| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 13th, 2008 | 14 | Yes |
Popular Name: (2S)-2-[(3R,5S)-3,5-dimethyl-1-piperidyl]-3-methyl-butan-1-amine (2S)-2-[(3R,5S)-3,5-dimethyl-1-p…
| 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) | 1.88 | 5.9 | -109.32 | 4 | 2 | 2 | 32 | 200.37 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.88 | 5.85 | -29.42 | 3 | 2 | 1 | 30 | 199.362 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.88 | 4.22 | -41.9 | 3 | 2 | 1 | 31 | 199.362 | 3 | ↓ |
