General Information of the Compound
Compound ID
CP0899456
Compound Name
1-((2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl)methyl)piperidine-4-carboxylic acid
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Structure
Formula
C26H24ClN3O2
Molecular Weight
445.95
Canonical SMILES
O=C(O)C1CCN(Cc2c(-c3ccc(Cl)cc3)nc3ccc(-c4ccccc4)cn23)CC1
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InChI
InChI=1S/C26H24ClN3O2/c27-22-9-6-19(7-10-22)25-23(17-29-14-12-20(13-15-29)26(31)32)30-16-21(8-11-24(30)28-25)18-4-2-1-3-5-18/h1-11,16,20H,12-15,17H2,(H,31,32)
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InChIKey
YBQMZYNVNMSYGK-UHFFFAOYSA-N
Physicochemical Property
logP
5.6183
Rotatable Bonds
5
Heavy Atom Count
32
Polar Areas
57.84
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
4
Complexity
32

"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: 121309725
ChEMBL ID
CHEMBL4278673
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 > 100000 nM
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