In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 11th, 2010 | 32 | No |
Popular Name: [(1S,2S,4S,5R)-3-hydroxy-2,4,5,6-tetraphosphonooxy-cyclohexyl] [(1S,2S,4S,5R)-3-hydroxy-2,4,5,6…
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) | -5.34 | -10.36 | -429.25 | 6 | 21 | -5 | 368 | 575.011 | 10 | ↓ |
Mid Mid (pH 6-8) | -5.34 | -5.84 | -1284.69 | 2 | 21 | -9 | 379 | 570.979 | 10 | ↓ |
Mid Mid (pH 6-8) | -5.34 | -4.63 | -1524.12 | 1 | 21 | -10 | 382 | 569.971 | 10 | ↓ |
Mid Mid (pH 6-8) | -5.34 | -5.84 | -1265.42 | 2 | 21 | -9 | 379 | 570.979 | 10 | ↓ |
Lo Low (pH 4.5-6) | -5.34 | -9.28 | -609.01 | 5 | 21 | -6 | 371 | 574.003 | 10 | ↓ |