General Information of the Compound
| Compound ID |
CP0415943
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| Compound Name |
N'-tert-butyl-N'-(2-chlorobenzoyl)-5-methyl-3,4-dihydro-2H-chromene-6-carbohydrazide
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| Structure |
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| Formula |
C22H25ClN2O3
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| Molecular Weight |
400.906
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| Canonical SMILES |
Cc1c2CCCOc2ccc1C(=O)NN(C(=O)c1ccccc1Cl)C(C)(C)C
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| InChI |
InChI=1S/C22H25ClN2O3/c1-14-15-9-7-13-28-19(15)12-11-16(14)20(26)24-25(22(2,3)4)21(27)17-8-5-6-10-18(17)23/h5-6,8,10-12H,7,9,13H2,1-4H3,(H,24,26)
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| InChIKey |
NHBORXJQYDFLHV-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