Wizard program output
Daylight HTML/MCL/Merlin interface
pKa
hits 1 to 7 of 7 in hitlist "hits", database "medchem98demo@daylight:thor:http"
| hit |
SMILES |
Name |
pKa1 |
| 1 |
 |
DOPAMINE |
8.87 |
| 2 |
 |
12BENZENEDIOL42METHYLAMINOETHYL |
8.75 |
| 3 |
 |
DOPAMINE6HYDROXY |
8.78 |
| 4 |
 |
34DIMETHOXYPHENETHYLAMINE |
9.75 |
| 5 |
 |
NOREPINEPHRINE |
8.53 |
| 6 |
 |
NMETHYLADRENALONE |
6.91 |
| 7 |
 |
ISOPRENALINE |
8.55 |
Current context
| Object | Description |
|---|
| database | medchem98demo@daylight:thor:http |
| column | $NAM (Name) |
| column | PKA1 (pKa1) |
| column | SIMILARITY (similar) |
| column | $SMI (SMILES) |
| hitlist | hits (pos 270464 / length 7) |
|