| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 20th, 2010 | 23 | No |
Popular Name: 7-[(4-ethylpiperazin-1-yl)methyl]-6-hydroxy-2-isopropylidene-benzofuran-3-one 7-[(4-ethylpiperazin-1-yl)methyl…
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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) | 2.43 | 5.29 | -39.16 | 2 | 5 | 1 | 58 | 317.409 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.43 | 3.81 | -42.02 | 0 | 5 | -1 | 60 | 315.393 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.43 | 3.04 | -7.14 | 1 | 5 | 0 | 57 | 316.401 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.43 | 6.07 | -50.94 | 1 | 5 | 0 | 61 | 316.401 | 3 | ↓ |
