General Information of the Compound
Compound ID
CP0474853
Compound Name
N-[1-(4-methoxyphenyl)propyl]pyrazolo[1,5-a]pyridine-3-carboxamide
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Structure
Formula
C18H19N3O2
Molecular Weight
309.369
Canonical SMILES
CCC(NC(=O)c1cnn2ccccc12)c1ccc(OC)cc1
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InChI
InChI=1S/C18H19N3O2/c1-3-16(13-7-9-14(23-2)10-8-13)20-18(22)15-12-19-21-11-5-4-6-17(15)21/h4-12,16H,3H2,1-2H3,(H,20,22)
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InChIKey
OXDFQPBYBKEJLJ-UHFFFAOYSA-N
Physicochemical Property
logP
3.224
Rotatable Bonds
5
Heavy Atom Count
23
Polar Areas
55.63
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
4
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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PubChem ID
CID: 137633190
ChEMBL ID
CHEMBL4066287
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: PT02047, cGMP-dependent 3',5'-cyclic phosphodiesterase
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000013 Sf9 Spodoptera frugiperda (Fall armyworm)  1
1
IC50 > 100000 nM
   TI
   LI
   LO
   TS