In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 28th, 2010 | 18 | Yes |
Popular Name: 6-[2-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-2-oxo-ethyl]-1H-pyrimidine-2,4-dione 6-[2-[(2S)-2-(hydroxymethyl)pyrr…
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) | -1.15 | -1.75 | -17.23 | 3 | 7 | 0 | 106 | 253.258 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.69 | -3.6 | -47.42 | 2 | 7 | -1 | 109 | 252.25 | 3 | ↓ |