In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 31st, 2006 | 20 | No |
Popular Name: 28283-84-3; 3-Methoxy-1,6,7-trihydroxyxanthone; Athyriol; C10052 28283-84-3; 3-Methoxy-1,6,7-trih…
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CAS Number: 28283-84-3
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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) | 2.32 | 0.26 | -11.42 | 3 | 6 | 0 | 100 | 274.228 | 1 | ↓ |
Hi High (pH 8-9.5) | 2.32 | 1 | -57.56 | 2 | 6 | -1 | 103 | 273.22 | 1 | ↓ |
Hi High (pH 8-9.5) | 2.32 | 1.06 | -45.51 | 2 | 6 | -1 | 103 | 273.22 | 1 | ↓ |
Hi High (pH 8-9.5) | 2.32 | 1.8 | -106.06 | 1 | 6 | -2 | 106 | 272.212 | 1 | ↓ |