| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 5th, 2006 | 18 | No |
Popular Name: 1,5,6-Trihydroxyxanthone; 5042-03-5; C10082; Mesuaxanthone B 1,5,6-Trihydroxyxanthone; 5042-0…
Find On: PubMed — Wikipedia — Google
CAS Number: 5042-03-5
| 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) | 2.54 | 1.97 | -15.83 | 3 | 5 | 0 | 91 | 244.202 | 0 | ↓ |
| Hi High (pH 8-9.5) | 2.54 | 2.45 | -39.59 | 2 | 5 | -1 | 94 | 243.194 | 0 | ↓ |
| Hi High (pH 8-9.5) | 2.54 | 2.71 | -64.7 | 2 | 5 | -1 | 94 | 243.194 | 0 | ↓ |
