| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 27th, 2010 | 15 | Yes |
Popular Name: (2S)-2-[[(2R)-2-(hydroxymethyl)-1-piperidyl]methyl]cyclopentanone (2S)-2-[[(2R)-2-(hydroxymethyl)-…
| 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) | 1.05 | 4.56 | -32.72 | 2 | 3 | 1 | 42 | 212.313 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.05 | 2.56 | -8.04 | 1 | 3 | 0 | 41 | 211.305 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
