| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 2nd, 2009 | 17 | Yes |
Popular Name: [(2S)-2-piperidyl]-(4-prop-2-ynylpiperazin-1-yl)methanone [(2S)-2-piperidyl]-(4-prop-2-yny…
| 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) | 0.40 | 3.41 | -37.35 | 2 | 4 | 1 | 40 | 236.339 | 2 | ↓ |
| Hi High (pH 8-9.5) | 0.40 | 2.16 | -9.05 | 1 | 4 | 0 | 36 | 235.331 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 0.40 | 5.65 | -93.58 | 3 | 4 | 2 | 41 | 237.347 | 2 | ↓ |
