General Information of the Compound
Compound ID
CP0122605
Compound Name
2,3-Dihydroflavone
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Synonyms
(-)-Flavanone
2,3-Dihydro-2-phenyl-4H-1-benzopyran-4-one
2,3-Dihydro-2-phenyl-4H-benzopyran-4-one
2,3-Dihydroflavone
2-Phenyl-2,3-dihydro-4H-chromen-4-one
2-Phenyl-4-chromanone
2-Phenyl-chroman-4-one
2-Phenylchroman-4-one
2-phenyl-2,3-dihydrochromen-4-one
2-phenyl-3,4-dihydro-2H-1-benzopyran-4-one
4-Flavanone
487-26-3
4H-1-Benzopyran-4-one, 2,3-dihydro-2-phenyl-
BRN 0183227
CHEBI:5070
CHEMBL274318
EINECS 207-654-8
FLAVANONE
Flavanone
MFCD00006841
MLS002667384
NSC 50393
NSC-50393
NSC50393
ZONYXWQDUYMKFB-UHFFFAOYSA-N
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Structure
Formula
C15H12O2
Molecular Weight
224.259
Canonical SMILES
O=C1CC(Oc2ccccc12)c1ccccc1
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InChI
InChI=1S/C15H12O2/c16-13-10-15(11-6-2-1-3-7-11)17-14-9-5-4-8-12(13)14/h1-9,15H,10H2
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InChIKey
ZONYXWQDUYMKFB-UHFFFAOYSA-N
CAS
24271-98-5
487-26-3
Physicochemical Property
logP
3.3931
Rotatable Bonds
1
Heavy Atom Count
17
Polar Areas
26.3
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
2
Complexity
17

"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: 10251
SID: 15043641
ChEMBL ID
CHEMBL274318
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: PT01279, Adenosine receptor A3
 Protein Info 
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000006 HEK293
 Cell Line Info 
Homo sapiens (Human)  1
1
Ki = 50100 nM
 Bioactivity Info 
   TI
   LI
   LO
   TS
Protein ID: PT01362, Amine oxidase [flavin-containing] B
 Protein Info 
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000023 BTI-Tn-5B1-4
 Cell Line Info 
Trichoplusia ni (Cabbage looper)  1
1
IC50 = 2870 nM
 Bioactivity Info 
   TI
   LI
   LO
   TS
Protein ID: PT00894, Androgen receptor
 Protein Info 
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000257 MDA-kb2
 Cell Line Info 
Homo sapiens (Human)  1
1
IC50 = 20000 nM
 Bioactivity Info 
   TI
   LI
   LO
   TS
Clinical Information about the Compound
Drug 1 ( Flavanone )
Drug Name Flavanone
Target(s)
Monoamine oxidase type B (MAO-B)
 Target Info 
Inhibitor
Corticosteroid 11-beta-dehydrogenase 1 (HSD11B1)
 Target Info 
Inhibitor