General Information of the Compound
| Compound ID |
CP0448350
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| Compound Name |
(2,5-diphenyl-1,3-thiazol-4-yl) pentanoate
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| Structure |
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| Formula |
C20H19NO2S
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| Molecular Weight |
337.444
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| Canonical SMILES |
CCCCC(=O)Oc1nc(sc1-c1ccccc1)-c1ccccc1
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| InChI |
InChI=1S/C20H19NO2S/c1-2-3-14-17(22)23-19-18(15-10-6-4-7-11-15)24-20(21-19)16-12-8-5-9-13-16/h4-13H,2-3,14H2,1H3
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| InChIKey |
CRNNZIGNOAZMCQ-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