In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2008 | 11 | No |
Popular Name: 3-(2-Pyridyl)acrylic acid 3-(2-Pyridyl)acrylic acid
Find On: PubMed — Wikipedia — Google
CAS Number: 7340-22-9
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) | 0.56 | 4.31 | -58.36 | 0 | 3 | -1 | 53 | 148.141 | 2 | ↓ |
Lo Low (pH 4.5-6) | 0.56 | 4.41 | -37.18 | 1 | 3 | 0 | 54 | 149.149 | 2 | ↓ |
Note Type | Comments | Provided By |
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PUBCHEM_PATENT_ID | EP0775139A1; WO1996005201A1 | IBM Patent Data |