| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2009 | 21 | Yes |
Popular Name: 2-[3,5-dimethyl-4-(propylaminomethyl)pyrazol-1-yl]-1-(1-piperidyl)ethanone 2-[3,5-dimethyl-4-(propylaminome…
| 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) | 1.45 | 7.3 | -44.79 | 2 | 5 | 1 | 55 | 293.435 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.45 | 5.95 | -13.38 | 1 | 5 | 0 | 50 | 292.427 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
