In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 27th, 2004 | 18 | No |
Popular Name: 3-oxo-3-[4-(trifluoromethoxy)anilino]propanoic acid 3-oxo-3-[4-(trifluoromethoxy)ani…
Find On: PubMed — Wikipedia — Google
CAS Number: 241132-65-0
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) | 1.60 | 1.42 | -54.17 | 1 | 5 | -1 | 78 | 262.163 | 5 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
melting_point | 131 - 133 | KeyOrganics |
PUBCHEM_PATENT_ID | WO2000001692A1 | IBM Patent Data |