| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 25th, 2007 | 22 | Yes |
Popular Name: 2-(4,6-diaminopyrimidin-2-yl)sulfanyl-N-(3-isopropylphenyl)-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) | 3.21 | -5.07 | -13.17 | 5 | 6 | 0 | 107 | 317.418 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 3.21 | -4.86 | -32.69 | 6 | 6 | 1 | 108 | 318.426 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 3.21 | -4.67 | -106.79 | 7 | 6 | 2 | 109 | 319.434 | 5 | ↓ |
