| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 11th, 2008 | 15 | Yes |
Popular Name: 4-(Pyridin-3-yl)benzaldehyde 4-(Pyridin-3-yl)benzaldehyde
Find On: PubMed — Wikipedia — Google
CAS Number: 90395-45-2
| 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) | 2.56 | 6.51 | -10.08 | 0 | 2 | 0 | 30 | 197.237 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 2.56 | 6.96 | -42.79 | 1 | 2 | 1 | 31 | 198.245 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0790974A1; US6133304; WO1998025597A2; WO1998026773A1; WO1999032150A1; WO1999047138A1; WO2000004892A2 | IBM Patent Data |
