| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 30th, 2010 | 20 | Yes |
Popular Name: (2S)-2-(3,4-dimethoxyphenyl)-2-(4-methyl-1-piperidyl)ethanamine (2S)-2-(3,4-dimethoxyphenyl)-2-(…
| 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) | 1.52 | 6.01 | -127.15 | 4 | 4 | 2 | 51 | 280.412 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.52 | 6.29 | -35.07 | 3 | 4 | 1 | 49 | 279.404 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.52 | 4.12 | -48.68 | 3 | 4 | 1 | 49 | 279.404 | 5 | ↓ |
