General Information of the Compound
Compound ID
CP0905305
Compound Name
4-((2-(4-chlorophenyl)-6-phenylimidazo[1,2-a]pyridin-3-yl)methyl)-N-(2,6-dimethylphenyl)piperazine-1-carboxamide
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Structure
Formula
C33H32ClN5O
Molecular Weight
550.106
Canonical SMILES
Cc1cccc(C)c1NC(=O)N1CCN(Cc2c(-c3ccc(Cl)cc3)nc3ccc(-c4ccccc4)cn23)CC1
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InChI
InChI=1S/C33H32ClN5O/c1-23-7-6-8-24(2)31(23)36-33(40)38-19-17-37(18-20-38)22-29-32(26-11-14-28(34)15-12-26)35-30-16-13-27(21-39(29)30)25-9-4-3-5-10-25/h3-16,21H,17-20,22H2,1-2H3,(H,36,40)
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InChIKey
PWVFZEVWFRWZNR-UHFFFAOYSA-N
Physicochemical Property
logP
7.28824
Rotatable Bonds
5
Heavy Atom Count
40
Polar Areas
52.88
Hydrogen Bond Donor Count
1
Hydrogen Bond Acceptor Count
4
Complexity
40

"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: 45970468
ChEMBL ID
CHEMBL4291813
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