| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 5th, 2011 | 24 | Yes |
Popular Name: 1-(8-butanoyl-5,7-dihydroxy-2,2-dimethyl-chroman-6-yl)butan-1-one 1-(8-butanoyl-5,7-dihydroxy-2,2-…
| 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) | 4.56 | 8.21 | -14.12 | 2 | 5 | 0 | 84 | 334.412 | 6 | ↓ |
| Hi High (pH 8-9.5) | 4.56 | 9.89 | -115.78 | 0 | 5 | -2 | 89 | 332.396 | 6 | ↓ |
| Hi High (pH 8-9.5) | 4.56 | 8.83 | -38 | 1 | 5 | -1 | 87 | 333.404 | 6 | ↓ |
| Mid Mid (pH 6-8) | 4.56 | 8.87 | -37.14 | 1 | 5 | -1 | 87 | 333.404 | 6 | ↓ |
