General Information of the Compound
Compound ID
CP0945647
Compound Name
N-ethyl-3-(morpholinomethyl)-6-phenylimidazo[1,2-a]pyridine-2-carboxamide
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Structure
Formula
C21H24N4O2
Molecular Weight
364.449
Canonical SMILES
CCNC(=O)c1nc2ccc(-c3ccccc3)cn2c1CN1CCOCC1
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InChI
InChI=1S/C21H24N4O2/c1-2-22-21(26)20-18(15-24-10-12-27-13-11-24)25-14-17(8-9-19(25)23-20)16-6-4-3-5-7-16/h3-9,14H,2,10-13,15H2,1H3,(H,22,26)
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InChIKey
WYUZYYZHYYWOQB-UHFFFAOYSA-N
Physicochemical Property
logP
2.5832
Rotatable Bonds
5
Heavy Atom Count
27
Polar Areas
58.87
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
5
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: 121309639
ChEMBL ID
CHEMBL4285241
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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