In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 30th, 2009 | 19 | No |
Popular Name: 1-[(2S,3R,4R)-3,4-bis(hydroxymethyl)oxetan-2-yl]-5-[(E)-2-bromovinyl]pyrimidine-2,4-dione 1-[(2S,3R,4R)-3,4-bis(hydroxymet…
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) | -0.83 | -3.74 | -10.59 | 3 | 7 | 0 | 105 | 333.138 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.37 | -6.4 | -44.88 | 2 | 7 | -1 | 108 | 332.13 | 4 | ↓ |