In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 20th, 2010 | 27 | No |
Popular Name: 2-[[2-(4-benzylsulfonylpiperazin-1-yl)-2-oxo-ethyl]-methyl-amino]-N,N-dimethyl-acetamide 2-[[2-(4-benzylsulfonylpiperazin…
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) | -0.54 | 5.89 | -59.1 | 1 | 8 | 1 | 82 | 397.521 | 7 | ↓ |
Hi High (pH 8-9.5) | -0.54 | 3.65 | -26.26 | 0 | 8 | 0 | 81 | 396.513 | 7 | ↓ |