| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 10th, 2009 | 20 | Yes |
Popular Name: 3-amino-4-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanyl]benzonitrile 3-amino-4-[(4-oxo-6-propyl-1H-py…
| 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) | 2.59 | 5.28 | -11.16 | 3 | 5 | 0 | 96 | 286.36 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.05 | 3.37 | -44.96 | 2 | 5 | -1 | 99 | 285.352 | 4 | ↓ |
