General Information of the Compound
| Compound ID |
CP0452439
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| Compound Name |
N'-benzoyl-N-tert-butyl-2,3,4-trichlorobenzohydrazide
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| Structure |
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| Formula |
C18H17Cl3N2O2
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| Molecular Weight |
399.705
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| Canonical SMILES |
CC(C)(C)N(NC(=O)c1ccccc1)C(=O)c1ccc(Cl)c(Cl)c1Cl
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| InChI |
InChI=1S/C18H17Cl3N2O2/c1-18(2,3)23(22-16(24)11-7-5-4-6-8-11)17(25)12-9-10-13(19)15(21)14(12)20/h4-10H,1-3H3,(H,22,24)
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| InChIKey |
AMGIERNTMSYGFH-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