General Information of the Compound
| Compound ID |
CP0515884
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| Compound Name |
5-[4-methoxy-3-[(4-methoxyphenyl)methoxy]phenyl]-4,4-dimethyl-2-propan-2-ylpyrazol-3-one
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| Structure |
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| Formula |
C23H28N2O4
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| Molecular Weight |
396.487
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| Canonical SMILES |
COc1ccc(COc2cc(ccc2OC)C2=NN(C(C)C)C(=O)C2(C)C)cc1
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| InChI |
InChI=1S/C23H28N2O4/c1-15(2)25-22(26)23(3,4)21(24-25)17-9-12-19(28-6)20(13-17)29-14-16-7-10-18(27-5)11-8-16/h7-13,15H,14H2,1-6H3
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| InChIKey |
WCHMRSWODZYIHF-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