In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 22nd, 2008 | 27 | Yes |
Popular Name: 2-[4-[(1R)-1-methyl-2-oxo-2-(1-piperidyl)ethyl]piperazin-1-yl]-N-(p-tolyl)acetamide 2-[4-[(1R)-1-methyl-2-oxo-2-(1-p…
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) | 2.44 | 7.57 | -42.61 | 2 | 6 | 1 | 57 | 373.521 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.44 | 5.32 | -14.07 | 1 | 6 | 0 | 56 | 372.513 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.44 | 7.55 | -39.45 | 2 | 6 | 1 | 57 | 373.521 | 5 | ↓ |