General Information of the Compound
Compound ID
CP0021123
Compound Name
(1H-indol-2-yl)(5-phenoxy-1H-indol-2-yl)methanone
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Synonyms
(1H-indol-2-yl)(5-phenoxy-1H-indol-2-yl)methanone
CHEMBL210425
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Structure
Formula
C23H16N2O2
Molecular Weight
352.393
Canonical SMILES
O=C(c1cc2ccccc2[nH]1)c1cc2cc(Oc3ccccc3)ccc2[nH]1
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InChI
InChI=1S/C23H16N2O2/c26-23(21-13-15-6-4-5-9-19(15)24-21)22-14-16-12-18(10-11-20(16)25-22)27-17-7-2-1-3-8-17/h1-14,24-25H
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InChIKey
XSKBJPGCRXDUEV-UHFFFAOYSA-N
Physicochemical Property
logP
5.6725
Rotatable Bonds
4
Heavy Atom Count
27
Polar Areas
57.88
Hydrogen Bond Donor Count
2
Hydrogen Bond Acceptor Count
2
Complexity
27

"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: 44411967
ChEMBL ID
CHEMBL210425
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 = 10000 nM
   TI
   LI
   LO
   TS
Clinical Information about the Compound
Drug 1 ( (1H-indol-2-yl)(5-phenoxy-1H-indol-2-yl)methanone )
Drug Name (1H-indol-2-yl)(5-phenoxy-1H-indol-2-yl)methanone
Target(s)
Platelet-derived growth factor receptor beta (PDGFRB)
Inhibitor
Fms-like tyrosine kinase 3 (FLT-3)
Inhibitor
Platelet-derived growth factor receptor alpha (PDGFRA)
Inhibitor