| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 11th, 2008 | 24 | No |
Popular Name: [(1S,2R,4R,5R)-2,3,4-trihydroxy-5,6-diphosphonooxy-cyclohexyl] [(1S,2R,4R,5R)-2,3,4-trihydroxy-…
| 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) | -4.71 | -9.01 | -549.83 | 4 | 15 | -5 | 275 | 415.053 | 6 | ↓ |
| Mid Mid (pH 6-8) | -4.71 | -7.82 | -503.44 | 4 | 15 | -5 | 275 | 415.053 | 6 | ↓ |
| Mid Mid (pH 6-8) | -4.71 | -6.68 | -691.03 | 3 | 15 | -6 | 278 | 414.045 | 6 | ↓ |
| Lo Low (pH 4.5-6) | -4.71 | -10.15 | -362.01 | 5 | 15 | -4 | 272 | 416.061 | 6 | ↓ |
| Lo Low (pH 4.5-6) | -4.71 | -11.3 | -220.76 | 6 | 15 | -3 | 269 | 417.069 | 6 | ↓ |
| Lo Low (pH 4.5-6) | -4.71 | -9.25 | -347.78 | 5 | 15 | -4 | 272 | 416.061 | 6 | ↓ |
| Lo Low (pH 4.5-6) | -4.71 | -11.3 | -222.25 | 6 | 15 | -3 | 269 | 417.069 | 6 | ↓ |
