| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 29th, 2009 | 15 | Yes |
Popular Name: 3,4,5-Piperidinetriol, 1-butyl-2-(hydroxymethyl)-, (2R,3S,4R,5R)- (9CI) 3,4,5-Piperidinetriol, 1-butyl-2…
Find On: PubMed — Wikipedia — Google
CAS Number: 757235-48-6
| 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) | -0.72 | -2.17 | -32.67 | 5 | 5 | 1 | 85 | 220.289 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.72 | -1.4 | -38.43 | 4 | 5 | 0 | 88 | 219.281 | 4 | ↓ |
