| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 3rd, 2010 | 25 | No |
Popular Name: 1-[[benzyl(isopropyl)amino]methyl]-5,6,7-trimethyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-thione 1-[[benzyl(isopropyl)amino]methy…
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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) | 3.02 | 13.88 | -50.67 | 1 | 5 | 1 | 40 | 356.519 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.02 | 11.96 | -24.75 | 0 | 5 | 0 | 38 | 355.511 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
![1H-[1,2,4]triazolo[1,5-a]pyrimidine-2-thione](http://zinc12.docking.org/img/rings/123206.gif)
![1-[(benzylamino)methyl]-[1,2,4]triazolo[1,5-a]pyrimidine-2-thione](http://zinc12.docking.org/img/rings/123294.gif)