General Information of the Compound
Compound ID
CP0565602
Compound Name
(2R)-2-(6-methoxynaphthalen-2-yl)-N-(4-methylpyridin-2-yl)propanamide
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Structure
Formula
C20H20N2O2
Molecular Weight
320.392
Canonical SMILES
COc1ccc2cc(ccc2c1)[C@@H](C)C(=O)Nc1cc(C)ccn1
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InChI
InChI=1S/C20H20N2O2/c1-13-8-9-21-19(10-13)22-20(23)14(2)15-4-5-17-12-18(24-3)7-6-16(17)11-15/h4-12,14H,1-3H3,(H,21,22,23)/t14-/m1/s1
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InChIKey
QUOGFPPPCZTQAX-CQSZACIVSA-N
Physicochemical Property
logP
4.29402
Rotatable Bonds
4
Heavy Atom Count
24
Polar Areas
51.22
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
3
Complexity
24

"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: 25344969
ChEMBL ID
CHEMBL4748932
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: PT01157, Serine/threonine-protein kinase RIO2
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000006 HEK293 Homo sapiens (Human)  1
1
IC50 = 7600 nM
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