| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 11th, 2008 | 30 | Yes |
Popular Name: 2-(4-benzylpiperazin-1-yl)-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)acetamide 2-(4-benzylpiperazin-1-yl)-N-(6-…
| 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) | 2.21 | 6.66 | -53.09 | 2 | 7 | 1 | 84 | 445.59 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.02 | 5.77 | -43.97 | 1 | 7 | 0 | 90 | 444.582 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.02 | 5.73 | -60.61 | 1 | 7 | 0 | 90 | 444.582 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.21 | 4.39 | -21.52 | 1 | 7 | 0 | 83 | 444.582 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.02 | 3.46 | -50.28 | 0 | 7 | -1 | 89 | 443.574 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.21 | 6.58 | -57.02 | 2 | 7 | 1 | 84 | 445.59 | 6 | ↓ |
