General Information of the Compound
Compound ID
CP0482116
Compound Name
2-N-cyclohexyl-4-N-[2-(dimethylamino)ethyl]-6-methylpyrimidine-2,4-diamine
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Structure
Formula
C15H27N5
Molecular Weight
277.416
Canonical SMILES
CN(C)CCNc1cc(C)nc(NC2CCCCC2)n1
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InChI
InChI=1S/C15H27N5/c1-12-11-14(16-9-10-20(2)3)19-15(17-12)18-13-7-5-4-6-8-13/h11,13H,4-10H2,1-3H3,(H2,16,17,18,19)
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InChIKey
MMOXJTHENHXEFL-UHFFFAOYSA-N
Physicochemical Property
logP
2.50312
Rotatable Bonds
6
Heavy Atom Count
20
Polar Areas
53.08
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
5
Complexity
20

"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: 112910508
ChEMBL ID
CHEMBL4064353
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: PT04443, Dynamin-2
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000043 U2OS Homo sapiens (Human)  1
1
IC50 = 65900 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 IC50 = 1800 nM