| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 20th, 2010 | 25 | Yes |
Popular Name: 3-acetyl-7-hydroxy-8-[[4-(2-hydroxyethyl)piperazin-1-yl]methyl]chromen-2-one 3-acetyl-7-hydroxy-8-[[4-(2-hydr…
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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) | 0.80 | 2.48 | -41.53 | 3 | 7 | 1 | 95 | 347.391 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.80 | 0.74 | -38.61 | 1 | 7 | -1 | 97 | 345.375 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.80 | 2.56 | -41.53 | 3 | 7 | 1 | 95 | 347.391 | 5 | ↓ |
| Mid Mid (pH 6-8) | 0.80 | 0.22 | -12.3 | 2 | 7 | 0 | 94 | 346.383 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
