In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 11th, 2010 | 27 | Yes |
Popular Name: (2R,3S,5S,6S)-2,6-bis(4-dimethylaminophenyl)-3,5-dimethyl-piperidin-4-one (2R,3S,5S,6S)-2,6-bis(4-dimethyl…
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) | 3.99 | 10.81 | -42.69 | 2 | 4 | 1 | 40 | 366.529 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.99 | 9.99 | -6.18 | 1 | 4 | 0 | 36 | 365.521 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.99 | 10.78 | -17.4 | 2 | 4 | 0 | 37 | 366.529 | 4 | ↓ |