General Information of the Compound
| Compound ID |
CP0407450
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| Compound Name |
N-[6-[2-hydroxyethyl(methyl)amino]pyridin-3-yl]-2-[4-(trifluoromethyl)phenoxy]acetamide
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| Structure |
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| Formula |
C17H18F3N3O3
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| Molecular Weight |
369.343
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| Canonical SMILES |
CN(CCO)c1ccc(NC(=O)COc2ccc(cc2)C(F)(F)F)cn1
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| InChI |
InChI=1S/C17H18F3N3O3/c1-23(8-9-24)15-7-4-13(10-21-15)22-16(25)11-26-14-5-2-12(3-6-14)17(18,19)20/h2-7,10,24H,8-9,11H2,1H3,(H,22,25)
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| InChIKey |
FDJMFDVXCYLTLY-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