General Information of the Compound
| Compound ID |
CP0571732
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| Compound Name |
1-(2-methoxy-5-methylphenyl)-2-(4-methylphenyl)-N-(2-methylquinolin-5-yl)sulfonylcyclopropane-1-carboxamide
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| Structure |
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| Formula |
C29H28N2O4S
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| Molecular Weight |
500.62
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| Canonical SMILES |
COc1ccc(C)cc1C1(CC1c1ccc(C)cc1)C(=O)NS(=O)(=O)c1cccc2nc(C)ccc12
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| InChI |
InChI=1S/C29H28N2O4S/c1-18-8-12-21(13-9-18)24-17-29(24,23-16-19(2)10-15-26(23)35-4)28(32)31-36(33,34)27-7-5-6-25-22(27)14-11-20(3)30-25/h5-16,24H,17H2,1-4H3,(H,31,32)
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| InChIKey |
UHGWSSDCGQVTTI-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