In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 12th, 2010 | 18 | Yes |
Popular Name: 1-[4-(Propane-2-sulfonyl)phenyl]piperazine 1-[4-(Propane-2-sulfonyl)phenyl]…
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CAS Numbers: 1048921-11-4 , [1048921-11-4]
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) | 0.94 | 3.51 | -52.85 | 2 | 4 | 1 | 54 | 269.39 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.94 | 2.2 | -10.12 | 1 | 4 | 0 | 49 | 268.382 | 3 | ↓ |