In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 31st, 2006 | 26 | Yes |
Popular Name: 3,5,7-TRIHYDROXY-3',4',5'-TRIMETHOXYFLAVONE 3,5,7-TRIHYDROXY-3',4',5'-TRIMET…
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CAS Number: 146132-95-8
3,5,7-Trihydroxy-2-(3,4,5-trimethoxyphenyl)-4H-chromen-4-one
3,5,7-Trihydroxy-3',4',5'-trimethoxyflavone [146132-95-8]; (Myricetin trimethyl ether)
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) | 2.28 | 1.08 | -20.25 | 3 | 8 | 0 | 119 | 360.318 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.28 | 2.09 | -58.39 | 2 | 8 | -1 | 121 | 359.31 | 4 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
M.P. | 288-291 C (dec) | Indofine |
MP | 288-291o C (d) | Indofine |