| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 17th, 2010 | 17 | Yes |
Popular Name: (2S)-2-[(4aR,8aS)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]hexan-1-amine (2S)-2-[(4aR,8aS)-3,4,4a,5,6,7,8…
| 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) | 3.25 | 7.3 | -121.82 | 4 | 2 | 2 | 32 | 240.435 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.25 | 5.84 | -41.29 | 3 | 2 | 1 | 31 | 239.427 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.25 | 6.94 | -27.92 | 3 | 2 | 1 | 30 | 239.427 | 5 | ↓ |
