In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 1st, 2009 | 25 | No |
Popular Name: (2S,3S,5S,6R)-2,6-bis(5-bromo-2-hydroxy-phenyl)-3,5-dimethyl-piperidin-4-one (2S,3S,5S,6R)-2,6-bis(5-bromo-2-…
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) | 5.24 | 5.46 | -6.96 | 3 | 4 | 0 | 70 | 469.173 | 2 | ↓ |
Mid Mid (pH 6-8) | 5.24 | 6.16 | -45.5 | 4 | 4 | 1 | 74 | 470.181 | 2 | ↓ |