| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 13th, 2008 | 16 | Yes |
Popular Name: (4-Methyl-piperazin-1-yl)phenyl-acetonitrilehydrochloride (4-Methyl-piperazin-1-yl)phenyl-…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 108953-41-9 , 92042-94-9
(4-Methyl-piperazin-1-yl)-phenyl-acetonitrile hydrochloride
(4-Methyl-piperazin-1-yl)-phenyl-acetonitrilehydrochloride
(4-Methyl-piperazin-1-yl)phenyl-acetonitrile hydrochloride
| 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) | 1.60 | 6.47 | -41.95 | 1 | 3 | 1 | 31 | 216.308 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.60 | 3.99 | -5.07 | 0 | 3 | 0 | 30 | 215.3 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 95% | Fluorochem |
| Purity | 95+% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
