General Information of the Compound
| Compound ID |
CP0444909
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| Compound Name |
US9422293, 317
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| Structure |
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| Formula |
C26H25F6N5O3S
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| Molecular Weight |
601.573
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| Canonical SMILES |
CC(Oc1nc2CCN(CCc2c(Nc2ccc(cc2)S(=O)(=O)C(F)(F)F)n1)c1ncccc1C(F)(F)F)C1CC1
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| InChI |
InChI=1S/C26H25F6N5O3S/c1-15(16-4-5-16)40-24-35-21-11-14-37(23-20(25(27,28)29)3-2-12-33-23)13-10-19(21)22(36-24)34-17-6-8-18(9-7-17)41(38,39)26(30,31)32/h2-3,6-9,12,15-16H,4-5,10-11,13-14H2,1H3,(H,34,35,36)
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| InChIKey |
RSCUUJRGPQOMJT-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