| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 9th, 2010 | 18 | Yes |
Popular Name: 3-[4-(2-methylpyrimidin-4-yl)piperazin-1-yl]propanoic 3-[4-(2-methylpyrimidin-4-yl)pip…
| 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) | -0.27 | 7.28 | -50.21 | 1 | 6 | 0 | 74 | 250.302 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.27 | 5.05 | -46.11 | 0 | 6 | -1 | 72 | 249.294 | 4 | ↓ |
| Lo Low (pH 4.5-6) | -0.27 | 7.73 | -85.46 | 2 | 6 | 1 | 75 | 251.31 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
