General Information of the Compound
| Compound ID |
CP0928928
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| Compound Name |
4-(2-(1,3-dioxoisoindolin-2-yl)thiazol-4-yl)benzonitrile
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| Structure |
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| Formula |
C18H9N3O2S
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| Molecular Weight |
331.356
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| Canonical SMILES |
N#Cc1ccc(-c2csc(N3C(=O)c4ccccc4C3=O)n2)cc1
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| InChI |
InChI=1S/C18H9N3O2S/c19-9-11-5-7-12(8-6-11)15-10-24-18(20-15)21-16(22)13-3-1-2-4-14(13)17(21)23/h1-8,10H
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| InChIKey |
DSGFCOABPWEAKE-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