|
| ID | Structure | Empirical Formula | Molecular Weight | Monoisotopic Mass, Da | LogP | ACD/LogD (pH 5.5) | ACD/LogD (pH 7.4) |
1710
 |
| C15H12N2O2 | 252.268 | 252.089878 |
|
ACD/LogP: |
2.52
|
|
XLogP: |
2.20
|
|
ALOGPS: |
2.26
|
| 2.52 | 2.49 |
2458
 |
| C15H12N2O2 | 252.268 | 252.089878 |
|
ACD/LogP: |
1.26
|
|
XLogP: |
1.50
|
|
ALOGPS: |
1.58
|
| 1.26 | 1.26 |
13983
 |
| C15H12N2O2 | 252.268 | 252.089878 |
|
ACD/LogP: |
2.33
|
|
ALOGPS: |
3.39
|
| 2.33 | 2.33 |
16604
 |
| C15H12N2O2 | 252.268 | 252.089878 |
|
ACD/LogP: |
1.07
|
|
XLogP: |
1.80
|
|
ALOGPS: |
1.41
|
| 1.07 | 1.07 |
| 29989 |
| C15H12N2O2 | 252.268 | 252.089878 |
|
ACD/LogP: |
2.98
|
|
XLogP: |
1.40
|
| 2.98 | 2.83 |
31608
 |
| C15H12N2O2 | 252.268 | 252.089878 |
|
ACD/LogP: |
1.44
|
|
XLogP: |
1.50
|
|
ALOGPS: |
1.76
|
| 1.44 | 1.44 |
| 39194 |
| C15H12N2O2 | 252.268 | 252.089878 |
|
ACD/LogP: |
1.52
|
|
XLogP: |
3.20
|
| 1.49 | 1.52 |
| 42462 |
| C15H12N2O2 | 252.268 | 252.089878 |
|
ACD/LogP: |
2.58
|
|
XLogP: |
2.60
|
|
ALOGPS: |
2.91
|
| 0.11 | 0.91 |
| 48526 |
| C15H12N2O2 | 252.268 | 252.089878 |
|
ACD/LogP: |
1.08
|
|
XLogP: |
2.00
|
|
ALOGPS: |
1.69
|
| 1.08 | 1.08 |
| 49194 |
| C15H12N2O2 | 252.268 | 252.089878 |
|
ACD/LogP: |
2.50
|
|
XLogP: |
1.50
|
| 1.83 | 2.48 |
| 49432 |
| C15H12N2O2 | 252.268 | 252.089878 |
|
ACD/LogP: |
3.29
|
|
XLogP: |
2.80
|
|
ALOGPS: |
2.64
|
| 1.77 | 0.04 |
| 49803 |
| C15H12N2O2 | 252.268 | 252.089878 |
|
ACD/LogP: |
2.50
|
|
XLogP: |
1.50
|
| 2.43 | 2.5 |
| 57029 |
| C15H12N2O2 | 252.268 | 252.089878 |
|
ACD/LogP: |
1.30
|
|
XLogP: |
2.20
|
| 1.3 | 1.29 |
63242
 |
| C15H12N2O2 | 252.268 | 252.089878 |
|
ACD/LogP: |
4.32
|
|
XLogP: |
4.80
|
|
ALOGPS: |
3.35
|
| 4.32 | 4.32 |
| 67217 |
| C15H12N2O2 | 252.268 | 252.089878 |
|
ACD/LogP: |
4.31
|
|
XLogP: |
4.80
|
| 4.31 | 4.31 |
| 67218 |
| C15H12N2O2 | 252.268 | 252.089878 |
|
ACD/LogP: |
3.88
|
|
XLogP: |
4.80
|
| 3.88 | 3.88 |
83912
 |
| C15H12N2O2 | 252.268 | 252.089878 |
|
ACD/LogP: |
2.08
|
|
XLogP: |
2.00
|
| 2.07 | 1.58 |
| 89004 |
| C15H12N2O2 | 252.268 | 252.089878 |
|
ACD/LogP: |
1.85
|
|
XLogP: |
2.20
|
| 1.83 | 1.85 |
| 89005 |
| C15H12N2O2 | 252.268 | 252.089878 |
|
ACD/LogP: |
1.60
|
|
XLogP: |
1.70
|
| -0.4 | -0.39 |
| 97109 |
| C15H12N2O2 | 252.268 | 252.089878 |
|
ACD/LogP: |
3.16
|
|
XLogP: |
3.70
|
| 3.16 | 3.16 |
|