PDB ligand accession: 2GE
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: PNMYJIOQIAEYQL-UHFFFAOYSA-N
SMILES: c1cc(c(c(c1)Cl)Cl)c2cc(nc(n2)N)NC3CC3
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 |
---|---|---|---|---|---|
5MZG | Download | Experimental | e5mzgA1 e5mzgB1 | beta-Grasp beta-Grasp | LigPlot |
6EHH | Download | Experimental | e6ehhA1 e6ehhB1 e6ehhC1 e6ehhD1 | beta-Grasp beta-Grasp beta-Grasp beta-Grasp | LigPlot |