General Information of the Compound
Compound ID
CP0426945
Compound Name
(S)-2-(4-chlorophenyl)-3-methyl-N-(thiazol-2-yl)butanamide
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Synonyms
AMG 7703
AMG-7703
AMG7703
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Structure
Formula
C14H15ClN2OS
Molecular Weight
294.807
Canonical SMILES
CC(C)[C@H](C(=O)Nc1nccs1)c1ccc(Cl)cc1
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InChI
InChI=1S/C14H15ClN2OS/c1-9(2)12(10-3-5-11(15)6-4-10)13(18)17-14-16-7-8-19-14/h3-9,12H,1-2H3,(H,16,17,18)/t12-/m0/s1
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InChIKey
AZYDQCGCBQYFSE-LBPRGKRZSA-N
Physicochemical Property
logP
4.1748
Rotatable Bonds
4
Heavy Atom Count
19
Polar Areas
41.99
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
3
Complexity
19

"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: 854189
ChEMBL ID
CHEMBL594671
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: PT04096, Free fatty acid receptor 2
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000026 CHO-K1 Cricetulus griseus (Chinese hamster)  1
1
EC50 = 100 nM
   TI
   LI
   LO
   TS
CL000025 HEK-293T Homo sapiens (Human)  1
1
EC50 = 416.87 nM
   TI
   LI
   LO
   TS
CL000011 CHO Cricetulus griseus (Chinese hamster)  1
1
IC50 = 700 nM
   TI
   LI
   LO
   TS
Protein ID: PT06211, Free fatty acid receptor 2
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000026 CHO-K1 Cricetulus griseus (Chinese hamster)  1
1
EC50 = 158.49 nM
   TI
   LI
   LO
   TS
Clinical Information about the Compound
Drug 1 ( AMG7703 )
Drug Name AMG7703
Target(s)
Free fatty acid receptor 2 (FFAR2)
Modulator (allosteric modulator)