General Information of the Compound
| Compound ID |
CP0379198
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| Compound Name |
N-benzyl-N-ethyl-1-pyridin-4-ylsulfonylpiperidine-4-carboxamide
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| Structure |
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| Formula |
C20H25N3O3S
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| Molecular Weight |
387.505
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| Canonical SMILES |
CCN(Cc1ccccc1)C(=O)C1CCN(CC1)S(=O)(=O)c1ccncc1
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| InChI |
InChI=1S/C20H25N3O3S/c1-2-22(16-17-6-4-3-5-7-17)20(24)18-10-14-23(15-11-18)27(25,26)19-8-12-21-13-9-19/h3-9,12-13,18H,2,10-11,14-16H2,1H3
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| InChIKey |
NZBQIRBBHQQEPV-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