General Information of the Compound
Compound ID
CP0520877
Compound Name
1-[2-methoxy-2-(4-methoxyphenyl)ethyl]-1-methylhydrazine
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Structure
Formula
C11H18N2O2
Molecular Weight
210.277
Canonical SMILES
COC(CN(C)N)c1ccc(OC)cc1
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InChI
InChI=1S/C11H18N2O2/c1-13(12)8-11(15-3)9-4-6-10(14-2)7-5-9/h4-7,11H,8,12H2,1-3H3
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InChIKey
DBSPMHVTUFGFLI-UHFFFAOYSA-N
Physicochemical Property
logP
1.1882
Rotatable Bonds
5
Heavy Atom Count
15
Polar Areas
47.72
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
4
Complexity
15

"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: 21361090
SID: 99435791
ChEMBL ID
CHEMBL1241332
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: PT02562, Membrane primary amine oxidase
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000011 CHO Cricetulus griseus (Chinese hamster)  1
1
IC50 = 416.87 nM
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