PDB ligand accession: 7SB
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: IRHUOSKJHRHZKH-UHFFFAOYSA-N
SMILES: c1cc(oc1)c2[nH]nc(n2)NCc3ccc(cc3)Cl
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Benzylamines
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4CL6 | Download | Experimental | e4cl6A1 e4cl6B1 e4cl6C1 e4cl6D1 e4cl6E1 | Thioesterase/thiol ester dehydrase-isomerase-like Thioesterase/thiol ester dehydrase-isomerase-like Thioesterase/thiol ester dehydrase-isomerase-like Thioesterase/thiol ester dehydrase-isomerase-like Thioesterase/thiol ester dehydrase-isomerase-like | LigPlot |