General Information of the Compound
Compound ID
CP0855310
Compound Name
4-((2-(4-chlorophenyl)-6-(1H-tetrazol-5-yl)imidazo[1,2-a]pyridin-3-yl)methyl)morpholine
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Structure
Formula
C19H18ClN7O
Molecular Weight
395.854
Canonical SMILES
Clc1ccc(-c2nc3ccc(-c4nnn[nH]4)cn3c2CN2CCOCC2)cc1
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InChI
InChI=1S/C19H18ClN7O/c20-15-4-1-13(2-5-15)18-16(12-26-7-9-28-10-8-26)27-11-14(3-6-17(27)21-18)19-22-24-25-23-19/h1-6,11H,7-10,12H2,(H,22,23,24,25)
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InChIKey
FHEHTUSEMAIEHZ-UHFFFAOYSA-N
Physicochemical Property
logP
2.667
Rotatable Bonds
4
Heavy Atom Count
28
Polar Areas
84.23
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
7
Complexity
28

"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: 121309729
ChEMBL ID
CHEMBL4285309
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
   TI
   LI
   LO
   TS