| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 9th, 2011 | 21 | Yes |
Popular Name: 5-[2-(4-pentylphenyl)ethynyl]-1H-pyrimidine-2,4-dione 5-[2-(4-pentylphenyl)ethynyl]-1H…
| 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) | 2.88 | 7.73 | -14.75 | 2 | 4 | 0 | 66 | 282.343 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.34 | 5.79 | -38.2 | 1 | 4 | -1 | 69 | 281.335 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
