General Information of the Compound
| Compound ID |
CP0525264
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-[2-[(2-cyclopropyl-4-fluorophenoxy)methyl]phenoxy]acetic acid
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C18H17FO4
|
||||||||||||||||||
| Molecular Weight |
316.328
|
||||||||||||||||||
| Canonical SMILES |
OC(=O)COc1ccccc1COc1ccc(F)cc1C1CC1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C18H17FO4/c19-14-7-8-17(15(9-14)12-5-6-12)22-10-13-3-1-2-4-16(13)23-11-18(20)21/h1-4,7-9,12H,5-6,10-11H2,(H,20,21)
Show/Hide
|
||||||||||||||||||
| InChIKey |
FHCFFGDAEJVWLZ-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