General Information of the Compound
| Compound ID |
CP0479621
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| Compound Name |
US9422293, 343
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| Structure |
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| Formula |
C25H25F6N5O
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| Molecular Weight |
525.497
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| Canonical SMILES |
CCCCOc1nc2CCN(CCc2c(Nc2ccc(cc2)C(F)(F)F)n1)c1ncccc1C(F)(F)F
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| InChI |
InChI=1S/C25H25F6N5O/c1-2-3-15-37-23-34-20-11-14-36(22-19(25(29,30)31)5-4-12-32-22)13-10-18(20)21(35-23)33-17-8-6-16(7-9-17)24(26,27)28/h4-9,12H,2-3,10-11,13-15H2,1H3,(H,33,34,35)
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| InChIKey |
RJKJTQYGIKVRQY-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: PT02183, Transient receptor potential cation channel subfamily V member 1
Protein ID: PT01914, Transient receptor potential cation channel subfamily V member 1