| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 6th, 2011 | 32 | No |
Popular Name: Sissotrin Sissotrin
Find On: PubMed — Wikipedia — Google
CAS Numbers: 5928-26-7 , [5928-26-7]
CPD-4563; biochanin A 7-O-beta-D-glucoside; biochanin A-7-O-glucoside
Sissotrin with HPLC [5928-26-7]; (Biochanin A-7-O-glucoside)
Sissotrin with HPLC, 99+% [5928-26-7] ; (Biochanin A-7-glucoside)
| 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) | 1.02 | -3.24 | -17.85 | 5 | 10 | 0 | 159 | 446.408 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.02 | -2.26 | -65.19 | 4 | 10 | -1 | 162 | 445.4 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| M.P. | 218-220 C | Indofine |
| MP | 218-221o C | Indofine |
No pre-computed analogs available. Try a structural similarity search.