General Information of the Compound
| Compound ID |
CP0362572
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| Compound Name |
methyl 4-[[3-(2,6-dichlorophenyl)-5-propan-2-yl-1,2-oxazol-4-yl]methoxy]benzoate
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| Structure |
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| Formula |
C21H19Cl2NO4
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| Molecular Weight |
420.292
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| Canonical SMILES |
COC(=O)c1ccc(OCc2c(onc2-c2c(Cl)cccc2Cl)C(C)C)cc1
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| InChI |
InChI=1S/C21H19Cl2NO4/c1-12(2)20-15(11-27-14-9-7-13(8-10-14)21(25)26-3)19(24-28-20)18-16(22)5-4-6-17(18)23/h4-10,12H,11H2,1-3H3
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| InChIKey |
HNYCWNGXVBOEGR-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