| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2008 | 15 | Yes |
Popular Name: 2-(4-Methylpiperazin-1-yl)isonicotinonitrile 2-(4-Methylpiperazin-1-yl)isonic…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1016501-27-1 , [1016501-27-1]
| 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) | 0.74 | 5.48 | -40.91 | 1 | 4 | 1 | 44 | 203.269 | 1 | ↓ |
| Mid Mid (pH 6-8) | 0.74 | 3.01 | -5.64 | 0 | 4 | 0 | 43 | 202.261 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 97% | Fluorochem |
