General Information of the Compound
| Compound ID |
CP0966257
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
5-(3-((2-chloro-4-fluorophenoxy)methyl)phenyl)-1H-tetrazole
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C14H10ClFN4O
|
||||||||||||||||||
| Molecular Weight |
304.712
|
||||||||||||||||||
| Canonical SMILES |
Fc1ccc(OCc2cccc(-c3nnn[nH]3)c2)c(Cl)c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C14H10ClFN4O/c15-12-7-11(16)4-5-13(12)21-8-9-2-1-3-10(6-9)14-17-19-20-18-14/h1-7H,8H2,(H,17,18,19,20)
Show/Hide
|
||||||||||||||||||
| InChIKey |
JAKMNMUAZUSPAB-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