In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 7th, 2008 | 25 | Yes |
Popular Name: 2-[4-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]piperazin-1-yl]-1-(1-piperidyl)ethanone 2-[4-[(3,5-dimethyl-1H-pyrazol-4…
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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) | 0.15 | 4.46 | -52.22 | 2 | 8 | 1 | 91 | 370.499 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.15 | 2.24 | -16.26 | 1 | 8 | 0 | 90 | 369.491 | 4 | ↓ |