Attributes
UniProt ID
Protein Name
Bile acid receptor
Ligand Name
1-methylethyl 3-[(3,4-difluorophenyl)carbonyl]-1,1-dimethyl-1,2,3,6-tetrahydroazepino[4,5-b]indole-5-carboxylate
DrugBank ID
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
INASOKQDNHHMRE-UHFFFAOYSA-N
SMILES
CC(C)OC(=O)C1=CN(CC(c2c1[nH]c3c2cccc3)(C)C)C(=O)c4ccc(c(c4)F)F
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
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Structure: 3FLI
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Color Legend
Unassigned regionsLigand / hetero atomse3fliA1