General Information of the Compound
| Compound ID |
CP0437738
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| Compound Name |
N-(benzenesulfonyl)-2-methyl-2-[4-[2-(4-phenyldiazenylphenoxy)ethyl]phenoxy]propanamide
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| Formula |
C30H29N3O5S
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| Molecular Weight |
543.645
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| Canonical SMILES |
CC(C)(Oc1ccc(CCOc2ccc(cc2)\N=N\c2ccccc2)cc1)C(=O)NS(=O)(=O)c1ccccc1
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| InChI |
InChI=1S/C30H29N3O5S/c1-30(2,29(34)33-39(35,36)28-11-7-4-8-12-28)38-27-17-13-23(14-18-27)21-22-37-26-19-15-25(16-20-26)32-31-24-9-5-3-6-10-24/h3-20H,21-22H2,1-2H3,(H,33,34)/b32-31+
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| InChIKey |
YJXJWPIHVCCSOE-QNEJGDQOSA-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: PT00910, Peroxisome proliferator-activated receptor alpha
Protein ID: PT00915, Peroxisome proliferator-activated receptor gamma