| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 21st, 2010 | 24 | Yes |
Popular Name: 6-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]-2-isopropyl-pyrimidin-4-ol 6-[[4-(4-fluorophenyl)piperazin-…
| 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) | 2.62 | 8.45 | -49.6 | 2 | 5 | 1 | 53 | 331.415 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.62 | 6.19 | -10.59 | 1 | 5 | 0 | 52 | 330.407 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.07 | 6.2 | -55.85 | 1 | 5 | 0 | 57 | 330.407 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![4-[(4-phenylpiperazino)methyl]-1H-pyrimidin-6-one](http://zinc12.docking.org/img/rings/561181.gif)