General Information of the Compound
| Compound ID |
CP0474050
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| Compound Name |
1-phenyl-3-[4-(2-piperidin-1-ylethoxy)phenyl]sulfonylurea
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| Structure |
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| Formula |
C20H25N3O4S
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| Molecular Weight |
403.504
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| Canonical SMILES |
O=C(Nc1ccccc1)NS(=O)(=O)c1ccc(OCCN2CCCCC2)cc1
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| InChI |
InChI=1S/C20H25N3O4S/c24-20(21-17-7-3-1-4-8-17)22-28(25,26)19-11-9-18(10-12-19)27-16-15-23-13-5-2-6-14-23/h1,3-4,7-12H,2,5-6,13-16H2,(H2,21,22,24)
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| InChIKey |
IJEPZAMOGHEOQY-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: PT01194, Histamine H3 receptor
Protein ID: PT00897, Potassium voltage-gated channel subfamily H member 2