General Information of the Compound
| Compound ID |
CP0108373
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| Compound Name |
7-{(R)-2-[(E)-3-(4'-Chloro-biphenyl-3-yl)-3-hydroxy-propenyl]-5-oxo-pyrrolidin-1-yl}-heptanoic acid
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| Structure |
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| Formula |
C26H30ClNO4
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| Molecular Weight |
455.982
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| Canonical SMILES |
OC(\C=C\[C@H]1CCC(=O)N1CCCCCCC(O)=O)c1cccc(c1)-c1ccc(Cl)cc1
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| InChI |
InChI=1S/C26H30ClNO4/c27-22-11-9-19(10-12-22)20-6-5-7-21(18-20)24(29)15-13-23-14-16-25(30)28(23)17-4-2-1-3-8-26(31)32/h5-7,9-13,15,18,23-24,29H,1-4,8,14,16-17H2,(H,31,32)/b15-13+/t23-,24?/m0/s1
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| InChIKey |
HMLXINXDKPDSCN-QQGWBRQSSA-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