| ID | Structure | Empirical Formula | Molecular Weight | Monoisotopic Mass, Da | LogP | ACD/LogD (pH 5.5) | ACD/LogD (pH 7.4) |
7016
 |
| C5H10O | 86.1323 | 86.073165 |
|
ACD/LogP: |
0.91
|
|
XLogP: |
0.70
|
|
ALOGPS: |
1.19
|
| 0.91 | 0.91 |
| 10136153 |
| C5H6D4O | 90.1569 | 90.098272 |
|
ACD/LogP: |
0.91
|
|
XLogP: |
0.70
|
| | |