General Information of the Compound
| Compound ID |
CP0532359
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| Compound Name |
N-tert-butyl-4-[[6-(4-propylsulfonylpiperazin-1-yl)pyridin-3-yl]oxymethyl]piperidine-1-carboxamide
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| Structure |
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| Formula |
C23H39N5O4S
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| Molecular Weight |
481.663
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| Canonical SMILES |
CCCS(=O)(=O)N1CCN(CC1)c1ccc(OCC2CCN(CC2)C(=O)NC(C)(C)C)cn1
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| InChI |
InChI=1S/C23H39N5O4S/c1-5-16-33(30,31)28-14-12-26(13-15-28)21-7-6-20(17-24-21)32-18-19-8-10-27(11-9-19)22(29)25-23(2,3)4/h6-7,17,19H,5,8-16,18H2,1-4H3,(H,25,29)
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| InChIKey |
KFTQZCZUPNYDBE-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