General Information of the Compound
Compound ID
CP0942302
Compound Name
(4-methoxyphenyl)(4-((2-(4-methoxyphenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl)methyl)piperazin-1-yl)methanone
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Structure
Formula
C33H32N4O3
Molecular Weight
532.644
Canonical SMILES
COc1ccc(C(=O)N2CCN(Cc3c(-c4ccc(OC)cc4)nc4ccc(-c5ccccc5)cn34)CC2)cc1
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InChI
InChI=1S/C33H32N4O3/c1-39-28-13-8-25(9-14-28)32-30(37-22-27(12-17-31(37)34-32)24-6-4-3-5-7-24)23-35-18-20-36(21-19-35)33(38)26-10-15-29(40-2)16-11-26/h3-17,22H,18-21,23H2,1-2H3
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InChIKey
UJHJPWWBAIOOKX-UHFFFAOYSA-N
Physicochemical Property
logP
5.6435
Rotatable Bonds
7
Heavy Atom Count
40
Polar Areas
59.31
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
6
Complexity
40

"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: 45970404
ChEMBL ID
CHEMBL4276890
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 <= 1000 nM
   TI
   LI
   LO
   TS