PDB ligand accession: LRI
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: PDWZXKSZLRVSEH-UHFFFAOYSA-N
SMILES: c1cc(sc1)CN(c2cc(nc(n2)N)Cl)C3CC3
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic nitrogen compounds
- Class: Organonitrogen compounds
- Subclass: Amines
- Class: Organonitrogen compounds
- Superclass: Organic nitrogen compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5IV4 | Download | Experimental | e5iv4A1 e5iv4A2 | Alpha-beta plaits Alpha-beta plaits | LigPlot |
5IV3 | Download | Experimental | e5iv3A1 e5iv3A2 | Alpha-beta plaits Alpha-beta plaits | LigPlot |