PDB ligand accession: 1NN
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: BLYJASYJWHXVPZ-UHFFFAOYSA-N
SMILES: CCc1c(nc(s1)c2ccc(c(c2)OCCF)OC)CSc3nc(cc(n3)N)N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Azoles
- Subclass: Thiazoles
- Class: Azoles
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4JLM | Download | Experimental | e4jlmA1 e4jlmB1 | P-loop domains-like P-loop domains-like | LigPlot |