In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2008 | 10 | Yes |
Popular Name: 3-Methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine 3-Methyl-5,6,7,8-tetrahydro-[1,2…
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CAS Numbers: 1260826-85-4 , 886886-04-0 , [886886-04-0]
3-Methyl-5,6,7,8-tetrahydro[1,2,4]triazolo[4,3-a]pyrazine hydrochloride
3-methyl-5H,6H,7H,8H-[1,2,4]triazolo[4,3-a]pyrazine
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) | -0.93 | 2.94 | -57.91 | 2 | 4 | 1 | 47 | 139.182 | 0 | ↓ |
Mid Mid (pH 6-8) | -0.93 | 1.51 | -11.29 | 1 | 4 | 0 | 43 | 138.174 | 0 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
Purity | 95% | Fluorochem |
Purity | >95% | Matrix Scientific |
Warnings | IRRITANT | Matrix Scientific |