General Information of the Compound
| Compound ID |
CP0967335
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| Compound Name |
N-(2-amino-2-oxoethyl)-3-((2-chloro-4-(trifluoromethyl)phenoxy)methyl)benzamide
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| Structure |
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| Formula |
C17H14ClF3N2O3
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| Molecular Weight |
386.757
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| Canonical SMILES |
NC(=O)CNC(=O)c1cccc(COc2ccc(C(F)(F)F)cc2Cl)c1
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| InChI |
InChI=1S/C17H14ClF3N2O3/c18-13-7-12(17(19,20)21)4-5-14(13)26-9-10-2-1-3-11(6-10)16(25)23-8-15(22)24/h1-7H,8-9H2,(H2,22,24)(H,23,25)
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| InChIKey |
NSBASVCICIIERT-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