 446310;3000663;
ChEMBL: n/a
InChI Key: FSRLCMRWYUJTNT-UONOGXRCSA-N
SMILES: CC(=O)c1ccc(c(c1O)C2CC2NC(=S)Nc3ccc(cn3)C#N)OC
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic oxygen compounds
- Class: Organooxygen compounds
- Subclass: Carbonyl compounds
- Class: Organooxygen compounds
- Superclass: Organic oxygen compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
1IKY | Download | Experimental | e1ikyA4 e1ikyA2 e1ikyB2 | Ribonuclease H-like Alpha-beta plaits Alpha-beta plaits | LigPlot |