In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 18th, 2009 | 17 | Yes |
Popular Name: 1-[(2S,4R,5R)-4-hydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-5-iodo-pyrimidine-2,4-dione 1-[(2S,4R,5R)-4-hydroxy-5-(hydro…
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) | -0.80 | -3.01 | -18.16 | 3 | 7 | 0 | 105 | 354.1 | 2 | ↓ |
Hi High (pH 8-9.5) | -0.34 | -4.82 | -54.78 | 2 | 7 | -1 | 108 | 353.092 | 2 | ↓ |