In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 13th, 2010 | 12 | Yes |
Popular Name: (3S,3aR,6R,6aS)-3,6-dihydroxy-3,3a,6,6a-tetrahydrofuro[3,2-b]furan-2,5-dione (3S,3aR,6R,6aS)-3,6-dihydroxy-3,…
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) | -4.31 | -3.79 | -10.34 | 2 | 6 | 0 | 93 | 174.108 | 0 | ↓ |
Hi High (pH 8-9.5) | -4.31 | -2.68 | -98.24 | 0 | 6 | -2 | 99 | 172.092 | 0 | ↓ |
Mid Mid (pH 6-8) | -4.31 | -3.23 | -42.21 | 1 | 6 | -1 | 96 | 173.1 | 0 | ↓ |