General Information of the Compound
| Compound ID |
CP0370596
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
3-methyl-2-((6-(2-(5-methyl-2-phenyloxazol-4-yl)ethoxy)pyridin-3-yl)methyl)butanoic acid
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C23H26N2O4
|
||||||||||||||||||
| Molecular Weight |
394.471
|
||||||||||||||||||
| Canonical SMILES |
CC(C)C(Cc1ccc(OCCc2nc(oc2C)-c2ccccc2)nc1)C(O)=O
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C23H26N2O4/c1-15(2)19(23(26)27)13-17-9-10-21(24-14-17)28-12-11-20-16(3)29-22(25-20)18-7-5-4-6-8-18/h4-10,14-15,19H,11-13H2,1-3H3,(H,26,27)
Show/Hide
|
||||||||||||||||||
| InChIKey |
RBRIRIIMEHNOLN-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 | |||||||||||||||||||
| PubChem ID | |||||||||||||||||||
| 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