General Information of the Compound
| Compound ID |
CP0536001
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| Compound Name |
US9422293, 203
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| Structure |
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| Formula |
C22H18ClF6N5S
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| Molecular Weight |
533.929
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| Canonical SMILES |
CSc1nc2CCN(CCc2c(Nc2ccc(cc2Cl)C(F)(F)F)n1)c1ncccc1C(F)(F)F
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| InChI |
InChI=1S/C22H18ClF6N5S/c1-35-20-32-16-7-10-34(19-14(22(27,28)29)3-2-8-30-19)9-6-13(16)18(33-20)31-17-5-4-12(11-15(17)23)21(24,25)26/h2-5,8,11H,6-7,9-10H2,1H3,(H,31,32,33)
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| InChIKey |
PFWKPJYQOCYCOU-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