In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 20th, 2010 | 28 | No |
Popular Name: (2Z)-7-methyl-2-(4-pyridylmethylene)-6-[(4-vinylphenyl)methoxy]benzofuran-3-one (2Z)-7-methyl-2-(4-pyridylmethyl…
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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) | 4.80 | 11.81 | -9.89 | 0 | 4 | 0 | 52 | 369.42 | 5 | ↓ |
Lo Low (pH 4.5-6) | 4.80 | 12.29 | -40.56 | 1 | 4 | 1 | 54 | 370.428 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.