In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 18th, 2009 | 17 | No |
Popular Name: 3-(3-Ethoxy-phenylcarbamoyl)-acrylic acid 3-(3-Ethoxy-phenylcarbamoyl)-acr…
Find On: PubMed — Wikipedia — Google
CAS Number: 36847-96-8
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) | 1.29 | 4.71 | -71.62 | 1 | 5 | -1 | 78 | 234.231 | 5 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
mp | 45 | MolMall (formerly Molecular Diversity Preservation International) |
PUBCHEM_PATENT_ID | WO2000001692A1 | IBM Patent Data |