General Information of the Compound
Compound ID
CP0909235
Compound Name
1-(4-((2-(4-chlorophenyl)-6-(1,2,4-oxadiazol-3-yl)imidazo[1,2-a]pyridin-3-yl)methyl)piperazin-1-yl)ethanone
    Show/Hide
Structure
Formula
C22H21ClN6O2
Molecular Weight
436.903
Canonical SMILES
CC(=O)N1CCN(Cc2c(-c3ccc(Cl)cc3)nc3ccc(-c4ncon4)cn23)CC1
    Show/Hide
InChI
InChI=1S/C22H21ClN6O2/c1-15(30)28-10-8-27(9-11-28)13-19-21(16-2-5-18(23)6-3-16)25-20-7-4-17(12-29(19)20)22-24-14-31-26-22/h2-7,12,14H,8-11,13H2,1H3
    Show/Hide
InChIKey
NBVYOGMQSKHLLX-UHFFFAOYSA-N
Physicochemical Property
logP
3.3688
Rotatable Bonds
4
Heavy Atom Count
31
Polar Areas
79.77
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
7
Complexity
31

"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).

    Show/Hide
Click to Show/Hide the External Link(s) of This Compound
PubChem ID
CID: 121309815
ChEMBL ID
CHEMBL4286240
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