| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 1st, 2009 | 26 | No |
Popular Name: (5E)-5-(5-bromo-2-oxo-indolin-3-ylidene)-2-(2,3-dimethylanilino)thiazol-4-one (5E)-5-(5-bromo-2-oxo-indolin-3-…
| 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) | 5.50 | 9.18 | -48.4 | 1 | 5 | -1 | 77 | 427.303 | 2 | ↓ |
| Mid Mid (pH 6-8) | 6.45 | 7.79 | -45.76 | 1 | 5 | -1 | 81 | 427.303 | 1 | ↓ |
| Mid Mid (pH 6-8) | 6.45 | 8 | -52.83 | 1 | 5 | -1 | 81 | 427.303 | 1 | ↓ |
| Mid Mid (pH 6-8) | 6.91 | 6.24 | -117.67 | 0 | 5 | -2 | 84 | 426.295 | 1 | ↓ |
| Mid Mid (pH 6-8) | 5.96 | 7.4 | -111.49 | 0 | 5 | -2 | 80 | 426.295 | 2 | ↓ |
| Mid Mid (pH 6-8) | 6.45 | 7.49 | -46.18 | 1 | 5 | -1 | 81 | 427.303 | 1 | ↓ |
| Mid Mid (pH 6-8) | 6.45 | 7.5 | -53.76 | 1 | 5 | -1 | 81 | 427.303 | 1 | ↓ |
| Mid Mid (pH 6-8) | 6.91 | 5.74 | -118.75 | 0 | 5 | -2 | 84 | 426.295 | 1 | ↓ |
