General Information of the Compound
Compound ID
CP0523244
Compound Name
(5R)-3-((6-(1-cyclohexylethoxy)pyridin-3-yl)methyl)-5-methyloxazolidin-2-one
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Structure
Formula
C18H26N2O3
Molecular Weight
318.417
Canonical SMILES
CC(Oc1ccc(CN2C[C@@H](C)OC2=O)cn1)C1CCCCC1
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InChI
InChI=1S/C18H26N2O3/c1-13-11-20(18(21)22-13)12-15-8-9-17(19-10-15)23-14(2)16-6-4-3-5-7-16/h8-10,13-14,16H,3-7,11-12H2,1-2H3/t13-,14?/m1/s1
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InChIKey
MFRCOQXLJGTTAZ-KWCCSABGSA-N
Physicochemical Property
logP
3.7699
Rotatable Bonds
5
Heavy Atom Count
23
Polar Areas
51.66
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
4
Complexity
23

"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: 44591712
ChEMBL ID
CHEMBL484178
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: PT01748, Metabotropic glutamate receptor 2
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000006 HEK293 Homo sapiens (Human)  1
1
EC50 = 88 nM
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