General Information of the Compound
| Compound ID |
CP0391250
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| Compound Name |
N-tert-butyl-2-chloro-N'-(4-methoxybenzoyl)-3,5-dimethylbenzohydrazide
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| Structure |
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| Formula |
C21H25ClN2O3
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| Molecular Weight |
388.895
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| Canonical SMILES |
COc1ccc(cc1)C(=O)NN(C(=O)c1cc(C)cc(C)c1Cl)C(C)(C)C
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| InChI |
InChI=1S/C21H25ClN2O3/c1-13-11-14(2)18(22)17(12-13)20(26)24(21(3,4)5)23-19(25)15-7-9-16(27-6)10-8-15/h7-12H,1-6H3,(H,23,25)
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| InChIKey |
IHHGYIAMYMBJEN-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
Protein ID: PT06098, Ecdysone receptor
Protein ID: PT00632, Ecdysone receptor