General Information of the Compound
| Compound ID |
CP0421635
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| Compound Name |
N-(5-nitro-1,3-thiazol-2-yl)-4-(trifluoromethyl)benzamide
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| Structure |
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| Formula |
C11H6F3N3O3S
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| Molecular Weight |
317.248
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| Canonical SMILES |
[O-][N+](=O)c1cnc(NC(=O)c2ccc(cc2)C(F)(F)F)s1
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| InChI |
InChI=1S/C11H6F3N3O3S/c12-11(13,14)7-3-1-6(2-4-7)9(18)16-10-15-5-8(21-10)17(19)20/h1-5H,(H,15,16,18)
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| InChIKey |
HKCGJKNZQDBZFT-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