In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 28th, 2008 | 37 | No |
Popular Name: [(2Z)-2-[(2,3-dimethoxyphenyl)methylene]-6-hydroxy-3-oxo-benzofuran-7-yl]methylBLAHone [(2Z)-2-[(2,3-dimethoxyphenyl)me…
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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) | 3.27 | 11.89 | -51.88 | 1 | 8 | 0 | 98 | 500.551 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.27 | 9.65 | -57.58 | 0 | 8 | -1 | 97 | 499.543 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.27 | 9.01 | -20.05 | 1 | 8 | 0 | 94 | 500.551 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.27 | 11.27 | -65.04 | 2 | 8 | 1 | 95 | 501.559 | 5 | ↓ |