General Information of the Compound
| Compound ID |
CP0430866
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| Compound Name |
2-Chloro-6-methyl-pyrimidine-4-carboxylic acid (3,5-bis-trifluoromethyl-phenyl)-amide
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| Structure |
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| Formula |
C14H8ClF6N3O
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| Molecular Weight |
383.679
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| Canonical SMILES |
Cc1cc(nc(Cl)n1)C(=O)Nc1cc(cc(c1)C(F)(F)F)C(F)(F)F
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| InChI |
InChI=1S/C14H8ClF6N3O/c1-6-2-10(24-12(15)22-6)11(25)23-9-4-7(13(16,17)18)3-8(5-9)14(19,20)21/h2-5H,1H3,(H,23,25)
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| InChIKey |
WOYJTHBPOAICKQ-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