| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 5th, 2006 | 23 | Yes |
Popular Name: 2-(4,6-diaminopyrimidin-2-yl)sulfanyl-N-(4-tert-butylphenyl)-acetamide 2-(4,6-diaminopyrimidin-2-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) | 3.43 | 5.04 | -12.77 | 5 | 6 | 0 | 107 | 331.445 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 3.43 | 5.61 | -106.68 | 7 | 6 | 2 | 109 | 333.461 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 3.43 | 5.31 | -39.4 | 6 | 6 | 1 | 108 | 332.453 | 5 | ↓ |
