General Information of the Compound
Compound ID
CP0373233
Compound Name
3-methyl-1-[6-(2-methyl-4,5-diphenyl-1H-imidazol-1-yl)hexyl]urea
    Show/Hide
Structure
Formula
C24H30N4O
Molecular Weight
390.531
Canonical SMILES
CNC(=O)NCCCCCCn1c(C)nc(c1-c1ccccc1)-c1ccccc1
    Show/Hide
InChI
InChI=1S/C24H30N4O/c1-19-27-22(20-13-7-5-8-14-20)23(21-15-9-6-10-16-21)28(19)18-12-4-3-11-17-26-24(29)25-2/h5-10,13-16H,3-4,11-12,17-18H2,1-2H3,(H2,25,26,29)
    Show/Hide
InChIKey
SKGPLXRCLFUACL-UHFFFAOYSA-N
Physicochemical Property
logP
5.01492
Rotatable Bonds
9
Heavy Atom Count
29
Polar Areas
58.95
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
3
Complexity
29

"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: 25190476
ChEMBL ID
CHEMBL233792
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: PT01099, Fatty-acid amide hydrolase 1
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000008 H4 Homo sapiens (Human)  1
1
IC50 > 10000 nM
   TI
   LI
   LO
   TS