In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 15th, 2010 | 20 | 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) | 1.77 | 4.25 | -40.35 | 2 | 5 | 1 | 49 | 284.424 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.77 | 2.98 | -5.64 | 1 | 5 | 0 | 45 | 283.416 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | US6066636; WO2000000488A1 | IBM Patent Data |