In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 1st, 2011 | 14 | Yes |
Popular Name: 2-[(1R,4S,5R)-7-oxabicyclo[2.2.1]heptan-5-yl]-1H-pyrimidin-6-one 2-[(1R,4S,5R)-7-oxabicyclo[2.2.1…
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) | 0.03 | 2.37 | -8.95 | 1 | 4 | 0 | 55 | 192.218 | 1 | ↓ |
Hi High (pH 8-9.5) | 0.48 | 0.56 | -44.52 | 0 | 4 | -1 | 58 | 191.21 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.