| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 25th, 2011 | 18 | Yes |
Popular Name: (3S)-1-[(2S)-2-hydroxy-3-(4-methyl-1-piperidyl)propyl]piperidin-3-ol (3S)-1-[(2S)-2-hydroxy-3-(4-meth…
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| 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) | 0.63 | 1.19 | -35.62 | 3 | 4 | 1 | 48 | 257.398 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.63 | 1.25 | -35.75 | 3 | 4 | 1 | 48 | 257.398 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.63 | 3.47 | -100.44 | 4 | 4 | 2 | 49 | 258.406 | 4 | ↓ |
