General Information of the Compound
Compound ID
CP0921334
Compound Name
2-(2-cyclohexylvinyl)-5-o-tolyl-1H-benzo[d]imidazole
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Structure
Formula
C22H24N2
Molecular Weight
316.448
Canonical SMILES
Cc1ccccc1-c1ccc2[nH]c(/C=C/C3CCCCC3)nc2c1
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InChI
InChI=1S/C22H24N2/c1-16-7-5-6-10-19(16)18-12-13-20-21(15-18)24-22(23-20)14-11-17-8-3-2-4-9-17/h5-7,10-15,17H,2-4,8-9H2,1H3,(H,23,24)/b14-11+
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InChIKey
FABSVXGHUICJFX-SDNWHVSQSA-N
Physicochemical Property
logP
6.13182
Rotatable Bonds
3
Heavy Atom Count
24
Polar Areas
28.68
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
1
Complexity
24

"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: 49806083
SID: 103777963
ChEMBL ID
CHEMBL1955986
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: PT00608, Transient receptor potential M8 protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000006 HEK293 Homo sapiens (Human)  1
1
IC50 = 7.1 nM
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