General Information of the Compound
| Compound ID |
CP0526062
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| Compound Name |
US9422293, 64
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| Structure |
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| Formula |
C24H24F6N6O
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| Molecular Weight |
526.485
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| Canonical SMILES |
COc1ccc(Nc2nc(nc3CCN(CCc23)c2ncccc2C(F)(F)F)N(C)C)cc1C(F)(F)F
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| InChI |
InChI=1S/C24H24F6N6O/c1-35(2)22-33-18-9-12-36(21-16(23(25,26)27)5-4-10-31-21)11-8-15(18)20(34-22)32-14-6-7-19(37-3)17(13-14)24(28,29)30/h4-7,10,13H,8-9,11-12H2,1-3H3,(H,32,33,34)
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| InChIKey |
PBJAFAGMRXUSRW-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