In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 6th, 2005 | 15 | Yes |
Popular Name: 7-amino-2-(methylthio)[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylic acid 7-amino-2-(methylthio)[1,2,4]tri…
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CAS Numbers: 113967-71-8 , [113967-71-8]
7-Amino-2-(methylsulfanyl)[1,2,4]triazolo-[1,5-a]pyrimidine-6-carboxylic acid
7-Amino-2-(methylsulfanyl)[1,2,4]triazolo-[1,5-a]pyrimidine-6-carboxylicacid
7-amino-2-(methylsulfanyl)[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylic acid
7-Amino-2-(methylthio)-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxylic acid
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) | -0.08 | 5.34 | -37.4 | 2 | 7 | -1 | 109 | 224.225 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
melting_point | 275 | KeyOrganics |
MP | 275° | Matrix Scientific |
Purity | >95% | Matrix Scientific |
Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.