PDB ligand accession: 22M
DrugBank: DB06918
PubChem:
ChEMBL: n/a
InChI Key: ZRYXDGAKQGRHFG-UHFFFAOYSA-N
SMILES: [H]N=C(c1ccc2cc([nH]c2c1)c3ccccc3C)N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Indoles and derivatives
- Subclass: Indoles
- Class: Indoles and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
2G5V | Download | Experimental | e2g5vA1 | cradle loop barrel | LigPlot |