General Information of the Compound
Compound ID
CP0431384
Compound Name
4,4-bis(4-fluorophenyl)-2-phenyl-4,5-dihydro-1H-imidazole
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Structure
Formula
C21H16F2N2
Molecular Weight
334.369
Canonical SMILES
Fc1ccc(cc1)C1(CNC(=N1)c1ccccc1)c1ccc(F)cc1
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InChI
InChI=1S/C21H16F2N2/c22-18-10-6-16(7-11-18)21(17-8-12-19(23)13-9-17)14-24-20(25-21)15-4-2-1-3-5-15/h1-13H,14H2,(H,24,25)
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InChIKey
QHLIBNPMZZLGDJ-UHFFFAOYSA-N
Physicochemical Property
logP
4.2584
Rotatable Bonds
3
Heavy Atom Count
25
Polar Areas
24.39
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
2
Complexity
25

"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: 44573407
ChEMBL ID
CHEMBL493971
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: PT01795, Neuropeptide Y receptor type 5
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000440 LM Homo sapiens (Human)  1
1
IC50 = 32 nM
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