In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 28th, 2008 | 35 | No |
Popular Name: [(2Z)-6-hydroxy-2-[(4-methoxyphenyl)methylene]-3-oxo-benzofuran-7-yl]methylBLAHone [(2Z)-6-hydroxy-2-[(4-methoxyphe…
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) | 3.51 | 11.84 | -47.26 | 1 | 7 | 0 | 89 | 470.525 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.51 | 9.59 | -58.18 | 0 | 7 | -1 | 88 | 469.517 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.51 | 8.96 | -17.81 | 1 | 7 | 0 | 85 | 470.525 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.51 | 11.22 | -58.12 | 2 | 7 | 1 | 86 | 471.533 | 4 | ↓ |