In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 8th, 2004 | 21 | Yes |
Popular Name: 2-[4-[4-(2-keto-2-oxido-ethyl)phenoxy]phenyl]acetate 2-[4-[4-(2-keto-2-oxido-ethyl)ph…
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) | 2.54 | 1.5 | -97.63 | 0 | 5 | -2 | 89 | 284.267 | 6 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | US4002593; US4267310 | IBM Patent Data |