General Information of the Compound
| Compound ID |
CP0403956
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| Compound Name |
2-[2'-(3,4-Dimethyl-isoxazol-5-ylsulfamoyl)-4-oxazol-2-yl-biphenyl-2-yl]-N,N-dimethyl-acetamide
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| Structure |
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| Formula |
C24H24N4O5S
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| Molecular Weight |
480.546
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| Canonical SMILES |
CN(C)C(=O)Cc1cc(ccc1-c1ccccc1S(=O)(=O)Nc1onc(C)c1C)-c1ncco1
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| InChI |
InChI=1S/C24H24N4O5S/c1-15-16(2)26-33-23(15)27-34(30,31)21-8-6-5-7-20(21)19-10-9-17(24-25-11-12-32-24)13-18(19)14-22(29)28(3)4/h5-13,27H,14H2,1-4H3
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| InChIKey |
LZJBWBJQATUAPH-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: PT01783, Endothelin receptor type B
Protein ID: PT01372, Endothelin-1 receptor