| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 26th, 2010 | 13 | Yes |
Popular Name: N-[2-(1-methylimidazol-2-yl)sulfanylethyl]propan-2-amine N-[2-(1-methylimidazol-2-yl)sulf…
| 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) | 1.37 | 5.59 | -39.25 | 2 | 3 | 1 | 34 | 200.331 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.37 | 4.38 | -6.47 | 1 | 3 | 0 | 30 | 199.323 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.37 | 6.07 | -88.86 | 3 | 3 | 2 | 36 | 201.339 | 5 | ↓ |
