| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 13th, 2009 | 16 | Yes |
Popular Name: 2-[(4-Aminopiperidin-1-yl)methyl]benzonitrile dihydrochloride 2-[(4-Aminopiperidin-1-yl)methyl…
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CAS Numbers: 1286273-00-4 , 1289388-13-1 , N/A
2-((4-Aminopiperidin-1-yl)methyl)benzonitrile hydrochloride
2-(4-Amino-piperidin-1-ylmethyl)-benzonitrile hydrochloride
2-(4-Amino-piperidin-1-ylmethyl)-benzonitrilehydrochloride
| 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) | 0.71 | 3.68 | -44.39 | 3 | 3 | 1 | 55 | 216.308 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.71 | 5.43 | -35.5 | 3 | 3 | 1 | 54 | 216.308 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 95% | Fluorochem |
