| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 15th, 2010 | 16 | Yes |
Popular Name: [1-[(1S)-1-(1-methylpyrazol-4-yl)ethyl]-4-piperidyl]methanamine [1-[(1S)-1-(1-methylpyrazol-4-yl…
| 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) | 0.26 | 4.61 | -100.83 | 4 | 4 | 2 | 50 | 224.352 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.26 | 2.44 | -45.9 | 3 | 4 | 1 | 49 | 223.344 | 3 | ↓ |
