| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 29th, 2008 | 18 | No |
Popular Name: 1-(2-Hydroxyphenyl)-3-phenyl-1,3-propanedione 1-(2-Hydroxyphenyl)-3-phenyl-1,3…
Find On: PubMed — Wikipedia — Google
CAS Number: 1469-94-9
1-(2-Hydroxyphenyl)-3-phenylpropane-1,3-dione
1-(o-hydroxyphenyl)-3-phenyl-1,3-propanedione
3-Hydroxy-1-(2-hydroxy-phenyl)-3-phenyl-propenone
Benzoyl(2-hydroxybenzoyl)methane
| 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) | 2.82 | 8.14 | -19.2 | 1 | 3 | 0 | 54 | 240.258 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.82 | 9.15 | -66.18 | 0 | 3 | -1 | 57 | 239.25 | 4 | ↓ |
| Mid Mid (pH 6-8) | 4.01 | 7 | -59.24 | 1 | 3 | -1 | 60 | 239.25 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Melting_Point | 118-122? | Alfa-Aesar |
| Melting_Point | 118-122° | Alfa-Aesar |
No pre-computed analogs available. Try a structural similarity search.
