| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 21st, 2010 | 30 | Yes |
Popular Name: (3-acetyl-7-hydroxy-2-oxo-chromen-8-yl)methylBLAHone (3-acetyl-7-hydroxy-2-oxo-chrome…
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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) | 2.06 | 9.71 | -62.7 | 2 | 7 | 1 | 94 | 407.446 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.06 | 8.1 | -43.03 | 0 | 7 | -1 | 96 | 405.43 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.06 | 10.24 | -31.11 | 1 | 7 | 0 | 97 | 406.438 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.06 | 7.56 | -27.97 | 1 | 7 | 0 | 93 | 406.438 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
