PDB ligand accession: JE7
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: CYJMENLWUXOKNT-UHFFFAOYSA-N
SMILES: c1cc(c(c(c1)Cl)Cl)Sc2ccc3c(n2)[nH]c(n3)N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organosulfur compounds
- Class: Thioethers
- Subclass: Aryl thioethers
- Class: Thioethers
- Superclass: Organosulfur compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
6MDD | Download | Experimental | e6mddA2 e6mddA3 e6mddB2 e6mddB3 | SH2 Flavodoxin-like SH2 Flavodoxin-like | LigPlot |