| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 19th, 2009 | 19 | Yes |
Popular Name: (3S)-1-[2-(3,4-dimethoxyphenyl)ethyl]piperidin-3-amine (3S)-1-[2-(3,4-dimethoxyphenyl)e…
| 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) | 1.06 | 3.31 | -48.91 | 3 | 4 | 1 | 49 | 265.377 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.06 | 5.6 | -123.99 | 4 | 4 | 2 | 51 | 266.385 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.06 | 5.28 | -44.49 | 3 | 4 | 1 | 49 | 265.377 | 5 | ↓ |
