General Information of the Compound
| Compound ID |
CP0526071
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| Compound Name |
US9422293, 271
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| Structure |
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| Formula |
C26H26F6N6O2
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| Molecular Weight |
568.522
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| Canonical SMILES |
OCC1CN(CCO1)c1nc2CCN(CCc2c(Nc2ccc(cc2)C(F)(F)F)n1)c1ncccc1C(F)(F)F
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| InChI |
InChI=1S/C26H26F6N6O2/c27-25(28,29)16-3-5-17(6-4-16)34-22-19-7-10-37(23-20(26(30,31)32)2-1-9-33-23)11-8-21(19)35-24(36-22)38-12-13-40-18(14-38)15-39/h1-6,9,18,39H,7-8,10-15H2,(H,34,35,36)
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| InChIKey |
OIFCGYNNTOHQSG-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