General Information of the Compound
| Compound ID |
CP0514758
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
3-[[6-(2,6-dimethylpyridin-3-yl)oxy-4-methoxy-1-methylbenzimidazol-2-yl]methoxy]benzoic acid
Show/Hide
|
||||||||||||||||||
| Formula |
C24H23N3O5
|
||||||||||||||||||
| Molecular Weight |
433.464
|
||||||||||||||||||
| Canonical SMILES |
COc1cc(Oc2ccc(C)nc2C)cc2n(C)c(COc3cccc(c3)C(O)=O)nc12
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C24H23N3O5/c1-14-8-9-20(15(2)25-14)32-18-11-19-23(21(12-18)30-4)26-22(27(19)3)13-31-17-7-5-6-16(10-17)24(28)29/h5-12H,13H2,1-4H3,(H,28,29)
Show/Hide
|
||||||||||||||||||
| InChIKey |
QPMHENJVTMRJDO-UHFFFAOYSA-N
|
||||||||||||||||||
| Physicochemical Property |
"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 | |||||||||||||||||||
| ChEMBL ID | |||||||||||||||||||
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: PT00910, Peroxisome proliferator-activated receptor alpha
Protein ID: PT00915, Peroxisome proliferator-activated receptor gamma