General Information of the Compound
Compound ID
CP0398027
Compound Name
N-(cyclopropylmethyl)-2-ethyl-7-(2-methoxy-4,6-dimethylphenyl)-N-(2-methoxyethyl)pyrazolo[1,5-a]pyridin-3-amine
    Show/Hide
Structure
Formula
C25H33N3O2
Molecular Weight
407.558
Canonical SMILES
CCc1nn2c(cccc2c1N(CCOC)CC1CC1)-c1c(C)cc(C)cc1OC
    Show/Hide
InChI
InChI=1S/C25H33N3O2/c1-6-20-25(27(12-13-29-4)16-19-10-11-19)22-9-7-8-21(28(22)26-20)24-18(3)14-17(2)15-23(24)30-5/h7-9,14-15,19H,6,10-13,16H2,1-5H3
    Show/Hide
InChIKey
JEDQXMQJEBQCJD-UHFFFAOYSA-N
Physicochemical Property
logP
5.05194
Rotatable Bonds
9
Heavy Atom Count
30
Polar Areas
39
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
5
Complexity
30

"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).

    Show/Hide
Click to Show/Hide the External Link(s) of This Compound
PubChem ID
CID: 21984555
SID: 144086665
ChEMBL ID
CHEMBL2087557
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: PT01588, Corticotropin-releasing factor receptor 1
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000006 HEK293 Homo sapiens (Human)  1
1
IC50 = 41 nM
   TI
   LI
   LO
   TS