PDB ligand accession: TE2
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: KNDSETYOKYYUHZ-OLEWYFQESA-N
SMILES: CC1(c2ccccc2N(C1=CCC3=C(C(=CC=C4C(c5ccccc5N4C)(C)C)CCC3)NCCCCCCNC(=O)CCc6ccc(cc6)S(=O)(=O)N)C)C
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Benzenesulfonamides
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3NJ9 | Download | Experimental | e3nj9A1 | Carbonic anhydrase | LigPlot |