| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 7th, 2004 | 12 | Yes |
Popular Name: Phloretic acid Phloretic acid
Find On: PubMed — Wikipedia — Google
CAS Number: 501-97-3
| 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) | 0.95 | 2.51 | -47.56 | 1 | 3 | -1 | 60 | 171.216 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 0.95 | 1.39 | -9.61 | 2 | 3 | 0 | 58 | 172.224 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Melting_Point | 126-131? | Alfa-Aesar |
| Melting_Point | 126-131° | Alfa-Aesar |
No pre-computed analogs available. Try a structural similarity search.