General Information of the Compound
Compound ID |
CP0260502
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Compound Name |
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-ethylphenyl)-N-(2-methylpropyl)-4-oxo-2,3-dihydrochromene-6-sulfonamide
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Structure |
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Formula |
C26H30N2O5S
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Molecular Weight |
482.602
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Canonical SMILES |
CCc1ccc(cc1)N(CC(C)C)S(=O)(=O)c1ccc2OC(CC(=O)c2c1)c1c(C)noc1C
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InChI |
InChI=1S/C26H30N2O5S/c1-6-19-7-9-20(10-8-19)28(15-16(2)3)34(30,31)21-11-12-24-22(13-21)23(29)14-25(32-24)26-17(4)27-33-18(26)5/h7-13,16,25H,6,14-15H2,1-5H3
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InChIKey |
RLPFQWWHWNRIIA-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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PubChem ID |
Map of Molecular Bioactivity Related to the Compound
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