| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 23rd, 2011 | 22 | Yes |
Popular Name: (2S)-2-[(3,5-dimethylpyrazol-1-yl)methyl]-4-[2-(2,2,2-trifluoroethoxy)ethyl]morpholine (2S)-2-[(3,5-dimethylpyrazol-1-y…
| 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) | 1.60 | 4.02 | -12.69 | 0 | 5 | 0 | 40 | 321.343 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 1.60 | 6.35 | -48.65 | 1 | 5 | 1 | 41 | 322.351 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
