General Information of the Compound
| Compound ID |
CP0476725
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| Compound Name |
N-[(S)-cyclohexyl-[3-(trifluoromethyl)pyridin-2-yl]methyl]quinoline-7-carboxamide
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| Structure |
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| Formula |
C23H22F3N3O
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| Molecular Weight |
413.443
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| Canonical SMILES |
FC(F)(F)c1cccnc1[C@@H](NC(=O)c1ccc2cccnc2c1)C1CCCCC1
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| InChI |
InChI=1S/C23H22F3N3O/c24-23(25,26)18-9-5-13-28-21(18)20(16-6-2-1-3-7-16)29-22(30)17-11-10-15-8-4-12-27-19(15)14-17/h4-5,8-14,16,20H,1-3,6-7H2,(H,29,30)/t20-/m0/s1
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| InChIKey |
DOEXTLXGOPNKQP-FQEVSTJZSA-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
Protein ID: PT03065, Transient receptor potential cation channel subfamily M member 8
Protein ID: PT06117, Transient receptor potential cation channel subfamily M member 8