| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2008 | 20 | Yes |
Popular Name: (2S)-2-[4-(diethylaminomethyl)-1-piperidyl]-2-(2-thienyl)ethanamine (2S)-2-[4-(diethylaminomethyl)-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) | 2.18 | 6.92 | -86.69 | 4 | 3 | 2 | 35 | 297.512 | 7 | ↓ |
| Hi High (pH 8-9.5) | 2.18 | 5.79 | -34.03 | 3 | 3 | 1 | 34 | 296.504 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.18 | 7.98 | -91.94 | 4 | 3 | 2 | 35 | 297.512 | 7 | ↓ |
