| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 28th, 2008 | 18 | No |
Popular Name: 2-[2-(4-Methyl-piperazin-1-yl)-ethoxy]-benzaldehyde 2-[2-(4-Methyl-piperazin-1-yl)-e…
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CAS Numbers: 82625-37-4 , [82625-37-4]
2-(2-(4-Methylpiperazin-1-yl)ethoxy)benzaldehyde
2-[2-(4-methyl-1-piperazinyl)ethoxy]benzaldehyde
2-[2-(4-methyl-1-piperazinyl)ethoxy]benzaldehyde hydrochloride
| 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) | 1.66 | 6.76 | -38.27 | 1 | 4 | 1 | 34 | 249.334 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.66 | 6.65 | -33.12 | 1 | 4 | 1 | 34 | 249.334 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.66 | 4.29 | -10.12 | 0 | 4 | 0 | 33 | 248.326 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
