| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 17th, 2011 | 16 | Yes |
Popular Name: (2S)-1-(4,4-dimethyl-1-piperidyl)-3-(isopropylamino)propan-2-ol (2S)-1-(4,4-dimethyl-1-piperidyl…
| 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) | 1.72 | 4.49 | -100.59 | 4 | 3 | 2 | 41 | 230.396 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.72 | 5.05 | -38.92 | 3 | 3 | 1 | 44 | 229.388 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.72 | 2.2 | -35.81 | 3 | 3 | 1 | 40 | 229.388 | 5 | ↓ |
