| ID | Structure | Empirical Formula | Molecular Weight | Monoisotopic Mass, Da | LogP | ACD/LogD (pH 5.5) | ACD/LogD (pH 7.4) |
| 12988 |
| C6H12O | 100.1589 | 100.088815 |
|
ACD/LogP: |
1.76
|
|
XLogP: |
1.70
|
|
ALOGPS: |
1.79
|
| 1.75 | 1.75 |
4476685
 |
| C6H12O | 100.1589 | 100.088815 |
|
ACD/LogP: |
1.76
|
|
XLogP: |
1.70
|
| 1.75 | 1.75 |
4482013
 |
| C6H12O | 100.1589 | 100.088815 |
|
ACD/LogP: |
1.76
|
|
XLogP: |
1.70
|
| 1.75 | 1.75 |