In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 7th, 2006 | 13 | Yes |
Popular Name: 2-(hydroxymethyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one 2-(hydroxymethyl)-5-methyl[1,2,4…
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CAS Number: 63870-38-2
2-(hydroxymethyl)-5-methyl-4H,7H-[1,2,4]triazolo[1,5-a]pyrimidin-7-one
2-(hydroxymethyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-ol
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) | -0.83 | 1.46 | -21.23 | 2 | 6 | 0 | 83 | 180.167 | 1 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 281 - 283 | Enamine Building Blocks |
MP | 281...283 | Enamine Building Blocks |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
PUBCHEM_PATENT_ID | US4987129 | IBM Patent Data |