General Information of the Compound
Compound ID
CP0554803
Compound Name
4-imidazo[1,2-a]pyridin-6-yl-6-(trifluoromethyl)-1H-indazole
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Structure
Formula
C15H9F3N4
Molecular Weight
302.259
Canonical SMILES
FC(F)(F)c1cc(-c2ccc3nccn3c2)c2cn[nH]c2c1
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InChI
InChI=1S/C15H9F3N4/c16-15(17,18)10-5-11(12-7-20-21-13(12)6-10)9-1-2-14-19-3-4-22(14)8-9/h1-8H,(H,20,21)
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InChIKey
NIDNKFIXOVDXKL-UHFFFAOYSA-N
Physicochemical Property
logP
3.8964
Rotatable Bonds
1
Heavy Atom Count
22
Polar Areas
45.98
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
3
Complexity
22

"RO5" indicates the cutoff set by lipinski's rule of five:

(1) Molecular weight less than 500 Dalton;

(2) xlogp less than 5;

(3) No more than 5 hbonddonor (Hydrogen Bond Donor Count);

(4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count);

(5) No more than 10 rotbonds (Rotatable Bond Count).

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PubChem ID
CID: 71735207
ChEMBL ID
CHEMBL3798727
Map of Molecular Bioactivity Related to the Compound
Map of Molecular Bioactivity Related to the Compound

Compound
Cell Line
Protein

Bioactivity Value:

<= 0.1 μM
> 0.1 μM and <= 10 μM
> 10 μM
Imprecise Activity
Table of Molecular Bioactivities Related to the Compound
Protein ID: PT00973, Methionine aminopeptidase 2
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000013 Sf9 Spodoptera frugiperda (Fall armyworm)  1
1
IC50 = 4 nM
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