General Information of the Compound
| Compound ID |
CP0515196
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| Compound Name |
US9422293, 89
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| Structure |
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| Formula |
C25H28F3N5O2S
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| Molecular Weight |
519.593
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| Canonical SMILES |
CC(C)c1nc2CCN(CCc2c(Nc2ccc(cc2)C(F)(F)F)n1)c1ccccc1NS(C)(=O)=O
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| InChI |
InChI=1S/C25H28F3N5O2S/c1-16(2)23-30-20-13-15-33(22-7-5-4-6-21(22)32-36(3,34)35)14-12-19(20)24(31-23)29-18-10-8-17(9-11-18)25(26,27)28/h4-11,16,32H,12-15H2,1-3H3,(H,29,30,31)
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| InChIKey |
VCIDLFZYHBUOJH-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