| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 4th, 2009 | 19 | Yes |
Popular Name: 3-[[(4aS,8aS)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl]methyl]benzonitrile 3-[[(4aS,8aS)-3,4,4a,5,6,7,8,8a-…
| 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) | 3.76 | 10.57 | -44.78 | 1 | 2 | 1 | 28 | 255.385 | 2 | ↓ |
