General Information of the Compound
| Compound ID |
CP0420136
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| Compound Name |
benzyl 5-[(2,4-difluorophenyl)sulfamoyl]-7-(2-oxopiperidin-1-yl)-2,3-dihydroindole-1-carboxylate
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| Structure |
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| Formula |
C27H25F2N3O5S
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| Molecular Weight |
541.576
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| Canonical SMILES |
Fc1ccc(NS(=O)(=O)c2cc3CCN(C(=O)OCc4ccccc4)c3c(c2)N2CCCCC2=O)c(F)c1
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| InChI |
InChI=1S/C27H25F2N3O5S/c28-20-9-10-23(22(29)15-20)30-38(35,36)21-14-19-11-13-32(27(34)37-17-18-6-2-1-3-7-18)26(19)24(16-21)31-12-5-4-8-25(31)33/h1-3,6-7,9-10,14-16,30H,4-5,8,11-13,17H2
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| InChIKey |
QGFVUUJRSFYDKK-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