| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 8th, 2004 | 23 | Yes |
Popular Name: N-(4-butylphenyl)-2-[(4,6-diaminopyrimidin-2-yl)thio]acetamide N-(4-butylphenyl)-2-[(4,6-diamin…
| 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) | 3.59 | -5.14 | -12.76 | 5 | 6 | 0 | 106 | 331.445 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 3.59 | -4.75 | -106.83 | 7 | 6 | 2 | 109 | 333.461 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 3.59 | -4.94 | -32.6 | 6 | 6 | 1 | 108 | 332.453 | 7 | ↓ |
