General Information of the Compound
Compound ID
CP0855323
Compound Name
ethyl 4-((2-(4-chlorophenyl)-6-cyclopropylimidazo[1,2-a]pyrazin-3-yl)methyl)piperazine-1-carboxylate
    Show/Hide
Structure
Formula
C23H26ClN5O2
Molecular Weight
439.947
Canonical SMILES
CCOC(=O)N1CCN(Cc2c(-c3ccc(Cl)cc3)nc3cnc(C4CC4)cn23)CC1
    Show/Hide
InChI
InChI=1S/C23H26ClN5O2/c1-2-31-23(30)28-11-9-27(10-12-28)15-20-22(17-5-7-18(24)8-6-17)26-21-13-25-19(14-29(20)21)16-3-4-16/h5-8,13-14,16H,2-4,9-12,15H2,1H3
    Show/Hide
InChIKey
DZONTVPZBIOYRQ-UHFFFAOYSA-N
Physicochemical Property
logP
4.2012
Rotatable Bonds
5
Heavy Atom Count
31
Polar Areas
62.97
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
6
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: 121309799
ChEMBL ID
CHEMBL4279228
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