General Information of the Compound
Compound ID
CP0851238
Compound Name
5-hexyl-3-phenyloxazolidin-2-one
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Structure
Formula
C15H21NO2
Molecular Weight
247.338
Canonical SMILES
CCCCCCC1CN(c2ccccc2)C(=O)O1
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InChI
InChI=1S/C15H21NO2/c1-2-3-4-8-11-14-12-16(15(17)18-14)13-9-6-5-7-10-13/h5-7,9-10,14H,2-4,8,11-12H2,1H3
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InChIKey
VSVXANNIGPUQAD-UHFFFAOYSA-N
Physicochemical Property
logP
3.9822
Rotatable Bonds
6
Heavy Atom Count
18
Polar Areas
29.54
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
2
Complexity
18

"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: 44155315
SID: 85155165
ChEMBL ID
CHEMBL1095385
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
CL000011 CHO Cricetulus griseus (Chinese hamster)  1
1
EC50 = 590 nM
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