| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 20th, 2008 | 19 | Yes |
Popular Name: 3'-Hydroxy-6-methylflavone 3'-Hydroxy-6-methylflavone
Find On: PubMed — Wikipedia — Google
CAS Number: 468060-75-5
| 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) | 3.66 | 6.1 | -11.06 | 1 | 3 | 0 | 50 | 252.269 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| M.P. | 199.5-201.5 C | Indofine |
| MP | 199.5-201.5o C | Indofine |
| Melting_Point | 203-206? | Alfa-Aesar |
| Melting_Point | 203-206° | Alfa-Aesar |
| APPEARANCE | Pale yellow crystalline powder | Indofine |
| SOLUBILITY | Soluble in Chloroform:Ethyl Acetate (7:3) | Indofine |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z104301-4-O | GABA-A Receptor; Anion Channel (cluster #4 Of 8), Other | Other | 390 | 0.47 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Z104301 | Z104301 | GABA-A Receptor; Anion Channel | 390 | 0.47 | Binding ≤ 1μM |
| Z104301 | Z104301 | GABA-A Receptor; Anion Channel | 390 | 0.47 | Binding ≤ 10μM |
No pre-computed analogs available. Try a structural similarity search.