General Information of the Compound
Compound ID
CP0955090
Compound Name
5-(2-(6-(8-Fluoronaphthalen-2-yl)-2-oxo-1,2-dihydropyridin-3-yl)-3-methylbutyl)-1-methylimidazo-lidine-2,4-dione
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Structure
Formula
C24H24FN3O3
Molecular Weight
421.472
Canonical SMILES
CC(C)C(CC1C(=O)NC(=O)N1C)c1ccc(-c2ccc3cccc(F)c3c2)[nH]c1=O
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InChI
InChI=1S/C24H24FN3O3/c1-13(2)17(12-21-23(30)27-24(31)28(21)3)16-9-10-20(26-22(16)29)15-8-7-14-5-4-6-19(25)18(14)11-15/h4-11,13,17,21H,12H2,1-3H3,(H,26,29)(H,27,30,31)
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InChIKey
JGFOJXYVINHAHZ-UHFFFAOYSA-N
Physicochemical Property
logP
4.0141
Rotatable Bonds
5
Heavy Atom Count
31
Polar Areas
82.27
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
3
Complexity
31

"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: 137478093
ChEMBL ID
CHEMBL4749494
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
IC50 = 65 nM
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