General Information of the Compound
| Compound ID |
CP0247113
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
1-(5-(4-fluorophenyl)oxazol-2-yl)-7-phenylheptan-1-one
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C22H22FNO2
|
||||||||||||||||||
| Molecular Weight |
351.421
|
||||||||||||||||||
| Canonical SMILES |
Fc1ccc(cc1)-c1cnc(o1)C(=O)CCCCCCc1ccccc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C22H22FNO2/c23-19-14-12-18(13-15-19)21-16-24-22(26-21)20(25)11-7-2-1-4-8-17-9-5-3-6-10-17/h3,5-6,9-10,12-16H,1-2,4,7-8,11H2
Show/Hide
|
||||||||||||||||||
| InChIKey |
TYWVRNPNBJLNRH-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