General Information of the Compound
| Compound ID |
CP0488889
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| Compound Name |
3-cyano-5-fluoro-N-(6-(trifluoromethyl)pyridin-2-yl)benzamide
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| Structure |
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| Formula |
C14H7F4N3O
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| Molecular Weight |
309.222
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| Canonical SMILES |
Fc1cc(cc(c1)C(=O)Nc1cccc(n1)C(F)(F)F)C#N
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| InChI |
InChI=1S/C14H7F4N3O/c15-10-5-8(7-19)4-9(6-10)13(22)21-12-3-1-2-11(20-12)14(16,17)18/h1-6H,(H,20,21,22)
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| InChIKey |
CCTMTFUWMFQSOX-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