PDB ligand accession: CR4
DrugBank: DB03643
PubChem:
ChEMBL:
InChI Key: URJKRCBBKTXOHS-UHFFFAOYSA-N
SMILES: c1ccc(c(c1)c2[nH]c3ccc(cc3n2)C(=[NH2+])N)[O-]
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 |
---|---|---|---|---|---|
1O2S | Download | Experimental | e1o2sA1 | cradle loop barrel | LigPlot |