PDB ligand accession: 3C4
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: IYTUKSIOQKTZEG-UHFFFAOYSA-N
SMILES: c1cc(c(cc1CC(=O)O)Cl)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Phenols
- Subclass: Halophenols
- Class: Phenols
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
2H6B | Download | Experimental | e2h6bA3 e2h6bB1 | jelly-roll jelly-roll | LigPlot |
3E6C | Download | Experimental | e3e6cC1 | jelly-roll | LigPlot |
3E5X | Download | Experimental | e3e5xA1 e3e5xB1 e3e5xC1 e3e5xD1 | jelly-roll jelly-roll jelly-roll jelly-roll | LigPlot |
3E5U | Download | Experimental | e3e5uD1 e3e5uC1 e3e5uA1 e3e5uA1 e3e5uB1 | jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll | LigPlot |
3E6B | Download | Experimental | e3e6bA1 e3e6bB1 | jelly-roll jelly-roll | LigPlot |