General Information of the Compound
| Compound ID |
CP0524038
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| Compound Name |
7-[[4-(4,5-difluoro-2-methoxyphenyl)phenoxy]methyl]-2-(2-methoxyethyl)-1H-indazol-3-one
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| Structure |
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| Formula |
C24H22F2N2O4
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| Molecular Weight |
440.446
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| Canonical SMILES |
COCCn1[nH]c2c(COc3ccc(cc3)-c3cc(F)c(F)cc3OC)cccc2c1=O
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| InChI |
InChI=1S/C24H22F2N2O4/c1-30-11-10-28-24(29)18-5-3-4-16(23(18)27-28)14-32-17-8-6-15(7-9-17)19-12-20(25)21(26)13-22(19)31-2/h3-9,12-13,27H,10-11,14H2,1-2H3
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| InChIKey |
QMIFVVQQWBUTSF-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