| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 10th, 2006 | 18 | Yes |
Popular Name: 2-(2,6-diaminopyrimidin-4-yl)sulfanyl-2-phenyl-acetonitrile 2-(2,6-diaminopyrimidin-4-yl)sul…
| 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) | 1.73 | 6.12 | -9.35 | 4 | 5 | 0 | 102 | 257.322 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.73 | 2.78 | -32.17 | 5 | 5 | 1 | 103 | 258.33 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.73 | 6.26 | -30.02 | 5 | 5 | 1 | 103 | 258.33 | 3 | ↓ |
