In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 20th, 2008 | 34 | Yes |
Popular Name: 2-[4-[2-(cyclopropylamino)-2-oxo-ethyl]piperazin-1-yl]-N-(2,5-diphenylpyrazol-3-yl)acetamide 2-[4-[2-(cyclopropylamino)-2-oxo…
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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) | 2.90 | 10.43 | -53.06 | 3 | 8 | 1 | 84 | 459.574 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.90 | 8.2 | -22.79 | 2 | 8 | 0 | 82 | 458.566 | 8 | ↓ |
Lo Low (pH 4.5-6) | 2.90 | 10.42 | -56.99 | 3 | 8 | 1 | 84 | 459.574 | 8 | ↓ |