PDB ligand accession: AZJ
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: NEMHKCNXXRQYRF-UHFFFAOYSA-N
SMILES: CCOC(=O)c1cc(c(nc1C)N2CCC(CC2)C(=O)NS(=O)(=O)Cc3ccccc3)C#N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pyridines and derivatives
- Subclass: Pyridinecarboxylic acids and derivatives
- Class: Pyridines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4NTJ | Download | Experimental | e4ntjA1 e4ntjA2 | Four-helical up-and-down bundle Family A G protein-coupled receptor-like | LigPlot |