General Information of the Compound
| Compound ID |
CP0437302
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| Compound Name |
2-(1,4'-bipiperidin-1'-yl)-5-(3-fluorophenyl)-1,3,4-thiadiazole
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| Structure |
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| Formula |
C18H23FN4S
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| Molecular Weight |
346.475
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| Canonical SMILES |
Fc1cccc(c1)-c1nnc(s1)N1CCC(CC1)N1CCCCC1
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| InChI |
InChI=1S/C18H23FN4S/c19-15-6-4-5-14(13-15)17-20-21-18(24-17)23-11-7-16(8-12-23)22-9-2-1-3-10-22/h4-6,13,16H,1-3,7-12H2
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| InChIKey |
QWQXDPOPCOPVHV-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