General Information of the Compound
| Compound ID |
CP0455212
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| Compound Name |
5-[3-fluoro-4-(trifluoromethyl)phenyl]-N-[(2R)-1-hydroxybutan-2-yl]-4-(hydroxymethyl)-1,2-oxazole-3-carboxamide
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| Structure |
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| Formula |
C16H16F4N2O4
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| Molecular Weight |
376.306
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| Canonical SMILES |
CC[C@H](CO)NC(=O)c1noc(c1CO)-c1ccc(c(F)c1)C(F)(F)F
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| InChI |
InChI=1S/C16H16F4N2O4/c1-2-9(6-23)21-15(25)13-10(7-24)14(26-22-13)8-3-4-11(12(17)5-8)16(18,19)20/h3-5,9,23-24H,2,6-7H2,1H3,(H,21,25)/t9-/m1/s1
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| InChIKey |
VTKFNIGSZMDOSC-SECBINFHSA-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