General Information of the Compound
Compound ID
CP0853945
Compound Name
ethyl 2-(2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl)acetate
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Structure
Formula
C23H19ClN2O2
Molecular Weight
390.87
Canonical SMILES
CCOC(=O)Cc1c(-c2ccc(Cl)cc2)nc2ccc(-c3ccccc3)cn12
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InChI
InChI=1S/C23H19ClN2O2/c1-2-28-22(27)14-20-23(17-8-11-19(24)12-9-17)25-21-13-10-18(15-26(20)21)16-6-4-3-5-7-16/h3-13,15H,2,14H2,1H3
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InChIKey
OFTZWQCGRVQWQR-UHFFFAOYSA-N
Physicochemical Property
logP
5.4273
Rotatable Bonds
5
Heavy Atom Count
28
Polar Areas
43.6
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
4
Complexity
28

"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: 121309845
ChEMBL ID
CHEMBL4277550
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: PT04657, Solute carrier family 2, facilitated glucose transporter member 1
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000006 HEK293 Homo sapiens (Human)  1
1
IC50 > 100000 nM
   TI
   LI
   LO
   TS
Protein ID: PT06319, Solute carrier family 2, facilitated glucose transporter member 2
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000006 HEK293 Homo sapiens (Human)  1
1
IC50 = 10000 nM
   TI
   LI
   LO
   TS