Ligand Id: 114
Ligand name L-775,606

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 1
Rotatable bonds 8
Topological polar surface area 52.98
Molecular weight 432.24
XLogP 4.61
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Summary Biological activity References Structure Similar ligands
Classification
Compound class Synthetic organic
IUPAC Name
3-[3-[4-[2-(3-fluorophenyl)ethyl]piperazin-1-yl]propyl]-5-(1,2,4-triazol-4-yl)-1H-indole
Synonyms
1-(3-(5-(1,2,4-triazol-4-yl)-1H-indol-3-yl)propyl)-4-(2-(3-fluorophenyl)ethyl)piperazine
Database Links
BindingDB Ligand 50060437
ChEBI CHEBI:202087
ChEMBL Ligand 202087
PubChem CID 6426760
Search on ChemSpider ZUTQCPBDRJBADG-UHFFFAOYSA-N
ZINC ZINC22446233

Please note: some links may refer to related isomers. For more details please contact: curators@iuphar-db.org

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