| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 4th, 2011 | 29 | Yes |
Popular Name: 2-(dimethylamino)-1-[4-[5-isopropyl-1-(p-tolyl)pyrazole-4-carbonyl]piperazin-1-yl]ethanone 2-(dimethylamino)-1-[4-[5-isopro…
| 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) | 1.52 | 10.06 | -47.31 | 1 | 7 | 1 | 63 | 398.531 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.52 | 7.67 | -13.59 | 0 | 7 | 0 | 62 | 397.523 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
