| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 29th, 2011 | 22 | Yes |
Popular Name: 1-[(3R)-3-(4-methylpyrazol-1-yl)-1-piperidyl]-3-(2,2,2-trifluoroethylamino)propan-1-one 1-[(3R)-3-(4-methylpyrazol-1-yl)…
| 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) | 1.14 | 4.95 | -12.51 | 1 | 5 | 0 | 50 | 318.343 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.14 | 6.34 | -56.2 | 2 | 5 | 1 | 55 | 319.351 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
