| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2010 | 20 | Yes |
Popular Name: 1-[(1R,2S)-2-(ethylamino)cyclooctyl]-N,N-dimethyl-piperidin-4-amine 1-[(1R,2S)-2-(ethylamino)cyclooc…
| 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) | 3.32 | 7.92 | -86.41 | 3 | 3 | 2 | 24 | 283.504 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.32 | 7.37 | -113.28 | 3 | 3 | 2 | 24 | 283.504 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.32 | 6.7 | -30.76 | 2 | 3 | 1 | 20 | 282.496 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.32 | 9.81 | -200.91 | 4 | 3 | 3 | 25 | 284.512 | 4 | ↓ |
