In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 30th, 2005 | 22 | Yes |
Popular Name: Ibuprofen piconol Ibuprofen piconol
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CAS Numbers: 112017-99-9 , 64622-45-3
112017-99-9; D01122; Ibuprofen piconol (JP16/USAN); Staderm (TN)
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) | 3.86 | 11.29 | -8.23 | 0 | 3 | 0 | 39 | 297.398 | 7 | ↓ |
Lo Low (pH 4.5-6) | 3.86 | 3.04 | -34.46 | 1 | 3 | 1 | 40 | 298.406 | 7 | ↓ |