PDB ligand accession: V15
DrugBank: n/a
PubChem: 244935;135408658;
ChEMBL:
InChI Key: CNBSPUGFNQVSJS-UHFFFAOYSA-N
SMILES: c1ccc(cc1)CCC2=CC(=O)NC(=N2)N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Diazines
- Subclass: Pyrimidines and pyrimidine derivatives
- Class: Diazines
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
2V00 | Download | Experimental | e2v00A2 e2v00A3 | cradle loop barrel cradle loop barrel | LigPlot |