| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 11th, 2008 | 16 | Yes |
Popular Name: 4-amino-1-benzylpiperidine-4-carbonitrile 4-amino-1-benzylpiperidine-4-car…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 136624-42-5 , 136624-92-5 , 6094-60-6 , [136624-42-5]
| 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) | 1.40 | 5.15 | -41.1 | 3 | 3 | 1 | 54 | 216.308 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.65 | 7.51 | -17.34 | 2 | 6 | 0 | 96 | 293.319 | 8 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 67 - 69 | Enamine Building Blocks |
| MP | 67...69 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
No pre-computed analogs available. Try a structural similarity search.