| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 17th, 2010 | 20 | Yes |
Popular Name: 4-[5-[[(2S)-2-(2-hydroxyethyl)-1-piperidyl]methyl]-3-thienyl]but-3-yn-1-ol 4-[5-[[(2S)-2-(2-hydroxyethyl)-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) | 1.94 | 4.75 | -36.87 | 3 | 3 | 1 | 45 | 294.44 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.94 | 3.09 | -5.93 | 2 | 3 | 0 | 44 | 293.432 | 5 | ↓ |
