PDB ligand accession: AU2
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: VTNLFGBARUUNPG-UHFFFAOYSA-O
SMILES: c1ccc(cc1)c2c(cc(cc2Cl)C[NH2+]CCc3[nH]c4ccccc4n3)Cl
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Biphenyls and derivatives
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5OTS | Download | Experimental | e5otsA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |