In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 1st, 2009 | 27 | No |
Popular Name: (3E,5E)-3,5-bis[(2,5-dichlorophenyl)methylene]-1-ethyl-piperidin-4-one (3E,5E)-3,5-bis[(2,5-dichlorophe…
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) | 6.54 | 12.09 | -5.63 | 0 | 2 | 0 | 20 | 441.185 | 3 | ↓ |
Lo Low (pH 4.5-6) | 6.54 | 14.31 | -39.4 | 1 | 2 | 1 | 22 | 442.193 | 3 | ↓ |