General Information of the Compound
Compound ID
CP0076368
Compound Name
4-(3-hydroxy-5-phenylphenyl)benzoic acid
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Structure
Formula
C19H14O3
Molecular Weight
290.318
Canonical SMILES
OC(=O)c1ccc(cc1)-c1cc(O)cc(c1)-c1ccccc1
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InChI
InChI=1S/C19H14O3/c20-18-11-16(13-4-2-1-3-5-13)10-17(12-18)14-6-8-15(9-7-14)19(21)22/h1-12,20H,(H,21,22)
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InChIKey
DHKPRBUCYOFAEV-UHFFFAOYSA-N
Physicochemical Property
logP
4.4244
Rotatable Bonds
3
Heavy Atom Count
22
Polar Areas
57.53
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
2
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: 10803426
SID: 15843112
ChEMBL ID
CHEMBL143899
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: PT00922, Epidermal growth factor receptor
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000520 39ER22 Cricetulus griseus (Chinese hamster)  1
1
IC50 = 10000 nM
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