| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 10th, 2010 | 20 | Yes |
Popular Name: 2-[(2R)-1-[(1R,2S)-2-amino-1-(5-methyl-2-thienyl)butyl]-2-piperidyl]ethanol 2-[(2R)-1-[(1R,2S)-2-amino-1-(5-…
| 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) | 2.32 | 3 | -42.91 | 4 | 3 | 1 | 51 | 297.488 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.32 | 3.05 | -3.46 | 3 | 3 | 0 | 49 | 296.48 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.32 | 4.23 | -29.2 | 4 | 3 | 1 | 51 | 297.488 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.32 | 4.55 | -107.25 | 5 | 3 | 2 | 52 | 298.496 | 6 | ↓ |
