| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 10th, 2010 | 20 | No |
Popular Name: 2-[[2-(4-methylpiperazin-1-yl)-2-oxo-acetyl]amino]thiophene-3-carboxamide 2-[[2-(4-methylpiperazin-1-yl)-2…
| 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) | -1.11 | -1.66 | -11.1 | 3 | 7 | 0 | 96 | 296.352 | 3 | ↓ |
| Hi High (pH 8-9.5) | -0.93 | -2.5 | -47.6 | 2 | 7 | -1 | 102 | 295.344 | 3 | ↓ |
| Mid Mid (pH 6-8) | -1.11 | 0.7 | -45.98 | 4 | 7 | 1 | 97 | 297.36 | 3 | ↓ |
