General Information of the Compound
| Compound ID |
CP0495315
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| Compound Name |
US9422293, 87
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| Structure |
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| Formula |
C24H25F3N6O2
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| Molecular Weight |
486.498
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| Canonical SMILES |
CC(C)c1nc2CCN(CCc2c(Nc2ccc(cc2)C(F)(F)F)n1)c1ncc(cc1C)[N+]([O-])=O
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| InChI |
InChI=1S/C24H25F3N6O2/c1-14(2)21-30-20-9-11-32(23-15(3)12-18(13-28-23)33(34)35)10-8-19(20)22(31-21)29-17-6-4-16(5-7-17)24(25,26)27/h4-7,12-14H,8-11H2,1-3H3,(H,29,30,31)
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| InChIKey |
RSAZQLBLGVJNJC-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