General Information of the Compound
Compound ID
CP0291031
Compound Name
(benzo[b]furan-2-yl)-(1H-indol-2-yl)methanone
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Synonyms
(Benzofuran-2-yl)(1H-indole-2-yl) ketone
(benzo[b]furan-2-yl)-(1H-indol-2-yl)methanone
BDBM50202215
CHEMBL226183
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Structure
Formula
C17H11NO2
Molecular Weight
261.28
Canonical SMILES
O=C(c1cc2ccccc2[nH]1)c1cc2ccccc2o1
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InChI
InChI=1S/C17H11NO2/c19-17(14-9-11-5-1-3-7-13(11)18-14)16-10-12-6-2-4-8-15(12)20-16/h1-10,18H
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InChIKey
NWBGABGOSKEFQJ-UHFFFAOYSA-N
Physicochemical Property
logP
4.1451
Rotatable Bonds
2
Heavy Atom Count
20
Polar Areas
46
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
2
Complexity
20

"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: 44423635
ChEMBL ID
CHEMBL226183
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 = 400 nM
   TI
   LI
   LO
   TS
Clinical Information about the Compound
Drug 1 ( (benzo[b]furan-2-yl)-(1H-indol-2-yl)methanone )
Drug Name (benzo[b]furan-2-yl)-(1H-indol-2-yl)methanone
Target(s)
Fms-like tyrosine kinase 3 (FLT-3)
Inhibitor
Platelet-derived growth factor receptor beta (PDGFRB)
Inhibitor