| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2010 | 20 | Yes |
Popular Name: 2,2,2-trifluoro-N-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]ethanamine 2,2,2-trifluoro-N-[2-(4-pyrimidi…
| 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) | 1.01 | 4.58 | -7.73 | 1 | 5 | 0 | 44 | 289.305 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.01 | 6.79 | -43.57 | 2 | 5 | 1 | 45 | 290.313 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.01 | 5.94 | -49.83 | 2 | 5 | 1 | 49 | 290.313 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
