General Information of the Compound
Compound ID
CP0944789
Compound Name
N-(2-(4-chlorophenyl)-3-((4-(2-methoxyacetyl)piperazin-1-yl)methyl)imidazo[1,2-a]pyridin-6-yl)methanesulfonamide
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Structure
Formula
C22H26ClN5O4S
Molecular Weight
492.001
Canonical SMILES
COCC(=O)N1CCN(Cc2c(-c3ccc(Cl)cc3)nc3ccc(NS(C)(=O)=O)cn23)CC1
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InChI
InChI=1S/C22H26ClN5O4S/c1-32-15-21(29)27-11-9-26(10-12-27)14-19-22(16-3-5-17(23)6-4-16)24-20-8-7-18(13-28(19)20)25-33(2,30)31/h3-8,13,25H,9-12,14-15H2,1-2H3
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InChIKey
SBAUWUDWDTXQMA-UHFFFAOYSA-N
Physicochemical Property
logP
2.3168
Rotatable Bonds
7
Heavy Atom Count
33
Polar Areas
96.25
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
7
Complexity
33

"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: 121309808
ChEMBL ID
CHEMBL4288836
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