General Information of the Compound
| Compound ID |
CP0478111
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| Compound Name |
US9422293, 325
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| Structure |
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| Formula |
C27H27F6N5O
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| Molecular Weight |
551.535
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| Canonical SMILES |
CC(Oc1nc2CCN(CCc2c(Nc2ccc(cc2C)C(F)(F)F)n1)c1ncccc1C(F)(F)F)C1CC1
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| InChI |
InChI=1S/C27H27F6N5O/c1-15-14-18(26(28,29)30)7-8-21(15)35-23-19-9-12-38(24-20(27(31,32)33)4-3-11-34-24)13-10-22(19)36-25(37-23)39-16(2)17-5-6-17/h3-4,7-8,11,14,16-17H,5-6,9-10,12-13H2,1-2H3,(H,35,36,37)
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| InChIKey |
JVZZLYGCVFFRMV-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