General Information of the Compound
| Compound ID |
CP0542271
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| Compound Name |
US9422293, 213
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| Structure |
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| Formula |
C24H24F6N6O
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| Molecular Weight |
526.485
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| Canonical SMILES |
COCCNc1nc2CCN(CCc2c(Nc2ccc(cc2)C(F)(F)F)n1)c1ncccc1C(F)(F)F
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| InChI |
InChI=1S/C24H24F6N6O/c1-37-14-11-32-22-34-19-9-13-36(21-18(24(28,29)30)3-2-10-31-21)12-8-17(19)20(35-22)33-16-6-4-15(5-7-16)23(25,26)27/h2-7,10H,8-9,11-14H2,1H3,(H2,32,33,34,35)
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| InChIKey |
MSVQYLQJVHJBKW-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
Protein ID: PT01914, Transient receptor potential cation channel subfamily V member 1
Protein ID: PT02183, Transient receptor potential cation channel subfamily V member 1