| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2010 | 19 | Yes |
Popular Name: N,N-dimethyl-1-[(1R,2S)-2-(methylamino)cyclooctyl]piperidin-4-amine N,N-dimethyl-1-[(1R,2S)-2-(methy…
| 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) | 2.95 | 6.55 | -114.01 | 3 | 3 | 2 | 24 | 269.477 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.94 | 5.8 | -30.88 | 2 | 3 | 1 | 20 | 268.469 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.94 | 8.99 | -201.01 | 4 | 3 | 3 | 25 | 270.485 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.94 | 8 | -94.07 | 3 | 3 | 2 | 21 | 269.477 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.95 | 7.09 | -87.46 | 3 | 3 | 2 | 24 | 269.477 | 3 | ↓ |
