In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 1st, 2009 | 13 | No |
Popular Name: 5-hydroxy-2,3-dihydro-1,4-benzodioxine-6-carbaldehyde 5-hydroxy-2,3-dihydro-1,4-benzod…
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) | 1.14 | 1.25 | -8.64 | 1 | 4 | 0 | 56 | 180.159 | 1 | ↓ |
Hi High (pH 8-9.5) | 1.14 | 2.19 | -41.36 | 0 | 4 | -1 | 59 | 179.151 | 1 | ↓ |