General Information of the Compound
| Compound ID |
CP0488542
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| Compound Name |
N-cyclobutyl-N-(2,4-dimethylphenyl)-2-(oxan-4-yl)-4-oxo-2,3-dihydrochromene-6-sulfonamide
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| Structure |
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| Formula |
C26H31NO5S
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| Molecular Weight |
469.603
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| Canonical SMILES |
Cc1ccc(N(C2CCC2)S(=O)(=O)c2ccc3OC(CC(=O)c3c2)C2CCOCC2)c(C)c1
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| InChI |
InChI=1S/C26H31NO5S/c1-17-6-8-23(18(2)14-17)27(20-4-3-5-20)33(29,30)21-7-9-25-22(15-21)24(28)16-26(32-25)19-10-12-31-13-11-19/h6-9,14-15,19-20,26H,3-5,10-13,16H2,1-2H3
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| InChIKey |
TYUBIUXHZBTYJM-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