General Information of the Compound
| Compound ID |
CP0847240
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| Compound Name |
5-{(R)-1-[4-(1-Hydroxy-2-phenyl-ethyl)-phenyl]-5-oxo-pyrrolidin-2-ylmethoxymethyl}-furan-2-carboxylic acid
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| Structure |
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| Formula |
C25H25NO6
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| Molecular Weight |
435.476
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| Canonical SMILES |
O=C(O)c1ccc(COC[C@H]2CCC(=O)N2c2ccc(C(O)Cc3ccccc3)cc2)o1
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| InChI |
InChI=1S/C25H25NO6/c27-22(14-17-4-2-1-3-5-17)18-6-8-19(9-7-18)26-20(10-13-24(26)28)15-31-16-21-11-12-23(32-21)25(29)30/h1-9,11-12,20,22,27H,10,13-16H2,(H,29,30)/t20-,22?/m1/s1
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| InChIKey |
UAXKGIZARLQFTR-PSDZMVHGSA-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