General Information of the Compound
Compound ID
CP0501497
Compound Name
5-(2-hydroxy-4-naphthalen-2-ylphenyl)-5-methyl-1,3-oxazolidine-2,4-dione
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Structure
Formula
C20H15NO4
Molecular Weight
333.343
Canonical SMILES
CC1(OC(=O)NC1=O)c1ccc(cc1O)-c1ccc2ccccc2c1
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InChI
InChI=1S/C20H15NO4/c1-20(18(23)21-19(24)25-20)16-9-8-15(11-17(16)22)14-7-6-12-4-2-3-5-13(12)10-14/h2-11,22H,1H3,(H,21,23,24)
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InChIKey
BWJWCBNWYFEMOZ-UHFFFAOYSA-N
Physicochemical Property
logP
3.694
Rotatable Bonds
2
Heavy Atom Count
25
Polar Areas
75.63
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
4
Complexity
25

"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: 54583738
ChEMBL ID
CHEMBL1770331
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: PT01367, Prostaglandin E2 receptor EP3 subtype
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000011 CHO Cricetulus griseus (Chinese hamster)  1
1
Ki = 1258.93 nM
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   LI
   LO
   TS