In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 5th, 2005 | 31 | Yes |
Popular Name: Simvastatin Ammonium Salt Simvastatin Ammonium Salt
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CAS Number: 139893-43-9
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) | 3.96 | 11.1 | -55.46 | 2 | 6 | -1 | 107 | 435.581 | 11 | ↓ |
Lo Low (pH 4.5-6) | 3.96 | 9.11 | -15.63 | 3 | 6 | 0 | 104 | 436.589 | 11 | ↓ |