General Information of the Compound
Compound ID |
CP0961103
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Compound Name |
N-(3,5-bis(trifluoromethyl)phenyl)-3-(2,6-dimethylphenyl)-4-oxo-3-azabicyclo[3.1.0]hexane-1-carboxamide
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Structure |
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Formula |
C22H18F6N2O2
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Molecular Weight |
456.386
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Canonical SMILES |
Cc1cccc(C)c1N1CC2(C(=O)Nc3cc(C(F)(F)F)cc(C(F)(F)F)c3)CC2C1=O
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InChI |
InChI=1S/C22H18F6N2O2/c1-11-4-3-5-12(2)17(11)30-10-20(9-16(20)18(30)31)19(32)29-15-7-13(21(23,24)25)6-14(8-15)22(26,27)28/h3-8,16H,9-10H2,1-2H3,(H,29,32)
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InChIKey |
ZBJHASNTCSERML-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