| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 9th, 2011 | 18 | Yes |
Popular Name: (5S,6S)-5-amino-1-(2-methoxyethyl)-6-(1-methylpyrazol-4-yl)piperidin-2-one (5S,6S)-5-amino-1-(2-methoxyethy…
| 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) | -1.13 | 2.5 | -51.75 | 3 | 6 | 1 | 75 | 253.326 | 4 | ↓ |
| Hi High (pH 8-9.5) | -1.13 | 2.16 | -12.97 | 2 | 6 | 0 | 73 | 252.318 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
