General Information of the Compound
| Compound ID |
CP0457559
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| Compound Name |
4-(2-((R)-2-oxo-5-(4-phenylpenta-1,3-dienyl)pyrrolidin-1-yl)ethyl)benzoic acid
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| Structure |
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| Formula |
C24H25NO3
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| Molecular Weight |
375.468
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| Canonical SMILES |
C\C(=C/C=C/[C@H]1CCC(=O)N1CCc1ccc(cc1)C(O)=O)c1ccccc1
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| InChI |
InChI=1S/C24H25NO3/c1-18(20-7-3-2-4-8-20)6-5-9-22-14-15-23(26)25(22)17-16-19-10-12-21(13-11-19)24(27)28/h2-13,22H,14-17H2,1H3,(H,27,28)/b9-5+,18-6+/t22-/m0/s1
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| InChIKey |
OVWCEHQXEOKSBR-IZJUNRQYSA-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: PT00948, Prostaglandin E2 receptor EP2 subtype
Protein ID: PT01534, Prostaglandin E2 receptor EP4 subtype