In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 25th, 2009 | 18 | Yes |
Popular Name: Ethyl 3-methyl-5-oxo-1-phenyl-4,5-dihydro-1H-pyrazole-4-carboxylate Ethyl 3-methyl-5-oxo-1-phenyl-4,…
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CAS Number: 29711-06-6
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) | 1.47 | 6.57 | -16.58 | 1 | 5 | 0 | 64 | 246.266 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.92 | 6.29 | -13.57 | 1 | 5 | 0 | 64 | 246.266 | 4 | ↓ |