| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 4th, 2009 | 20 | Yes |
Popular Name: [1-[(4aS,8aS)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-4-ethyl-cyclohexyl]methanamine [1-[(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) | 3.75 | 8.58 | -117.01 | 4 | 2 | 2 | 32 | 280.5 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.75 | 8.48 | -23.6 | 3 | 2 | 1 | 30 | 279.492 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.75 | 7.65 | -44.83 | 3 | 2 | 1 | 31 | 279.492 | 3 | ↓ |
