General Information of the Compound
| Compound ID |
CP0958625
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| Compound Name |
N-(3,5-bis(trifluoromethyl)phenyl)-1'-(2,6-dimethylphenyl)-5'-oxo-1,3'-bipyrrolidine-3'-carboxamide
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| Structure |
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| Formula |
C25H25F6N3O2
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| Molecular Weight |
513.482
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| Canonical SMILES |
Cc1cccc(C)c1N1CC(C(=O)Nc2cc(C(F)(F)F)cc(C(F)(F)F)c2)(N2CCCC2)CC1=O
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| InChI |
InChI=1S/C25H25F6N3O2/c1-15-6-5-7-16(2)21(15)34-14-23(13-20(34)35,33-8-3-4-9-33)22(36)32-19-11-17(24(26,27)28)10-18(12-19)25(29,30)31/h5-7,10-12H,3-4,8-9,13-14H2,1-2H3,(H,32,36)
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| InChIKey |
CFOBPVBLJGIEKW-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