In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 28th, 2010 | 34 | Yes |
Popular Name: tert-butyl tert-butyl
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) | 6.63 | 15.49 | -12.31 | 2 | 5 | 0 | 70 | 455.602 | 9 | ↓ |
Lo Low (pH 4.5-6) | 6.63 | 15.75 | -29.77 | 3 | 5 | 1 | 71 | 456.61 | 9 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | US5385925; US5587393 | IBM Patent Data |