In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 1st, 2009 | 39 | 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) | 6.66 | 18.66 | -16.83 | 0 | 6 | 0 | 64 | 523.677 | 9 | ↓ |
Lo Low (pH 4.5-6) | 6.66 | 18.92 | -34.55 | 1 | 6 | 1 | 66 | 524.685 | 9 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | US5385925; US5587393 | IBM Patent Data |