General Information of the Compound
Compound ID
CP0486434
Compound Name
N-cyclopropyl-3-(3,4-dichlorophenyl)pyrazolo[1,5-a]pyridine-2-carboxamide
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Formula
C17H13Cl2N3O
Molecular Weight
346.217
Canonical SMILES
Clc1ccc(cc1Cl)-c1c(nn2ccccc12)C(=O)NC1CC1
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InChI
InChI=1S/C17H13Cl2N3O/c18-12-7-4-10(9-13(12)19)15-14-3-1-2-8-22(14)21-16(15)17(23)20-11-5-6-11/h1-4,7-9,11H,5-6H2,(H,20,23)
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InChIKey
CLHUCTKVMAOAJA-UHFFFAOYSA-N
Physicochemical Property
logP
4.2003
Rotatable Bonds
3
Heavy Atom Count
23
Polar Areas
46.4
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
3
Complexity
23

"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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ChEMBL ID
CHEMBL4752210
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: PT01305, 3',5'-cyclic-AMP phosphodiesterase 4B
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000013 Sf9 Spodoptera frugiperda (Fall armyworm)  1
1
IC50 = 4200 nM
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