| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 4th, 2009 | 18 | Yes |
Popular Name: [1-[(4aR,8aS)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]cyclohexyl]methanamine [1-[(4aR,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) | 3.30 | 7.18 | -117.77 | 4 | 2 | 2 | 32 | 252.446 | 2 | ↓ |
| Hi High (pH 8-9.5) | 3.30 | 6.82 | -24.81 | 3 | 2 | 1 | 30 | 251.438 | 2 | ↓ |
| Hi High (pH 8-9.5) | 3.30 | 5.33 | -41.65 | 3 | 2 | 1 | 31 | 251.438 | 2 | ↓ |
