General Information of the Compound
| Compound ID |
CP0005748
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| Compound Name |
N-[3-(3,5-dimethylbenzoyl)pentan-3-yl]-4-ethylbenzamide
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| Structure |
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| Formula |
C23H29NO2
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| Molecular Weight |
351.49
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| Canonical SMILES |
CCc1ccc(cc1)C(=O)NC(CC)(CC)C(=O)c1cc(C)cc(C)c1
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| InChI |
InChI=1S/C23H29NO2/c1-6-18-9-11-19(12-10-18)22(26)24-23(7-2,8-3)21(25)20-14-16(4)13-17(5)15-20/h9-15H,6-8H2,1-5H3,(H,24,26)
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| InChIKey |
NOPSQZLYKMXQNR-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