General Information of the Compound
| Compound ID |
CP0947383
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| Compound Name |
1-(2-allyl-6-methylphenyl)-N-(3,5-bis(trifluoromethyl)phenyl)-3-isopropyl-5-oxopyrrolidine-3-carboxamide
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| Structure |
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| Formula |
C26H26F6N2O2
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| Molecular Weight |
512.494
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| Canonical SMILES |
C=CCc1cccc(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/C26H26F6N2O2/c1-5-7-17-9-6-8-16(4)22(17)34-14-24(15(2)3,13-21(34)35)23(36)33-20-11-18(25(27,28)29)10-19(12-20)26(30,31)32/h5-6,8-12,15H,1,7,13-14H2,2-4H3,(H,33,36)
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| InChIKey |
XFGJEDYAWHEEMM-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