PDB ligand accession: 3VM
DrugBank: n/a
PubChem: n/a
ChEMBL:
InChI Key: ABPMTNUZKFZRKL-DYLHXGEVSA-N
SMILES: c1ccc(cc1)CC(c2cc(ccn2)c3ccc4c(c3)n[nH]c4N)NC(=O)C5CCC(CC5)CN
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pyridines and derivatives
- Subclass: Phenylpyridines
- Class: Pyridines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4WXI | Download | Experimental | e4wxiA1 | cradle loop barrel | LigPlot |