PDB ligand accession: 43K
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: LEFDLEYZSDTVMO-DEOSSOPVSA-N
SMILES: c1cc(c(nc1)F)c2ccc3c(c2)C4(COC(=N4)N)c5cc(ncc5O3)c6ccnc(c6)F
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Benzopyrans
- Subclass: 1-benzopyrans
- Class: Benzopyrans
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4XKX | Download | Experimental | e4xkxA1 e4xkxA2 | cradle loop barrel cradle loop barrel | LigPlot |