| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 17th, 2008 | 16 | Yes |
Popular Name: 5-amino-2-(3-methylpiperidin-1-yl)benzonitrile dihydrochloride 5-amino-2-(3-methylpiperidin-1-y…
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CAS Numbers: , 952934-64-4
5-amino-2-(3-methylpiperidin-1-yl)benzonitrile
benzonitrile, 5-amino-2-(3-methyl-1-piperidinyl)-, dihydrochloride
| 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) | 1.95 | 5.08 | -7.67 | 2 | 3 | 0 | 53 | 215.3 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 95% | Fluorochem |
