PDB ligand accession: C64
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: GUHIASUSWSGRHY-UHFFFAOYSA-N
SMILES: c1ccc2c(c1)nc(n2CC(=O)Nc3ccc(cc3)Br)c4nccs4
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Benzimidazoles
- Subclass: None
- Class: Benzimidazoles
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3KHJ | Download | Experimental | e3khjA1 e3khjB1 e3khjC1 e3khjD1 e3khjG1 e3khjH1 | TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel | LigPlot |