General Information of the Compound
Compound ID
CP0893538
Compound Name
(4-((2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl)methyl)piperazin-1-yl)(pyridin-2-yl)methanone
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Structure
Formula
C30H26ClN5O
Molecular Weight
508.025
Canonical SMILES
O=C(c1ccccn1)N1CCN(Cc2c(-c3ccc(Cl)cc3)nc3ccc(-c4ccccc4)cn23)CC1
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InChI
InChI=1S/C30H26ClN5O/c31-25-12-9-23(10-13-25)29-27(36-20-24(11-14-28(36)33-29)22-6-2-1-3-7-22)21-34-16-18-35(19-17-34)30(37)26-8-4-5-15-32-26/h1-15,20H,16-19,21H2
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InChIKey
DPFXONBYMIJXPG-UHFFFAOYSA-N
Physicochemical Property
logP
5.6747
Rotatable Bonds
5
Heavy Atom Count
37
Polar Areas
53.74
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
5
Complexity
37

"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: 121309695
ChEMBL ID
CHEMBL4284712
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: PT04657, Solute carrier family 2, facilitated glucose transporter member 1
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000006 HEK293 Homo sapiens (Human)  1
1
IC50 <= 1000 nM
   TI
   LI
   LO
   TS