In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 12th, 2006 | 13 | Yes |
Popular Name: 7-Methyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxylic acid 7-Methyl-[1,2,4]triazolo[1,5-a]p…
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CAS Number: 438031-05-1
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) | -0.26 | 4.84 | -64.95 | 0 | 6 | -1 | 83 | 177.143 | 1 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 240 - 242 | Enamine Building Blocks |
MP | 240...242 | Enamine Building Blocks |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
PUBCHEM_PATENT_ID | US4943567 | IBM Patent Data |