In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 3rd, 2008 | 20 | Yes |
Popular Name: N-(5-methylthiazol-2-yl)-2-([1,2,4]triazolo[4,5-a]pyrimidin-3-ylsulfanyl)acetamide N-(5-methylthiazol-2-yl)-2-([1,2…
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) | 0.84 | 8.13 | -23.41 | 1 | 7 | 0 | 85 | 306.376 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.02 | 6.91 | -55.02 | 0 | 7 | -1 | 91 | 305.368 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.