General Information of the Compound
| Compound ID |
CP0478470
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| Compound Name |
4-Chloro-3'-((2-isopentyl-1-oxoisoindolin-5-yloxy)methyl)biphenyl-3-carboxylic Acid
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| Structure |
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| Formula |
C27H26ClNO4
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| Molecular Weight |
463.961
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| Canonical SMILES |
CC(C)CCN1Cc2cc(OCc3cccc(c3)-c3ccc(Cl)c(c3)C(O)=O)ccc2C1=O
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| InChI |
InChI=1S/C27H26ClNO4/c1-17(2)10-11-29-15-21-13-22(7-8-23(21)26(29)30)33-16-18-4-3-5-19(12-18)20-6-9-25(28)24(14-20)27(31)32/h3-9,12-14,17H,10-11,15-16H2,1-2H3,(H,31,32)
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| InChIKey |
IMHMIERAXZPLJV-UHFFFAOYSA-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