| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2011 | 28 | Yes |
Popular Name: 3-(dimethylamino)-1-[4-[1-methyl-5-(p-tolyl)pyrazole-3-carbonyl]piperazin-1-yl]propan-1-one 3-(dimethylamino)-1-[4-[1-methyl…
| 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) | 1.70 | 9.61 | -48.63 | 1 | 7 | 1 | 63 | 384.504 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.70 | 7.14 | -13.6 | 0 | 7 | 0 | 62 | 383.496 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
