In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 25th, 2010 | 29 | Yes |
Popular Name: ethyl ethyl
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) | 2.52 | 13.64 | -13.7 | 0 | 5 | 0 | 61 | 404.853 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.52 | 14.1 | -50.62 | 1 | 5 | 1 | 62 | 405.861 | 5 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | US4959363 | IBM Patent Data |