PDB ligand accession: C6U
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: VVZZZUNCWSTIOI-KRWDZBQOSA-N
SMILES: CC1(CCSC(=N1)N)c2cc(ccc2F)NC(=O)c3ccc(cn3)Cl
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Anilides
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
6JSG | Download | Experimental | e6jsgA1 e6jsgA2 | cradle loop barrel cradle loop barrel | LigPlot |