General Information of the Compound
| Compound ID |
CP0568825
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| Compound Name |
N-(1,3-benzothiazol-5-yl)-1-(6-chloropyridin-3-yl)sulfonylpiperidine-4-carboxamide
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| Structure |
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| Formula |
C18H17ClN4O3S2
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| Molecular Weight |
436.946
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| Canonical SMILES |
Clc1ccc(cn1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1ccc2scnc2c1
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| InChI |
InChI=1S/C18H17ClN4O3S2/c19-17-4-2-14(10-20-17)28(25,26)23-7-5-12(6-8-23)18(24)22-13-1-3-16-15(9-13)21-11-27-16/h1-4,9-12H,5-8H2,(H,22,24)
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| InChIKey |
CRDVYCHPBMFHGT-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