| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 7th, 2008 | 29 | Yes |
Popular Name: 2-[(1S)-2-acetyl-1H-isoquinolin-1-yl]-N-(5-benzyl-1,3,4-thiadiazol-2-yl)acetamide 2-[(1S)-2-acetyl-1H-isoquinolin-…
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 2.79 | 12.27 | -25.47 | 1 | 6 | 0 | 75 | 404.495 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.97 | 11.2 | -55.91 | 0 | 6 | -1 | 82 | 403.487 | 5 | ↓ |
