General Information of the Compound
Compound ID
CP0909499
Compound Name
(4-((2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl)methyl)piperazin-1-yl)(oxazol-4-yl)methanone
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Structure
Formula
C28H24ClN5O2
Molecular Weight
497.986
Canonical SMILES
O=C(c1cocn1)N1CCN(Cc2c(-c3ccc(Cl)cc3)nc3ccc(-c4ccccc4)cn23)CC1
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InChI
InChI=1S/C28H24ClN5O2/c29-23-9-6-21(7-10-23)27-25(17-32-12-14-33(15-13-32)28(35)24-18-36-19-30-24)34-16-22(8-11-26(34)31-27)20-4-2-1-3-5-20/h1-11,16,18-19H,12-15,17H2
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InChIKey
FZEKMMXTOAGOLW-UHFFFAOYSA-N
Physicochemical Property
logP
5.2677
Rotatable Bonds
5
Heavy Atom Count
36
Polar Areas
66.88
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
6
Complexity
36

"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: 121309778
ChEMBL ID
CHEMBL4290593
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