General Information of the Compound
| Compound ID |
CP0463389
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| Compound Name |
4-Methyl-benzo[1,3]dioxole-5-carboxylic acid [1-(3,5-dimethyl-benzoyl)-cyclohexyl]-amide
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| Structure |
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| Formula |
C24H27NO4
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| Molecular Weight |
393.483
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| Canonical SMILES |
Cc1cc(C)cc(c1)C(=O)C1(CCCCC1)NC(=O)c1ccc2OCOc2c1C
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| InChI |
InChI=1S/C24H27NO4/c1-15-11-16(2)13-18(12-15)22(26)24(9-5-4-6-10-24)25-23(27)19-7-8-20-21(17(19)3)29-14-28-20/h7-8,11-13H,4-6,9-10,14H2,1-3H3,(H,25,27)
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| InChIKey |
FEUFKYIMDJWZJV-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: PT00618, Ecdysone receptor
Protein ID: PT06098, Ecdysone receptor