General Information of the Compound
Compound ID
CP0011578
Compound Name
N-tert-butyl-N'-decanoyl-3,5-dimethylbenzohydrazide
    Show/Hide
Structure
Formula
C23H38N2O2
Molecular Weight
374.569
Canonical SMILES
CCCCCCCCCC(=O)NN(C(=O)c1cc(C)cc(C)c1)C(C)(C)C
    Show/Hide
InChI
InChI=1S/C23H38N2O2/c1-7-8-9-10-11-12-13-14-21(26)24-25(23(4,5)6)22(27)20-16-18(2)15-19(3)17-20/h15-17H,7-14H2,1-6H3,(H,24,26)
    Show/Hide
InChIKey
CIXNGAWSWRQOFC-UHFFFAOYSA-N
Physicochemical Property
logP
5.71604
Rotatable Bonds
9
Heavy Atom Count
27
Polar Areas
49.41
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
2
Complexity
27

"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: 11793829
SID: 16907130
ChEMBL ID
CHEMBL2286710
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: PT06098, Ecdysone receptor
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000933 Bm5 Bombyx mori (Silk moth)  1
1
EC50 = 1548.82 nM
   TI
   LI
   LO
   TS