| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 29th, 2008 | 17 | Yes |
Popular Name: 1-{4-[4-(aminomethyl)pyridin-2-yl]piperazin-1-yl}ethan-1-one 1-{4-[4-(aminomethyl)pyridin-2-y…
Find On: PubMed — Wikipedia — Google
CAS Number: 954571-60-9
None
| 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) | -0.47 | 1.99 | -56.65 | 3 | 5 | 1 | 64 | 235.311 | 2 | ↓ |
| Hi High (pH 8-9.5) | -0.47 | 1.61 | -10.25 | 2 | 5 | 0 | 62 | 234.303 | 2 | ↓ |
| Hi High (pH 8-9.5) | -0.47 | 1.88 | -39.43 | 3 | 5 | 1 | 64 | 235.311 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
