PDB ligand accession: 655
DrugBank: DB02526
PubChem:
ChEMBL:
InChI Key: WCFWDBPDMBXMTQ-UHFFFAOYSA-N
SMILES: c1cc(c(c(c1)OC2CCCC2)[O-])c3[nH]c4ccc(cc4n3)C(=[NH2+])N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Benzimidazoles
- Subclass: Phenylbenzimidazoles
- Class: Benzimidazoles
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
1O2I | Download | Experimental | e1o2iA1 | cradle loop barrel | LigPlot |