General Information of the Compound
| Compound ID |
CP0464526
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| Compound Name |
(R)-4-(2-(2-(4-methylpenta-1,3-dienyl)-5-oxopyrrolidin-1-yl)ethyl)benzoic acid
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| Structure |
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| Formula |
C19H23NO3
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| Molecular Weight |
313.397
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| Canonical SMILES |
CC(C)=C\C=C\[C@H]1CCC(=O)N1CCc1ccc(cc1)C(O)=O
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| InChI |
InChI=1S/C19H23NO3/c1-14(2)4-3-5-17-10-11-18(21)20(17)13-12-15-6-8-16(9-7-15)19(22)23/h3-9,17H,10-13H2,1-2H3,(H,22,23)/b5-3+/t17-/m0/s1
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| InChIKey |
HHOFHJTWHYKKJJ-RCFWFJCLSA-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