General Information of the Compound
| Compound ID |
CP0534200
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| Compound Name |
5-[4-methoxy-3-[(5-methyl-1,2-oxazol-3-yl)methoxy]phenyl]-4,4-dimethyl-2-propan-2-ylpyrazol-3-one
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| Structure |
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| Formula |
C20H25N3O4
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| Molecular Weight |
371.437
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| Canonical SMILES |
COc1ccc(cc1OCc1cc(C)on1)C1=NN(C(C)C)C(=O)C1(C)C
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| InChI |
InChI=1S/C20H25N3O4/c1-12(2)23-19(24)20(4,5)18(21-23)14-7-8-16(25-6)17(10-14)26-11-15-9-13(3)27-22-15/h7-10,12H,11H2,1-6H3
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| InChIKey |
SNQYPBPLTXBKPM-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound