| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 4th, 2005 | 12 | Yes |
Popular Name: 3-Pyridinebutanoic acid 3-Pyridinebutanoic acid
Find On: PubMed — Wikipedia — Google
CAS Numbers: 17270-50-7 , 176446-91-6
4-(3-pyridyl)-butanoate; 4-(3-pyridyl)-butanoic acid; 4-3-PYRIDYL-BUTANOATE
| 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) | 0.91 | 0.44 | -47.89 | 0 | 3 | -1 | 53 | 164.184 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 0.91 | 0.56 | -60.28 | 1 | 3 | 0 | 54 | 165.192 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
