General Information of the Compound
| Compound ID |
CP0516745
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| Compound Name |
US9422293, 22
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| Structure |
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| Formula |
C26H20F6N6
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| Molecular Weight |
530.476
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| Canonical SMILES |
FC(F)(F)c1ccc(Nc2nc(nc3CCN(CCc23)c2ncccc2C(F)(F)F)-c2ccccc2)nc1
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| InChI |
InChI=1S/C26H20F6N6/c27-25(28,29)17-8-9-21(34-15-17)36-23-18-10-13-38(24-19(26(30,31)32)7-4-12-33-24)14-11-20(18)35-22(37-23)16-5-2-1-3-6-16/h1-9,12,15H,10-11,13-14H2,(H,34,35,36,37)
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| InChIKey |
KJVGFSFONFFRFN-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