General Information of the Compound
| Compound ID |
CP0962222
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
3-((4'-fluorobiphenyl-3-yloxy)methyl)benzoic acid
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C20H15FO3
|
||||||||||||||||||
| Molecular Weight |
322.335
|
||||||||||||||||||
| Canonical SMILES |
O=C(O)c1cccc(COc2cccc(-c3ccc(F)cc3)c2)c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C20H15FO3/c21-18-9-7-15(8-10-18)16-4-2-6-19(12-16)24-13-14-3-1-5-17(11-14)20(22)23/h1-12H,13H2,(H,22,23)
Show/Hide
|
||||||||||||||||||
| InChIKey |
CBKQVOINZWJPNW-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