In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 1st, 2009 | 37 | Yes |
Popular Name: (3S)-1-benzyl-3-[2-benzyloxy-4-(1,1-dimethylheptyl)phenyl]piperidin-3-ol (3S)-1-benzyl-3-[2-benzyloxy-4-(…
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) | 8.61 | 18.32 | -29.89 | 2 | 3 | 1 | 34 | 500.747 | 12 | ↓ |
Hi High (pH 8-9.5) | 8.61 | 16.04 | -5.18 | 1 | 3 | 0 | 33 | 499.739 | 12 | ↓ |