General Information of the Compound
| Compound ID |
CP0412617
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| Compound Name |
US9186360, 17
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| Structure |
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| Formula |
C23H22N4O3S
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| Molecular Weight |
434.521
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| Canonical SMILES |
CCc1ccc(cc1)-c1csc(NC(=O)Cc2cccc3n(C)c(=O)n(C)c(=O)c23)n1
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| InChI |
InChI=1S/C23H22N4O3S/c1-4-14-8-10-15(11-9-14)17-13-31-22(24-17)25-19(28)12-16-6-5-7-18-20(16)21(29)27(3)23(30)26(18)2/h5-11,13H,4,12H2,1-3H3,(H,24,25,28)
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| InChIKey |
KFPIBSJOVPWQQT-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: PT02149, Transient receptor potential cation channel subfamily A member 1
Protein ID: PT03065, Transient receptor potential cation channel subfamily M member 8
Protein ID: PT02183, Transient receptor potential cation channel subfamily V member 1
Protein ID: PT04494, Transient receptor potential cation channel subfamily V member 3
Protein ID: PT03081, Transient receptor potential cation channel subfamily V member 4