General Information of the Compound
| Compound ID |
CP0523989
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| Compound Name |
2-(1,4'-bipiperidin-1'-yl)-5-phenyl-1,3,4-thiadiazole
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| Structure |
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| Formula |
C18H24N4S
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| Molecular Weight |
328.485
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| Canonical SMILES |
C1CCN(CC1)C1CCN(CC1)c1nnc(s1)-c1ccccc1
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| InChI |
InChI=1S/C18H24N4S/c1-3-7-15(8-4-1)17-19-20-18(23-17)22-13-9-16(10-14-22)21-11-5-2-6-12-21/h1,3-4,7-8,16H,2,5-6,9-14H2
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| InChIKey |
OBLUTTUWFIBPHB-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