General Information of the Compound
Compound ID |
CP0862409
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Compound Name |
N-(3,5-bis(trifluoromethyl)phenyl)-1-(2-(ethoxymethyl)-6-methylphenyl)-3-isopropyl-5-oxopyrrolidine-3-carboxamide
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Structure |
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Formula |
C26H28F6N2O3
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Molecular Weight |
530.509
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Canonical SMILES |
CCOCc1cccc(C)c1N1CC(C(=O)Nc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(C(C)C)CC1=O
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InChI |
InChI=1S/C26H28F6N2O3/c1-5-37-13-17-8-6-7-16(4)22(17)34-14-24(15(2)3,12-21(34)35)23(36)33-20-10-18(25(27,28)29)9-19(11-20)26(30,31)32/h6-11,15H,5,12-14H2,1-4H3,(H,33,36)
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InChIKey |
XTILZEVYAIFEKT-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