| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 20th, 2010 | 22 | No |
Popular Name: 6-hydroxy-2-isopropylidene-7-[(4-methylpiperazin-1-yl)methyl]benzofuran-3-one 6-hydroxy-2-isopropylidene-7-[(4…
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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) | 2.05 | 4.91 | -42.44 | 2 | 5 | 1 | 58 | 303.382 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.05 | 3.11 | -41.55 | 0 | 5 | -1 | 60 | 301.366 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.05 | 5.49 | -47.6 | 1 | 5 | 0 | 61 | 302.374 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.05 | 2.54 | -7.75 | 1 | 5 | 0 | 57 | 302.374 | 2 | ↓ |
