PDB ligand accession: L2J
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: WGKGADVPRVLHHZ-ZHRMCQFGSA-N
SMILES: c1ccc2c(c1)N(c3ccccc3O2)C4CCCC(C4O)NS(=O)(=O)c5ccc(cc5)OC(F)(F)F
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Benzoxazines
- Subclass: Phenoxazines
- Class: Benzoxazines
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
6NTS | Download | Experimental | e6ntsA1 e6ntsB1 e6ntsC1 | Repetitive alpha hairpins Repetitive alpha hairpins Carbon-nitrogen hydrolase-like | LigPlot |