In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 6th, 2006 | 22 | Yes |
Popular Name: N-(2,6-dioxabicyclo[5.4.0]undeca-8,10,12-trien-9-yl)-2-(2-pyridylsulfanyl)acetamide N-(2,6-dioxabicyclo[5.4.0]undeca…
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) | 2.22 | 5.98 | -15.01 | 1 | 5 | 0 | 60 | 316.382 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.22 | 6.26 | -46.66 | 2 | 5 | 1 | 62 | 317.39 | 4 | ↓ |