In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 11th, 2008 | 27 | Yes |
Popular Name: PYRROLIDINEMETHANOLSULFATE PYRROLIDINEMETHANOLSULFATE
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CAS Number: 131180-56-8
(2S)-(4,4'-DIISOBUTYLPHENYL)PYRROLIDINE METHANOL SULFATE
(S)-Bis(4-(tert-butyl)phenyl)(pyrrolidin-2-yl)methanol sulfate
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) | 5.89 | 11.17 | -38.17 | 3 | 2 | 1 | 37 | 366.569 | 5 | ↓ |
Hi High (pH 8-9.5) | 5.89 | 9.74 | -3.93 | 2 | 2 | 0 | 32 | 365.561 | 5 | ↓ |