In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 12th, 2010 | 31 | No |
Popular Name: (3E,5E)-1-ethyl-3,5-bis[(2-isopropoxyphenyl)methylene]piperidin-4-one (3E,5E)-1-ethyl-3,5-bis[(2-isopr…
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) | 5.46 | 11.95 | -11.55 | 0 | 4 | 0 | 39 | 419.565 | 7 | ↓ |
Lo Low (pH 4.5-6) | 5.46 | 14.19 | -40.89 | 1 | 4 | 1 | 40 | 420.573 | 7 | ↓ |