General Information of the Compound
| Compound ID |
CP0189604
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| Compound Name |
7-{(R)-2-[(E)-3-(3'-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)-c1cccc(Cl)c1
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| InChI |
InChI=1S/C26H30ClNO4/c27-22-10-6-8-20(18-22)19-7-5-9-21(17-19)24(29)14-12-23-13-15-25(30)28(23)16-4-2-1-3-11-26(31)32/h5-10,12,14,17-18,23-24,29H,1-4,11,13,15-16H2,(H,31,32)/b14-12+/t23-,24?/m0/s1
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| InChIKey |
HWJIRHWLJWIICT-JUBFZCQHSA-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