General Information of the Compound
| Compound ID |
CP0475564
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-[2-fluoro-4-[[3-(2-propan-2-ylphenyl)phenyl]methylamino]phenoxy]acetic acid
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C24H24FNO3
|
||||||||||||||||||
| Molecular Weight |
393.458
|
||||||||||||||||||
| Canonical SMILES |
CC(C)c1ccccc1-c1cccc(CNc2ccc(OCC(O)=O)c(F)c2)c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C24H24FNO3/c1-16(2)20-8-3-4-9-21(20)18-7-5-6-17(12-18)14-26-19-10-11-23(22(25)13-19)29-15-24(27)28/h3-13,16,26H,14-15H2,1-2H3,(H,27,28)
Show/Hide
|
||||||||||||||||||
| InChIKey |
KCYBHBTWSJWMEB-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