In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 7th, 2009 | 13 | Yes |
Popular Name: 3-tert-butyl-1-methyl-1H-pyrazole-4-carboxylic acid 3-tert-butyl-1-methyl-1H-pyrazol…
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CAS Number: 1152548-57-6
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) | 1.83 | 4.03 | -48.05 | 0 | 4 | -1 | 58 | 181.215 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 140 - 142 | Enamine Building Blocks |
MP | 140...142 | Enamine Building Blocks |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |