General Information of the Compound
| Compound ID |
CP0579849
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| Compound Name |
N-(1,3-benzothiazol-5-yl)-1-(6-methylpyridin-3-yl)sulfonylpiperidine-4-carboxamide
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| Structure |
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| Formula |
C19H20N4O3S2
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| Molecular Weight |
416.528
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| Canonical SMILES |
Cc1ccc(cn1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1ccc2scnc2c1
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| InChI |
InChI=1S/C19H20N4O3S2/c1-13-2-4-16(11-20-13)28(25,26)23-8-6-14(7-9-23)19(24)22-15-3-5-18-17(10-15)21-12-27-18/h2-5,10-12,14H,6-9H2,1H3,(H,22,24)
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| InChIKey |
HCCKZFKLXRZIRG-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