| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 5th, 2010 | 11 | No |
Popular Name: 2-Cyclohexen-1-one, 3-hydroxy-2-methoxy-5-methyl- (9CI) 2-Cyclohexen-1-one, 3-hydroxy-2-…
Find On: PubMed — Wikipedia — Google
CAS Number: 478618-95-0
| 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) | -0.19 | 4.65 | -41.37 | 0 | 3 | -1 | 49 | 155.173 | 1 | ↓ |
| Lo Low (pH 4.5-6) | -0.19 | 2.9 | -8.98 | 1 | 3 | 0 | 47 | 156.181 | 1 | ↓ |
| Lo Low (pH 4.5-6) | -0.19 | 2.91 | -8.91 | 1 | 3 | 0 | 47 | 156.181 | 1 | ↓ |
| Lo Low (pH 4.5-6) | -0.23 | 2.66 | -6.81 | 0 | 3 | 0 | 43 | 156.181 | 1 | ↓ |
