In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 1st, 2009 | 32 | Yes |
Popular Name: N-[1-[(1R)-2-(4-benzylpiperazin-1-yl)-1-methyl-2-oxo-ethyl]-4-piperidyl]benzamide N-[1-[(1R)-2-(4-benzylpiperazin-…
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) | 2.52 | 9.64 | -48.32 | 2 | 6 | 1 | 57 | 435.592 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.52 | 7.43 | -16.39 | 1 | 6 | 0 | 56 | 434.584 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.52 | 11.97 | -110.15 | 3 | 6 | 2 | 58 | 436.6 | 6 | ↓ |