General Information of the Compound
| Compound ID |
CP0551495
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| Compound Name |
N-(cyclobutylmethyl)-N-(4-ethylphenyl)-2-(oxan-4-yl)-4-oxo-2,3-dihydrochromene-6-sulfonamide
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| Structure |
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| Formula |
C27H33NO5S
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| Molecular Weight |
483.63
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| Canonical SMILES |
CCc1ccc(cc1)N(CC1CCC1)S(=O)(=O)c1ccc2OC(CC(=O)c2c1)C1CCOCC1
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| InChI |
InChI=1S/C27H33NO5S/c1-2-19-6-8-22(9-7-19)28(18-20-4-3-5-20)34(30,31)23-10-11-26-24(16-23)25(29)17-27(33-26)21-12-14-32-15-13-21/h6-11,16,20-21,27H,2-5,12-15,17-18H2,1H3
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| InChIKey |
IOMXQWLFMWBLTD-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