General Information of the Compound
| Compound ID |
CP0529098
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| Compound Name |
N-methyl-N-octyl-5-(phenylsulfamoyl)-2,3-dihydroindole-1-carboxamide
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| Structure |
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| Formula |
C24H33N3O3S
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| Molecular Weight |
443.613
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| Canonical SMILES |
CCCCCCCCN(C)C(=O)N1CCc2cc(ccc12)S(=O)(=O)Nc1ccccc1
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| InChI |
InChI=1S/C24H33N3O3S/c1-3-4-5-6-7-11-17-26(2)24(28)27-18-16-20-19-22(14-15-23(20)27)31(29,30)25-21-12-9-8-10-13-21/h8-10,12-15,19,25H,3-7,11,16-18H2,1-2H3
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| InChIKey |
LUBDEAGTLSVIAU-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: PT01179, Beta-1 adrenergic receptor
Protein ID: PT01494, Beta-2 adrenergic receptor
Protein ID: PT01493, Beta-3 adrenergic receptor