General Information of the Compound
Compound ID
CP0539976
Compound Name
2,2-diphenyl-N-(2-phenylimidazo[1,2-a]pyrazin-8-yl)acetamide
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Structure
Formula
C26H20N4O
Molecular Weight
404.473
Canonical SMILES
O=C(Nc1nccn2cc(nc12)-c1ccccc1)C(c1ccccc1)c1ccccc1
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InChI
InChI=1S/C26H20N4O/c31-26(23(20-12-6-2-7-13-20)21-14-8-3-9-15-21)29-24-25-28-22(18-30(25)17-16-27-24)19-10-4-1-5-11-19/h1-18,23H,(H,27,29,31)
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InChIKey
LAZAYQNLIBNORP-UHFFFAOYSA-N
Physicochemical Property
logP
5.1669
Rotatable Bonds
5
Heavy Atom Count
31
Polar Areas
59.29
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
4
Complexity
31

"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: 137648673
ChEMBL ID
CHEMBL4084789
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)  1
1
Ki = 245 nM
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