| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2008 | 28 | No |
Popular Name: (5E)-2-(4-benzylpiperazin-1-yl)-5-[(2,4-dihydroxyphenyl)methylene]thiazol-4-one (5E)-2-(4-benzylpiperazin-1-yl)-…
| 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) | 2.99 | 3.43 | -15.97 | 2 | 6 | 0 | 77 | 395.484 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.99 | 4.2 | -51.42 | 1 | 6 | -1 | 80 | 394.476 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.99 | 5.64 | -60.03 | 3 | 6 | 1 | 78 | 396.492 | 4 | ↓ |
