In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2008 | 31 | No |
Popular Name: (3E,5E)-3,5-bis[(3,4-dimethoxyphenyl)methylene]-1-ethyl-piperidin-4-one (3E,5E)-3,5-bis[(3,4-dimethoxyph…
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) | 3.62 | 8.59 | -12.92 | 0 | 6 | 0 | 57 | 423.509 | 7 | ↓ |
Lo Low (pH 4.5-6) | 3.62 | 10.83 | -48.43 | 1 | 6 | 1 | 58 | 424.517 | 7 | ↓ |