| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 12th, 2008 | 17 | Yes |
Popular Name: 4-[(4-methyl-6-oxo-3H-pyrimidin-2-yl)sulfanyl]benzonitrile 4-[(4-methyl-6-oxo-3H-pyrimidin-…
| 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) | 2.11 | 5.71 | -12.71 | 1 | 4 | 0 | 70 | 243.291 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.56 | 4.86 | -40.09 | 0 | 4 | -1 | 73 | 242.283 | 2 | ↓ |
| Mid Mid (pH 6-8) | 2.10 | 5.21 | -21.56 | 1 | 4 | 0 | 70 | 243.291 | 2 | ↓ |
