In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 23rd, 2006 | 34 | Yes |
Popular Name: 3-[(4-ethoxyphenyl)-(4-hydroxy-2-oxo-chromen-3-yl)-methyl]-4-hydroxy-chromen-2-one 3-[(4-ethoxyphenyl)-(4-hydroxy-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) | 4.96 | 11.5 | -139.71 | 0 | 7 | -2 | 116 | 454.434 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.96 | 10.55 | -28.89 | 2 | 7 | 0 | 110 | 456.45 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.96 | 10.9 | -60.83 | 1 | 7 | -1 | 113 | 455.442 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.96 | 11.65 | -142.63 | 0 | 7 | -2 | 116 | 454.434 | 5 | ↓ |
Lo Low (pH 4.5-6) | 4.96 | 10.3 | -26.54 | 2 | 7 | 0 | 110 | 456.45 | 5 | ↓ |