In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 1st, 2009 | 19 | Yes |
Popular Name: 1-(2,4-dimethylphenyl)-1H,4H,5H,6H-cyclopenta[c]pyrazole-3-carboxylic acid 1-(2,4-dimethylphenyl)-1H,4H,5H,…
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CAS Number: 1152535-85-7
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) | 3.17 | 9.76 | -62.12 | 0 | 4 | -1 | 58 | 255.297 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 198 - 200 | Enamine Building Blocks |
MP | 198...200 | Enamine Building Blocks |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |