| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 14th, 2010 | 34 | No |
Popular Name: [2-(4-methylanilino)-2-oxo-ethyl]-trioxo-(2-thienyl)BLAHcarboxamide [2-(4-methylanilino)-2-oxo-ethyl…
| 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) | 2.09 | 8.31 | -20.41 | 3 | 9 | 0 | 132 | 514.61 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.84 | 6.93 | -54.71 | 2 | 9 | -1 | 135 | 513.602 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.84 | 6.58 | -54.68 | 2 | 9 | -1 | 135 | 513.602 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.84 | 6.67 | -54.68 | 2 | 9 | -1 | 135 | 513.602 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.84 | 6.78 | -64.63 | 2 | 9 | -1 | 135 | 513.602 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.84 | 6.85 | -65.06 | 2 | 9 | -1 | 135 | 513.602 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.84 | 6.64 | -58.52 | 2 | 9 | -1 | 135 | 513.602 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.84 | 6.71 | -58.57 | 2 | 9 | -1 | 135 | 513.602 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.84 | 6.85 | -54.82 | 2 | 9 | -1 | 135 | 513.602 | 5 | ↓ |
