| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 30th, 2008 | 21 | No |
Popular Name: (2E,5S)-5-benzyl-2-[(6-methyl-2-pyridyl)imino]thiazolidin-4-one (2E,5S)-5-benzyl-2-[(6-methyl-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) | 2.36 | 8.85 | -7.62 | 1 | 4 | 0 | 54 | 297.383 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.36 | 8.06 | -42.67 | 0 | 4 | -1 | 56 | 296.375 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.36 | 8.69 | -28.96 | 2 | 4 | 1 | 56 | 298.391 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.36 | 8.28 | -29.83 | 2 | 4 | 1 | 56 | 298.391 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.54 | 8.94 | -15.04 | 1 | 4 | 0 | 58 | 297.383 | 3 | ↓ |
