| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 13th, 2010 | 15 | Yes |
Popular Name: (S)-6-(3-Methylpiperazin-1-yl)nicotinonitrile (S)-6-(3-Methylpiperazin-1-yl)ni…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1057682-03-7 , [1057682-03-7]
| 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) | 0.88 | 5.04 | -46.26 | 2 | 4 | 1 | 57 | 203.269 | 1 | ↓ |
| Hi High (pH 8-9.5) | 0.88 | 3.79 | -6.39 | 1 | 4 | 0 | 52 | 202.261 | 1 | ↓ |
