General Information of the Compound
| Compound ID |
CP0213694
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| Compound Name |
methyl 3-[4-[[3-(2,6-dichlorophenyl)-5-propan-2-yl-1,2-oxazol-4-yl]methoxy]phenyl]benzoate
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| Structure |
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| Formula |
C27H23Cl2NO4
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| Molecular Weight |
496.39
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| Canonical SMILES |
COC(=O)c1cccc(c1)-c1ccc(OCc2c(onc2-c2c(Cl)cccc2Cl)C(C)C)cc1
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| InChI |
InChI=1S/C27H23Cl2NO4/c1-16(2)26-21(25(30-34-26)24-22(28)8-5-9-23(24)29)15-33-20-12-10-17(11-13-20)18-6-4-7-19(14-18)27(31)32-3/h4-14,16H,15H2,1-3H3
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| InChIKey |
RHVBKJAWIAEAHW-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