General Information of the Compound
Compound ID
CP0272880
Compound Name
GSK-1292263A
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Synonyms
GSK1292263
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Structure
Formula
C23H28N4O4S
Molecular Weight
456.568
Canonical SMILES
CC(C)c1noc(n1)N1CCC(COc2ccc(nc2)-c2ccc(cc2)S(C)(=O)=O)CC1
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InChI
InChI=1S/C23H28N4O4S/c1-16(2)22-25-23(31-26-22)27-12-10-17(11-13-27)15-30-19-6-9-21(24-14-19)18-4-7-20(8-5-18)32(3,28)29/h4-9,14,16-17H,10-13,15H2,1-3H3
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InChIKey
AYJRTVVIBJSSKN-UHFFFAOYSA-N
CAS
1032823-75-8
Physicochemical Property
logP
3.9539
Rotatable Bonds
7
Heavy Atom Count
32
Polar Areas
98.42
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
8
Complexity
32

"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: 24996872
SID: 56338967
ChEMBL ID
CHEMBL3187503
DrugBank ID
DB12627
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: PT02455, Glucose-dependent insulinotropic receptor
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000026 CHO-K1 Cricetulus griseus (Chinese hamster)  1
1
EC50 = 3.4 nM
   TI
   LI
   LO
   TS
Clinical Information about the Compound
Drug 1 ( GSK1292263 )
Drug Name GSK1292263
Company GSK
Indication
Type-2 diabetes
Phase 2
Gastric adenocarcinoma
Phase 2
Target(s)
Glucose-dependent insulinotropic receptor (GPR119)
Modulator