General Information of the Compound
| Compound ID |
CP0533236
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| Compound Name |
N-[3-[(6-chloro-1,3-dioxoisoindol-5-yl)amino]phenyl]-3-(trifluoromethyl)benzamide
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| Structure |
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| Formula |
C22H13ClF3N3O3
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| Molecular Weight |
459.811
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| Canonical SMILES |
FC(F)(F)c1cccc(c1)C(=O)Nc1cccc(Nc2cc3C(=O)NC(=O)c3cc2Cl)c1
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| InChI |
InChI=1S/C22H13ClF3N3O3/c23-17-9-15-16(21(32)29-20(15)31)10-18(17)27-13-5-2-6-14(8-13)28-19(30)11-3-1-4-12(7-11)22(24,25)26/h1-10,27H,(H,28,30)(H,29,31,32)
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| InChIKey |
LMWCSKRGOYUZCO-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