General Information of the Compound
| Compound ID |
CP0377570
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| Compound Name |
3-[[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]methyl]-1,3-benzothiazol-2-one
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| Structure |
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| Formula |
C16H10ClN3O2S
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| Molecular Weight |
343.795
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| Canonical SMILES |
Clc1cccc(c1)-c1noc(Cn2c3ccccc3sc2=O)n1
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| InChI |
InChI=1S/C16H10ClN3O2S/c17-11-5-3-4-10(8-11)15-18-14(22-19-15)9-20-12-6-1-2-7-13(12)23-16(20)21/h1-8H,9H2
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| InChIKey |
CSZVJQMMLFBGHJ-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