In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2005 | 14 | Yes |
Popular Name: 1-butyl-5-chloro-3-methyl-1H-pyrazole-4-carboxylic acid 1-butyl-5-chloro-3-methyl-1H-pyr…
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CAS Number: 956573-62-9
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) | 2.35 | 6.14 | -44.89 | 0 | 4 | -1 | 58 | 215.66 | 4 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
purity | 9.500000000000000e+001 | Enamine Building Blocks |
MP | 94 - 98 | Enamine Building Blocks |
purity | 95 | Enamine Building Blocks |
MP | 95 - 97 | Enamine Building Blocks |
MP | 95...97 | Enamine Building Blocks |