General Information of the Compound
| Compound ID |
CP0465800
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| Compound Name |
US9422293, 209
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| Structure |
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| Formula |
C23H21F6N5O2S
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| Molecular Weight |
545.509
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| Canonical SMILES |
Cc1cc(ccc1Nc1nc(nc2CCN(CCc12)c1ncccc1C(F)(F)F)S(C)(=O)=O)C(F)(F)F
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| InChI |
InChI=1S/C23H21F6N5O2S/c1-13-12-14(22(24,25)26)5-6-17(13)31-19-15-7-10-34(20-16(23(27,28)29)4-3-9-30-20)11-8-18(15)32-21(33-19)37(2,35)36/h3-6,9,12H,7-8,10-11H2,1-2H3,(H,31,32,33)
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| InChIKey |
QFHGHRRWFOPAJA-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: PT01914, Transient receptor potential cation channel subfamily V member 1
Protein ID: PT02183, Transient receptor potential cation channel subfamily V member 1