| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 17th, 2011 | 18 | Yes |
Popular Name: 5-[[4-hydroxy-4-(hydroxymethyl)-1-piperidyl]methyl]-1H-pyrimidine-2,4-dione 5-[[4-hydroxy-4-(hydroxymethyl)-…
| 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) | -1.92 | -3.13 | -50.4 | 5 | 7 | 1 | 111 | 256.282 | 3 | ↓ |
| Hi High (pH 8-9.5) | -1.92 | -5.36 | -16.03 | 4 | 7 | 0 | 109 | 255.274 | 3 | ↓ |
| Hi High (pH 8-9.5) | -1.46 | -5.04 | -41.15 | 4 | 7 | 0 | 114 | 255.274 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
