In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 1st, 2011 | 17 | Yes |
Popular Name: (3S)-3-[2-[(2S)-2-methyl-1-piperidyl]-2-oxo-ethyl]piperazin-2-one (3S)-3-[2-[(2S)-2-methyl-1-piper…
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) | 1.14 | 1.07 | -8.71 | 2 | 5 | 0 | 61 | 239.319 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.14 | 2.22 | -39.63 | 3 | 5 | 1 | 66 | 240.327 | 2 | ↓ |