In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 24th, 2010 | 22 | Yes |
Popular Name: 2-[4-(3,3-dimethylbutyl)piperazin-1-yl]-N-(4-methylthiazol-2-yl)acetamide 2-[4-(3,3-dimethylbutyl)piperazi…
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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) | 2.65 | 6.34 | -41.74 | 2 | 5 | 1 | 50 | 325.502 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.65 | 4.06 | -8.46 | 1 | 5 | 0 | 48 | 324.494 | 6 | ↓ |