| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 10th, 2006 | 21 | No |
Popular Name: 6-hydroxy-5-[(1-hydroxy-2-naphthyl)methylene]-2-sulfanyl-pyrimidin-4-one 6-hydroxy-5-[(1-hydroxy-2-naphth…
| 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) | 1.99 | 1.94 | -42.06 | 2 | 5 | -1 | 89 | 297.315 | 1 | ↓ |
| Hi High (pH 8-9.5) | 1.99 | 2.72 | -96.54 | 1 | 5 | -2 | 92 | 296.307 | 1 | ↓ |
| Hi High (pH 8-9.5) | 1.99 | 2.49 | -97.6 | 1 | 5 | -2 | 92 | 296.307 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 1.99 | 1.71 | -42.5 | 2 | 5 | -1 | 89 | 297.315 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 1.53 | 3.71 | -9.89 | 3 | 5 | 0 | 86 | 298.323 | 1 | ↓ |
