| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 29th, 2008 | 12 | Yes |
Popular Name: 4-(4-Methyl-piperazin-1-yl)-butylamine 4-(4-Methyl-piperazin-1-yl)-buty…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 4553-32-6 , [4553-32-6]
| 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) | -0.42 | 1.64 | -96.04 | 4 | 3 | 2 | 35 | 173.304 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.42 | -0.76 | -43.55 | 3 | 3 | 1 | 34 | 172.296 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.42 | 1.72 | -86.07 | 4 | 3 | 2 | 35 | 173.304 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| BP | 130°/18 Torr | Matrix Scientific |
| BP | 130°/18mm | Oakwood Chemical |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 99% | Fluorochem |
| Warnings | IRRITANT | Matrix Scientific |
