General Information of the Compound
| Compound ID |
CP0384015
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| Compound Name |
1-[2-(5-Chloro-2-oxo-benzothiazol-3-yl)-acetyl]-piperidine-4-carboxylic acid decylamide
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| Structure |
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| Formula |
C25H36ClN3O3S
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| Molecular Weight |
494.101
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| Canonical SMILES |
CCCCCCCCCCNC(=O)C1CCN(CC1)C(=O)Cn1c2cc(Cl)ccc2sc1=O
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| InChI |
InChI=1S/C25H36ClN3O3S/c1-2-3-4-5-6-7-8-9-14-27-24(31)19-12-15-28(16-13-19)23(30)18-29-21-17-20(26)10-11-22(21)33-25(29)32/h10-11,17,19H,2-9,12-16,18H2,1H3,(H,27,31)
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| InChIKey |
GVWPBNKMMANINZ-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