| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 8th, 2008 | 18 | No |
Popular Name: 4-[2-(4-Methyl-piperazin-1-yl)-ethoxy]-benzaldehyde 4-[2-(4-Methyl-piperazin-1-yl)-e…
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CAS Numbers: 100875-69-2 , [100875-69-2]
| 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) | 1.71 | 5.5 | -40.54 | 1 | 4 | 1 | 34 | 249.334 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.71 | 5.42 | -40.95 | 1 | 4 | 1 | 34 | 249.334 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.71 | 3.03 | -8.13 | 0 | 4 | 0 | 33 | 248.326 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
