General Information of the Compound
| Compound ID |
CP0851318
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| Compound Name |
(3S,4S)-N-(3,5-bis(trifluoromethyl)phenyl)-1-(2,6-dimethylphenyl)-3,4-diethyl-5-oxopyrrolidine-3-carboxamide
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| Structure |
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| Formula |
C25H26F6N2O2
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| Molecular Weight |
500.483
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| Canonical SMILES |
CC[C@@H]1C(=O)N(c2c(C)cccc2C)C[C@@]1(CC)C(=O)Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1
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| InChI |
InChI=1S/C25H26F6N2O2/c1-5-19-21(34)33(20-14(3)8-7-9-15(20)4)13-23(19,6-2)22(35)32-18-11-16(24(26,27)28)10-17(12-18)25(29,30)31/h7-12,19H,5-6,13H2,1-4H3,(H,32,35)/t19-,23-/m1/s1
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| InChIKey |
CBVRFSBXCNLYJG-AUSIDOKSSA-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