In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 20th, 2010 | 14 | 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) | -1.01 | 0.31 | -110.68 | 6 | 5 | 2 | 85 | 205.302 | 6 | ↓ |
Hi High (pH 8-9.5) | -1.01 | -0.08 | -46.42 | 5 | 5 | 1 | 83 | 204.294 | 6 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | EP0912584A2; US6022892; WO1998003519A2 | IBM Patent Data |