General Information of the Compound
| Compound ID |
CP0526072
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| Compound Name |
US9422293, 278
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| Structure |
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| Formula |
C28H24F6N6
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| Molecular Weight |
558.53
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| Canonical SMILES |
Cc1ccccc1Nc1nc2CCN(CCc2c(Nc2ccc(cc2)C(F)(F)F)n1)c1ncccc1C(F)(F)F
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| InChI |
InChI=1S/C28H24F6N6/c1-17-5-2-3-7-22(17)37-26-38-23-13-16-40(25-21(28(32,33)34)6-4-14-35-25)15-12-20(23)24(39-26)36-19-10-8-18(9-11-19)27(29,30)31/h2-11,14H,12-13,15-16H2,1H3,(H2,36,37,38,39)
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| InChIKey |
LVYRPXGAUBOAIA-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