General Information of the Compound
Compound ID
CP0371853
Compound Name
5-(4-bromophenyl)-2-(4-(trifluoromethyl)phenyl)-1H-imidazole
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Structure
Formula
C16H10BrF3N2
Molecular Weight
367.168
Canonical SMILES
FC(F)(F)c1ccc(cc1)-c1nc(c[nH]1)-c1ccc(Br)cc1
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InChI
InChI=1S/C16H10BrF3N2/c17-13-7-3-10(4-8-13)14-9-21-15(22-14)11-1-5-12(6-2-11)16(18,19)20/h1-9H,(H,21,22)
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InChIKey
RZFBFYLZQIRIGP-UHFFFAOYSA-N
Physicochemical Property
logP
5.525
Rotatable Bonds
2
Heavy Atom Count
22
Polar Areas
28.68
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
1
Complexity
22

"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: 44447624
ChEMBL ID
CHEMBL398273
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: PT02183, Transient receptor potential cation channel subfamily V member 1
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000006 HEK293 Homo sapiens (Human)  1
1
IC50 = 6000 nM
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