| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2010 | 21 | No |
Popular Name: 2-methylsulfonyl-N-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]ethanamine 2-methylsulfonyl-N-[2-(4-pyrimid…
| 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) | -0.52 | 3.02 | -60.26 | 2 | 7 | 1 | 83 | 314.435 | 7 | ↓ |
| Mid Mid (pH 6-8) | -0.52 | 1.67 | -16.95 | 1 | 7 | 0 | 78 | 313.427 | 7 | ↓ |
| Lo Low (pH 4.5-6) | -0.52 | 5.23 | -139.18 | 3 | 7 | 2 | 84 | 315.443 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
