General Information of the Compound
Compound ID
CP0032490
Compound Name
2-(4-methoxyphenyl)-6-methyl-3-[(4-methylpyridin-2-yl)methoxy]pyridine
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Structure
Formula
C20H20N2O2
Molecular Weight
320.392
Canonical SMILES
COc1ccc(cc1)-c1nc(C)ccc1OCc1cc(C)ccn1
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InChI
InChI=1S/C20H20N2O2/c1-14-10-11-21-17(12-14)13-24-19-9-4-15(2)22-20(19)16-5-7-18(23-3)8-6-16/h4-12H,13H2,1-3H3
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InChIKey
FMOCTBWTIGZFKK-UHFFFAOYSA-N
Physicochemical Property
logP
4.34804
Rotatable Bonds
5
Heavy Atom Count
24
Polar Areas
44.24
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
4
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: 145981987
ChEMBL ID
CHEMBL4281815
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: PT01441, Tyrosine-protein kinase SYK
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000003 Ramos Homo sapiens (Human)  1
1
IC50 = 10000 nM
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