In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 12th, 2008 | 21 | No |
Popular Name: (2R,3R,4S,5R)-2-benzyloxy-5-(nitromethyl)tetrahydropyran-3,4,5-triol (2R,3R,4S,5R)-2-benzyloxy-5-(nit…
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) | -0.37 | -0.17 | -15.77 | 3 | 8 | 0 | 125 | 299.279 | 5 | ↓ |
Hi High (pH 8-9.5) | -0.64 | 0.29 | -40.78 | 3 | 8 | -1 | 131 | 298.271 | 4 | ↓ |