General Information of the Compound
Compound ID
CP0379581
Compound Name
1-[1,1',3',1'']Terphenyl-5'-ylmethyl-1H-benzoimidazole
    Show/Hide
Structure
Formula
C26H20N2
Molecular Weight
360.46
Canonical SMILES
C(c1cc(cc(c1)-c1ccccc1)-c1ccccc1)n1cnc2ccccc12
    Show/Hide
InChI
InChI=1S/C26H20N2/c1-3-9-21(10-4-1)23-15-20(16-24(17-23)22-11-5-2-6-12-22)18-28-19-27-25-13-7-8-14-26(25)28/h1-17,19H,18H2
    Show/Hide
InChIKey
XVCDSCFEQRCGGZ-UHFFFAOYSA-N
Physicochemical Property
logP
6.4186
Rotatable Bonds
4
Heavy Atom Count
28
Polar Areas
17.82
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
2
Complexity
28

"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: 53319146
ChEMBL ID
CHEMBL1651504
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: PT03119, Cytochrome P450 11B1, mitochondrial
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000170 V79MZ Cricetulus griseus (Chinese hamster)  1
1
IC50 > 1000 nM
   TI
   LI
   LO
   TS
Protein ID: PT03120, Cytochrome P450 11B2, mitochondrial
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000170 V79MZ Cricetulus griseus (Chinese hamster)  1
1
IC50 > 1000 nM
   TI
   LI
   LO
   TS