| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 20th, 2008 | 14 | Yes |
Popular Name: 1-[(2,5-dimethylpyrazol-3-yl)methyl]piperazine 1-[(2,5-dimethylpyrazol-3-yl)met…
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CAS Number: 1172092-88-4
| 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) | -0.05 | 1.65 | -45.06 | 2 | 4 | 1 | 38 | 195.29 | 2 | ↓ |
| Hi High (pH 8-9.5) | -0.05 | 0.3 | -6.11 | 1 | 4 | 0 | 33 | 194.282 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
