| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 24th, 2012 | 20 | No |
Popular Name: 1-[[butyl(ethyl)amino]methyl]-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-thione 1-[[butyl(ethyl)amino]methyl]-5,…
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| 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) | 2.39 | 11.89 | -55.87 | 1 | 5 | 1 | 40 | 294.448 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.39 | 10.04 | -24.93 | 0 | 5 | 0 | 38 | 293.44 | 6 | ↓ |
