PDB ligand accession: U9Y
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: AMADCPJVPLUGQO-UHFFFAOYSA-N
SMILES: CC1(CCN(CC1)c2cnc3c(n[nH]c3n2)c4cccc(c4Cl)Cl)N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Azoles
- Subclass: Pyrazoles
- Class: Azoles
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
6WU8 | Download | Experimental | e6wu8A1 e6wu8A2 e6wu8A3 e6wu8B1 e6wu8B2 e6wu8B3 | SH2 Flavodoxin-like SH2 SH2 Flavodoxin-like SH2 | LigPlot |