General Information of the Compound
Compound ID
CP0529065
Compound Name
bis(5-methoxy-1-benzofuran-2-yl)methanone
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Synonyms
Bis(5-methoxybenzo[b]furan-2-yl)methanone
CHEMBL225772
bis(5-methoxybenzo[b]furan-2-yl)methanone
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Structure
Formula
C19H14O5
Molecular Weight
322.316
Canonical SMILES
COc1ccc2oc(cc2c1)C(=O)c1cc2cc(OC)ccc2o1
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InChI
InChI=1S/C19H14O5/c1-21-13-3-5-15-11(7-13)9-17(23-15)19(20)18-10-12-8-14(22-2)4-6-16(12)24-18/h3-10H,1-2H3
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InChIKey
HEAUVWMQZFRPLK-UHFFFAOYSA-N
Physicochemical Property
logP
4.4272
Rotatable Bonds
4
Heavy Atom Count
24
Polar Areas
61.81
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
5
Complexity
24

"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: 13454368
SID: 24714642
ChEMBL ID
CHEMBL225772
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: PT01204, Receptor-type tyrosine-protein kinase FLT3
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000075 EoL-1 Homo sapiens (Human)  1
1
IC50 > 30000 nM
   TI
   LI
   LO
   TS
Clinical Information about the Compound
Drug 1 ( Bis(5-methoxybenzo[b]furan-2-yl)methanone )
Drug Name Bis(5-methoxybenzo[b]furan-2-yl)methanone
Target(s)
Platelet-derived growth factor receptor beta (PDGFRB)
Inhibitor