General Information of the Compound
Compound ID
CP0449325
Compound Name
bisarylimidazole derivative, 4
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Structure
Formula
C24H20N2O3
Molecular Weight
384.435
Canonical SMILES
COC(=O)COc1cccc(c1)-n1cnc(c1-c1ccccc1)-c1ccccc1
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InChI
InChI=1S/C24H20N2O3/c1-28-22(27)16-29-21-14-8-13-20(15-21)26-17-25-23(18-9-4-2-5-10-18)24(26)19-11-6-3-7-12-19/h2-15,17H,16H2,1H3
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InChIKey
RYGSHULDICKKAP-UHFFFAOYSA-N
Physicochemical Property
logP
4.7581
Rotatable Bonds
6
Heavy Atom Count
29
Polar Areas
53.35
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
5
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).

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PubChem ID
CID: 25190466
ChEMBL ID
CHEMBL428372
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 = 6500 nM
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