General Information of the Compound
Compound ID
CP0395738
Compound Name
4-methoxy-2-(4-methoxypyridin-2-yl)pyridine
    Show/Hide
Structure
Formula
C12H12N2O2
Molecular Weight
216.24
Canonical SMILES
COc1ccnc(c1)-c1cc(OC)ccn1
    Show/Hide
InChI
InChI=1S/C12H12N2O2/c1-15-9-3-5-13-11(7-9)12-8-10(16-2)4-6-14-12/h3-8H,1-2H3
    Show/Hide
InChIKey
IMEVSAIFJKKDAP-UHFFFAOYSA-N
CAS
17217-57-1
Physicochemical Property
logP
2.1608
Rotatable Bonds
3
Heavy Atom Count
16
Polar Areas
44.24
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
4
Complexity
16

"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).

    Show/Hide
Click to Show/Hide the External Link(s) of This Compound
PubChem ID
CID: 2733927
SID: 46492206
ChEMBL ID
CHEMBL2205808
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: PT01070, C-C chemokine receptor type 1
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000053 COS-7 Chlorocebus aethiops (Green monkey)  1
1
EC50 = 10000 nM
   TI
   LI
   LO
   TS