General Information of the Compound
Compound ID
CP0166793
Compound Name
2-{7-phenylimidazo[1,2-a]pyridin-3-yl}-1,3-thiazole
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Structure
Formula
C16H11N3S
Molecular Weight
277.352
Canonical SMILES
c1csc(n1)-c1cnc2cc(ccn12)-c1ccccc1
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InChI
InChI=1S/C16H11N3S/c1-2-4-12(5-3-1)13-6-8-19-14(11-18-15(19)10-13)16-17-7-9-20-16/h1-11H
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InChIKey
XZNTVQFNIAJJIP-UHFFFAOYSA-N
Physicochemical Property
logP
4.1248
Rotatable Bonds
2
Heavy Atom Count
20
Polar Areas
30.19
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
4
Complexity
20

"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: 5329344
SID: 15344333
ChEMBL ID
CHEMBL354895
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: PT00864, Vascular endothelial growth factor receptor 2
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000006 HEK293 Homo sapiens (Human)  1
1
IC50 = 42 nM
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