General Information of the Compound
| Compound ID |
CP0444270
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| Compound Name |
1-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-4-yl]propan-2-yl 5-methylsulfonyl-2,3-dihydroindole-1-carboxylate
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| Structure |
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| Formula |
C23H34N2O6S
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| Molecular Weight |
466.6
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| Canonical SMILES |
CC(CC1CCN(CC1)C(=O)OC(C)(C)C)OC(=O)N1CCc2cc(ccc12)S(C)(=O)=O
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| InChI |
InChI=1S/C23H34N2O6S/c1-16(14-17-8-11-24(12-9-17)21(26)31-23(2,3)4)30-22(27)25-13-10-18-15-19(32(5,28)29)6-7-20(18)25/h6-7,15-17H,8-14H2,1-5H3
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| InChIKey |
ZVYHMOBLENEFNW-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