In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 23rd, 2009 | 25 | Yes |
Popular Name: 2-[4-(2-fluorobenzoyl)piperazin-1-yl]-N-(5-methylisoxazol-3-yl)acetamide 2-[4-(2-fluorobenzoyl)piperazin-…
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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) | 0.91 | 7.69 | -59.54 | 2 | 7 | 1 | 80 | 347.37 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.91 | 5.46 | -20.5 | 1 | 7 | 0 | 79 | 346.362 | 4 | ↓ |