General Information of the Compound
| Compound ID |
CP0410057
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| Compound Name |
2-(1,4'-bipiperidin-1'-yl)-5-(pyridin-2-yl)-1,3,4-thiadiazole
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| Structure |
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| Formula |
C17H23N5S
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| Molecular Weight |
329.473
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| Canonical SMILES |
C1CCN(CC1)C1CCN(CC1)c1nnc(s1)-c1ccccn1
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| InChI |
InChI=1S/C17H23N5S/c1-4-10-21(11-5-1)14-7-12-22(13-8-14)17-20-19-16(23-17)15-6-2-3-9-18-15/h2-3,6,9,14H,1,4-5,7-8,10-13H2
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| InChIKey |
NATSPRZIXNJQOL-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