General Information of the Compound
| Compound ID |
CP0963005
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| Compound Name |
3-(benzyloxymethyl)-N-(3,5-bis(trifluoromethyl)phenyl)-1-(2,6-dimethylphenyl)-5-oxopyrrolidine-3-carboxamide
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| Structure |
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| Formula |
C29H26F6N2O3
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| Molecular Weight |
564.526
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| Canonical SMILES |
Cc1cccc(C)c1N1CC(COCc2ccccc2)(C(=O)Nc2cc(C(F)(F)F)cc(C(F)(F)F)c2)CC1=O
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| InChI |
InChI=1S/C29H26F6N2O3/c1-18-7-6-8-19(2)25(18)37-16-27(14-24(37)38,17-40-15-20-9-4-3-5-10-20)26(39)36-23-12-21(28(30,31)32)11-22(13-23)29(33,34)35/h3-13H,14-17H2,1-2H3,(H,36,39)
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| InChIKey |
VDKYZSKQJYUIFV-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