| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2010 | 19 | Yes |
Popular Name: 2,2,2-trifluoro-N-[2-(4-thiazol-2-ylpiperazin-1-yl)ethyl]ethanamine 2,2,2-trifluoro-N-[2-(4-thiazol-…
| 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) | 1.35 | 2.82 | -6.88 | 1 | 4 | 0 | 31 | 294.346 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.35 | 4.18 | -50.28 | 2 | 4 | 1 | 36 | 295.354 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.35 | 5.04 | -47.16 | 2 | 4 | 1 | 33 | 295.354 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.35 | 4.62 | -86.42 | 3 | 4 | 2 | 37 | 296.362 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
