General Information of the Compound
| Compound ID |
CP0499622
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| Compound Name |
US9422293, 35
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| Structure |
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| Formula |
C27H24F6N6
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| Molecular Weight |
546.519
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| Canonical SMILES |
CC(C)c1nc2CCN(CCc2c(Nc2ccc(cc2)C(F)(F)F)n1)c1nc2ccccc2nc1C(F)(F)F
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| InChI |
InChI=1S/C27H24F6N6/c1-15(2)23-36-19-12-14-39(25-22(27(31,32)33)35-20-5-3-4-6-21(20)37-25)13-11-18(19)24(38-23)34-17-9-7-16(8-10-17)26(28,29)30/h3-10,15H,11-14H2,1-2H3,(H,34,36,38)
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| InChIKey |
SWKLRHXULOZEGO-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