General Information of the Compound
| Compound ID |
CP0906652
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| Compound Name |
5-fluoro-2-(4-phenylthiazol-2-yl)isoindoline-1,3-dione
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| Structure |
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| Formula |
C17H9FN2O2S
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| Molecular Weight |
324.336
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| Canonical SMILES |
O=C1c2ccc(F)cc2C(=O)N1c1nc(-c2ccccc2)cs1
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| InChI |
InChI=1S/C17H9FN2O2S/c18-11-6-7-12-13(8-11)16(22)20(15(12)21)17-19-14(9-23-17)10-4-2-1-3-5-10/h1-9H
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| InChIKey |
IAJRTKXQNKMFNB-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