In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 2010 | 36 | Yes |
Popular Name: [7-hydroxy-3-(2-methoxyphenyl)-2-methyl-4-oxo-chromen-8-yl]methylBLAHone [7-hydroxy-3-(2-methoxyphenyl)-2…
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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) | 3.99 | 11.76 | -62.92 | 2 | 7 | 1 | 86 | 485.56 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.99 | 12.34 | -40.15 | 1 | 7 | 0 | 89 | 484.552 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.99 | 9.61 | -24.28 | 1 | 7 | 0 | 85 | 484.552 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.