In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2006 | 21 | Yes |
Popular Name: N-[1-(4-pyridyl)ethyl]-2,5-dioxabicyclo[4.4.0]deca-7,9,11-triene-8-carboxamide N-[1-(4-pyridyl)ethyl]-2,5-dioxa…
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) | 1.31 | 4.87 | -12.71 | 1 | 5 | 0 | 60 | 284.315 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.31 | 5.15 | -46.75 | 2 | 5 | 1 | 62 | 285.323 | 3 | ↓ |