| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2008 | 12 | No |
Popular Name: 4-(4-Methylpiperazin-1-yl)butan-2-one 4-(4-Methylpiperazin-1-yl)butan-…
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CAS Number: 59127-73-0
| 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) | 0.05 | 3.49 | -38.51 | 1 | 3 | 1 | 25 | 171.264 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.05 | 3.41 | -38.27 | 1 | 3 | 1 | 25 | 171.264 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.05 | 1.01 | -6.15 | 0 | 3 | 0 | 24 | 170.256 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 95% | Fluorochem |
