General Information of the Compound
Compound ID |
CP0492309
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Compound Name |
N-[2-[3,5-bis(trifluoromethyl)phenyl]ethyl]-N-methyl-3,3-diphenylpropanamide
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Structure |
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Formula |
C26H23F6NO
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Molecular Weight |
479.464
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Canonical SMILES |
CN(CCc1cc(cc(c1)C(F)(F)F)C(F)(F)F)C(=O)CC(c1ccccc1)c1ccccc1
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InChI |
InChI=1S/C26H23F6NO/c1-33(13-12-18-14-21(25(27,28)29)16-22(15-18)26(30,31)32)24(34)17-23(19-8-4-2-5-9-19)20-10-6-3-7-11-20/h2-11,14-16,23H,12-13,17H2,1H3
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InChIKey |
ZBUHIKOFVVSCIC-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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ChEMBL ID |
Map of Molecular Bioactivity Related to the Compound
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