General Information of the Compound
Compound ID
CP0471104
Compound Name
3-methyl-1-(2-phenylquinolin-7-yl)imidazo[1,5-a]pyrazin-8-amine
    Show/Hide
Structure
Formula
C22H17N5
Molecular Weight
351.413
Canonical SMILES
Cc1nc(-c2ccc3ccc(nc3c2)-c2ccccc2)c2c(N)nccn12
    Show/Hide
InChI
InChI=1S/C22H17N5/c1-14-25-20(21-22(23)24-11-12-27(14)21)17-8-7-16-9-10-18(26-19(16)13-17)15-5-3-2-4-6-15/h2-13H,1H3,(H2,23,24)
    Show/Hide
InChIKey
BRHYDMYLZDUHRQ-UHFFFAOYSA-N
Physicochemical Property
logP
4.50212
Rotatable Bonds
2
Heavy Atom Count
27
Polar Areas
69.1
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
5
Complexity
27

"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: 11494064
SID: 16595990
ChEMBL ID
CHEMBL260888
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: PT01104, Insulin-like growth factor 1 receptor
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000035 NIH 3T3 Mus musculus (Mouse)  1
1
IC50 = 1040 nM
   TI
   LI
   LO
   TS