General Information of the Compound
| Compound ID |
CP0389435
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| Compound Name |
N-[(S)-quinolin-3-yl-[3-(trifluoromethyl)pyridin-2-yl]methyl]quinoline-7-carboxamide
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| Structure |
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| Formula |
C26H17F3N4O
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| Molecular Weight |
458.443
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| Canonical SMILES |
FC(F)(F)c1cccnc1[C@@H](NC(=O)c1ccc2cccnc2c1)c1cnc2ccccc2c1
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| InChI |
InChI=1S/C26H17F3N4O/c27-26(28,29)20-7-4-12-31-24(20)23(19-13-17-5-1-2-8-21(17)32-15-19)33-25(34)18-10-9-16-6-3-11-30-22(16)14-18/h1-15,23H,(H,33,34)/t23-/m0/s1
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| InChIKey |
OQMUUPUIIMBEPA-QHCPKHFHSA-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