General Information of the Compound
| Compound ID |
CP0527003
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| Compound Name |
4-Chloro-3'-((1-oxo-2-(4-(trifluoromethoxy)benzyl)isoindolin-5-yloxy)methyl)biphenyl-3-carboxylic Acid
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| Structure |
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| Formula |
C30H21ClF3NO4
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| Molecular Weight |
551.948
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| Canonical SMILES |
OC(=O)c1cc(ccc1Cl)-c1cccc(COc2ccc3C(=O)N(Cc4ccc(cc4)C(F)(F)F)Cc3c2)c1
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| InChI |
InChI=1S/C30H21ClF3NO4/c31-27-11-6-21(14-26(27)29(37)38)20-3-1-2-19(12-20)17-39-24-9-10-25-22(13-24)16-35(28(25)36)15-18-4-7-23(8-5-18)30(32,33)34/h1-14H,15-17H2,(H,37,38)
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| InChIKey |
UWTLBJDYPAUTTF-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