In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 12th, 2010 | 29 | No |
Popular Name: (3E,5E)-3,5-bis[(2-isopropoxyphenyl)methylene]piperidin-4-one (3E,5E)-3,5-bis[(2-isopropoxyphe…
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) | 4.49 | 10.03 | -10.47 | 1 | 4 | 0 | 48 | 391.511 | 6 | ↓ |
Mid Mid (pH 6-8) | 4.49 | 11.31 | -47.77 | 2 | 4 | 1 | 52 | 392.519 | 6 | ↓ |