In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 19th, 2011 | 20 | Yes |
Popular Name: 1-(8-acetyl-5,7-dihydroxy-2,2-dimethyl-chroman-6-yl)ethanone 1-(8-acetyl-5,7-dihydroxy-2,2-di…
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) | 2.43 | 2.81 | -50.09 | 1 | 5 | -1 | 87 | 277.296 | 2 | ↓ |
Hi High (pH 8-9.5) | 2.43 | 3.61 | -123.41 | 0 | 5 | -2 | 89 | 276.288 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.43 | 3.64 | -11.49 | 2 | 5 | 0 | 84 | 278.304 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.43 | 4.37 | -45.52 | 1 | 5 | -1 | 87 | 277.296 | 2 | ↓ |