| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 3rd, 2008 | 27 | No |
Popular Name: (E)-1-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(6-nitro-4H-1,3-benzodioxin-8-yl)prop-2-en-1-one (E)-1-(3,4-dihydro-1H-isoquinoli…
| 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) | 2.90 | 9.92 | -12.42 | 0 | 7 | 0 | 85 | 366.373 | 3 | ↓ |
