PDB ligand accession: P8H
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: CQERVFFAOOUFEQ-UHFFFAOYSA-N
SMILES: c1c(cncc1Br)C(=O)N2CCC(CC2)N3CCCC3
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 |
---|---|---|---|---|---|
3P8H | Download | Experimental | e3p8hA8 e3p8hB8 e3p8hB8 | SH3 SH3 SH3 | LigPlot |