| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 11th, 2008 | 25 | No |
Popular Name: 2-[(4-benzylpiperazin-1-yl)methyl]isoindoline-1,3-dione 2-[(4-benzylpiperazin-1-yl)methy…
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CAS Number: 97-64-3
2-[(4-benzylpiperazino)methyl]-1H-isoindole-1,3(2H)-dione
2-[[4-(phenylmethyl)-1-piperazinyl]methyl]isoindole-1,3-dione
| 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) | 2.83 | 8.63 | -40.85 | 1 | 5 | 1 | 47 | 336.415 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.83 | 6.25 | -9.55 | 0 | 5 | 0 | 46 | 335.407 | 4 | ↓ |
