PDB ligand accession: C50
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: ZEXYNHJGHHPEOL-UHFFFAOYSA-N
SMILES: CC1(N=C(N=C(N1OCCCOc2cccc(c2Cl)Cl)N)N)C
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Halobenzenes
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3INV | Download | Experimental | e3invA3 e3invB2 | Dihydrofolate reductases Dihydrofolate reductases | LigPlot |