General Information of the Compound
| Compound ID |
CP0524656
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| Compound Name |
N-(5-chloro-1,3-thiazol-2-yl)-4-(3-cyanophenoxy)butanamide
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| Structure |
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| Formula |
C14H12ClN3O2S
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| Molecular Weight |
321.789
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| Canonical SMILES |
Clc1cnc(NC(=O)CCCOc2cccc(c2)C#N)s1
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| InChI |
InChI=1S/C14H12ClN3O2S/c15-12-9-17-14(21-12)18-13(19)5-2-6-20-11-4-1-3-10(7-11)8-16/h1,3-4,7,9H,2,5-6H2,(H,17,18,19)
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| InChIKey |
WGAOZIPKIWBDEM-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