In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 29 | Yes |
Popular Name: (2R,3S,5S,6S)-2,6-bis(3,4-dimethoxyphenyl)-3,5-dimethyl-piperidin-4-one (2R,3S,5S,6S)-2,6-bis(3,4-dimeth…
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) | 3.08 | 8.45 | -57.27 | 2 | 6 | 1 | 71 | 400.495 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.08 | 7.62 | -12.84 | 1 | 6 | 0 | 66 | 399.487 | 6 | ↓ |