General Information of the Compound
| Compound ID |
CP0404585
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| Compound Name |
3-[2-[3-(2-phenylmethoxyphenyl)phenyl]phenyl]-N-thiophen-2-ylsulfonylpropanamide
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| Structure |
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| Formula |
C32H27NO4S2
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| Molecular Weight |
553.705
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| Canonical SMILES |
O=C(CCc1ccccc1-c1cccc(c1)-c1ccccc1OCc1ccccc1)NS(=O)(=O)c1cccs1
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| InChI |
InChI=1S/C32H27NO4S2/c34-31(33-39(35,36)32-18-9-21-38-32)20-19-25-12-4-5-15-28(25)26-13-8-14-27(22-26)29-16-6-7-17-30(29)37-23-24-10-2-1-3-11-24/h1-18,21-22H,19-20,23H2,(H,33,34)
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| InChIKey |
CPNNNLVYEXESBV-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: PT01205, Prostaglandin E2 receptor EP1 subtype
Protein ID: PT00948, Prostaglandin E2 receptor EP2 subtype
Protein ID: PT01367, Prostaglandin E2 receptor EP3 subtype
Protein ID: PT01534, Prostaglandin E2 receptor EP4 subtype