General Information of the Compound
| Compound ID |
CP0381099
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| Compound Name |
N,N-dimethyl-3-[2-methylsulfonyl-6-(trifluoromethyl)pyrimidin-4-yl]benzamide
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| Structure |
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| Formula |
C15H14F3N3O3S
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| Molecular Weight |
373.356
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| Canonical SMILES |
CN(C)C(=O)c1cccc(c1)-c1cc(nc(n1)S(C)(=O)=O)C(F)(F)F
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| InChI |
InChI=1S/C15H14F3N3O3S/c1-21(2)13(22)10-6-4-5-9(7-10)11-8-12(15(16,17)18)20-14(19-11)25(3,23)24/h4-8H,1-3H3
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| InChIKey |
YZEHQPBQVRGHKU-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