| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 11th, 2011 | 16 | Yes |
Popular Name: 4-(4-Fluorophenyl)nicotinic acid 4-(4-Fluorophenyl)nicotinic acid
Find On: PubMed — Wikipedia — Google
CAS Number: 32923-72-1
| 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) | 2.16 | 6.75 | -44.9 | 0 | 3 | -1 | 53 | 216.191 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 2.16 | 7.21 | -47.45 | 1 | 3 | 0 | 54 | 217.199 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | 95% | Fluorochem |
No pre-computed analogs available. Try a structural similarity search.
