BDBM96727 1-(1,3-benzodioxol-5-ylmethyl)-4-[[1-(2-phenylethyl)-1,2,3,4-tetrazol-5-yl]-thiophen-2-yl-methyl]piperazine;hydrochloride::1-(1,3-benzodioxol-5-ylmethyl)-4-[[1-(2-phenylethyl)-5-tetrazolyl]-thiophen-2-ylmethyl]piperazine;hydrochloride::1-(1,3-benzodioxol-5-ylmethyl)-4-[[1-(2-phenylethyl)tetrazol-5-yl]-thiophen-2-ylmethyl]piperazine;hydrochloride::1-Benzo[1,3]dioxol-5-ylmethyl-4-[(1-phenethyl-1H-tetrazol-5-yl)-thiophen-2-yl-methyl]-piperazine::1-[(1-phenethyltetrazol-5-yl)-(2-thienyl)methyl]-4-piperonyl-piperazine;hydrochloride::MLS000881257::SMR000005654::cid_6603028

SMILES Cc1nc(Nc2cc(CCc3ccc(F)c(NC(=O)c4cccc(C(F)(F)F)c4)c3)n[nH]2)cc(N2CCN(CCO)CC2)n1

InChI Key InChIKey=YVSYLHWDHCXCTK-UHFFFAOYSA-N

Data  2 IC50  2 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 96727   

TargetTyrosine-protein kinase Fyn(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 96727BDBM96727(N-(2-fluoro-5-(2-(3-((6-(4-(2-hydroxyethyl)piperaz...)
Affinity DataIC50: 8nMAssay Description:Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Confirmation testing of small molecules identifie...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/11/2026
Entry Details
US Patent

TargetVascular endothelial growth factor receptor 2(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 96727BDBM96727(N-(2-fluoro-5-(2-(3-((6-(4-(2-hydroxyethyl)piperaz...)
Affinity DataIC50: 10nMAssay Description:Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Confirmation testing of small molecules identifie...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/11/2026
Entry Details
US Patent