General Information of the Compound
| Compound ID |
CP0011590
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| Compound Name |
4-chloro-N-[1-(4-chlorobenzoyl)-2,6-dimethyl-3,4-dihydro-2H-quinolin-4-yl]-N-(4-methylphenyl)benzamide
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| Structure |
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| Formula |
C32H28Cl2N2O2
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| Molecular Weight |
543.494
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| Canonical SMILES |
CC1CC(N(C(=O)c2ccc(Cl)cc2)c2ccc(C)cc2)c2cc(C)ccc2N1C(=O)c1ccc(Cl)cc1
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| InChI |
InChI=1S/C32H28Cl2N2O2/c1-20-4-15-27(16-5-20)36(32(38)24-9-13-26(34)14-10-24)30-19-22(3)35(29-17-6-21(2)18-28(29)30)31(37)23-7-11-25(33)12-8-23/h4-18,22,30H,19H2,1-3H3
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| InChIKey |
KKFIHBYZXIPSHA-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: PT00632, Ecdysone receptor
Protein ID: PT06098, Ecdysone receptor
Cell Viability or Cytotoxicity Assay