PDB ligand accession: HIC
DrugBank: DB04151
PubChem: 92105;7020397;
ChEMBL:
InChI Key: BRMWTNUJHUMWMS-LURJTMIESA-N
SMILES: Cn1cc(nc1)CC(C(=O)O)N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic acids and derivatives
- Class: Carboxylic acids and derivatives
- Subclass: Amino acids, peptides, and analogues
- Class: Carboxylic acids and derivatives
- Superclass: Organic acids and derivatives
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4Y3J | Download | Experimental | e4y3jA1 e4y3jA2 | cradle loop barrel cradle loop barrel | LigPlot |