PDB ligand accession: 8HI
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: ZBCQTJGKEZGMGJ-CLJLJLNGSA-N
SMILES: CC(C)n1c(c(c(c1C(=O)Nc2ccc(cc2)S(=O)(=O)N)c3ccccc3)c4ccc(cc4)F)CCC(CC(CC(=O)O)O)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pyrroles
- Subclass: Substituted pyrroles
- Class: Pyrroles
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3CDA | Download | Experimental | e3cdaA1 e3cdaA2 e3cdaB2 e3cdaA2 e3cdaB1 e3cdaB2 e3cdaC1 e3cdaC2 e3cdaD2 e3cdaC2 e3cdaD1 | Alpha-beta plaits Alpha-beta plaits Alpha-beta plaits Alpha-beta plaits Alpha-beta plaits Alpha-beta plaits Alpha-beta plaits Alpha-beta plaits Alpha-beta plaits Alpha-beta plaits Alpha-beta plaits | LigPlot |