General Information of the Compound
| Compound ID |
CP0579435
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| Compound Name |
2-[6-(difluoromethyl)pyridin-2-yl]-1-(2-methoxy-5-methylphenyl)-N-(2-methylquinolin-5-yl)sulfonylcyclopropane-1-carboxamide
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| Structure |
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| Formula |
C28H25F2N3O4S
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| Molecular Weight |
537.588
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| Canonical SMILES |
COc1ccc(C)cc1C1(CC1c1cccc(n1)C(F)F)C(=O)NS(=O)(=O)c1cccc2nc(C)ccc12
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| InChI |
InChI=1S/C28H25F2N3O4S/c1-16-10-13-24(37-3)19(14-16)28(15-20(28)22-7-4-8-23(32-22)26(29)30)27(34)33-38(35,36)25-9-5-6-21-18(25)12-11-17(2)31-21/h4-14,20,26H,15H2,1-3H3,(H,33,34)
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| InChIKey |
DFQBJQIHQMYWTB-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