General Information of the Compound
Compound ID
CP0378887
Compound Name
N-benzoyl-N-(2-phenylimidazo[1,2-a]pyrazin-8-yl)benzamide
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Structure
Formula
C26H18N4O2
Molecular Weight
418.456
Canonical SMILES
O=C(N(C(=O)c1ccccc1)c1nccn2cc(nc12)-c1ccccc1)c1ccccc1
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InChI
InChI=1S/C26H18N4O2/c31-25(20-12-6-2-7-13-20)30(26(32)21-14-8-3-9-15-21)23-24-28-22(18-29(24)17-16-27-23)19-10-4-1-5-11-19/h1-18H
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InChIKey
QXKHLCPMWPHNFR-UHFFFAOYSA-N
Physicochemical Property
logP
4.8835
Rotatable Bonds
4
Heavy Atom Count
32
Polar Areas
67.57
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
5
Complexity
32

"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: 129834701
ChEMBL ID
CHEMBL4070079
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: PT05120, Transmembrane domain-containing protein TMIGD3
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000011 CHO Cricetulus griseus (Chinese hamster)  2
1
IC50 = 187 nM
   TI
   LI
   LO
   TS
2
Ki = 64 nM
   TI
   LI
   LO
   TS