General Information of the Compound
Compound ID
CP0107763
Compound Name
4'-FLUORO-1,1'-BIPHENYL-4-CARBOXYLIC ACID
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Synonyms
1,5-dibenzoyloxybenzene
1ysg
4'-FLUORO-1,1'-BIPHENYL-4-CARBOXYLIC ACID
4'-Fluoro-[1,1'-biphenyl]-4-carboxylic acid
4'-Fluoro-biphenyl-4-carboxylic aci
4'-Fluoro-biphenyl-4-carboxylic acid
4'-fluoro(1,1'-biphenyl)-4-carboxylic acid
4'-fluoro[1,1'-biphenyl]-4-carboxylic acid
4'-fluorobiphenyl-4-carboxylic acid
4-(4-Fluorophenyl)benzoic acid
4-(4-Fluorophenyl)benzoic acid, 97%
4-Biphenyl-4'-fluoro-carboxylic acid
4-Biphenyl-4'-fluoro-carboxylicacid
4FC
5731-10-2
CHEMBL106708
MFCD01631909
PubChem10277
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Structure
Formula
C13H9FO2
Molecular Weight
216.211
Canonical SMILES
OC(=O)c1ccc(cc1)-c1ccc(F)cc1
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InChI
InChI=1S/C13H9FO2/c14-12-7-5-10(6-8-12)9-1-3-11(4-2-9)13(15)16/h1-8H,(H,15,16)
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InChIKey
LXWNTLBMNCXRQN-UHFFFAOYSA-N
Physicochemical Property
logP
3.1909
Rotatable Bonds
2
Heavy Atom Count
16
Polar Areas
37.3
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
1
Complexity
16

"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: 2782689
SID: 15838024
ChEMBL ID
CHEMBL106708
DrugBank ID
DB07108
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: PT01217, Bcl-2-like protein 1
 Protein Info 
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000596 U266B1
 Cell Line Info 
Homo sapiens (Human)  1
1
EC50 > 31500 nM
 Bioactivity Info 
   TI
   LI
   LO
   TS
Biochemical Assays
1 Kd = 300000 nM
Clinical Information about the Compound
Drug 1 ( 4'-FLUORO-1,1'-BIPHENYL-4-CARBOXYLIC ACID )
Drug Name 4'-FLUORO-1,1'-BIPHENYL-4-CARBOXYLIC ACID
Target(s)
Apoptosis regulator Bcl-xL (BCL-xL)
 Target Info 
Inhibitor