| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 18th, 2009 | 15 | No |
Popular Name: [(3S)-3-[(3R,5R)-3,5-dimethyl-1-piperidyl]tetrahydrothiophen-3-yl]methanamine [(3S)-3-[(3R,5R)-3,5-dimethyl-1-…
| 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) | 1.49 | 4.54 | -46.32 | 3 | 2 | 1 | 31 | 229.413 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.49 | 3.72 | -1.57 | 2 | 2 | 0 | 29 | 228.405 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.49 | 5.86 | -123.28 | 4 | 2 | 2 | 32 | 230.421 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.49 | 5.44 | -28.98 | 3 | 2 | 1 | 30 | 229.413 | 2 | ↓ |
