General Information of the Compound
| Compound ID |
CP0568385
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| Compound Name |
N-(1,2-benzothiazol-5-yl)-N-[(5-chloro-1-methylimidazol-2-yl)methyl]acetamide
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| Formula |
C14H13ClN4OS
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| Molecular Weight |
320.805
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| Canonical SMILES |
CC(=O)N(Cc1ncc(Cl)n1C)c1ccc2sncc2c1
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| InChI |
InChI=1S/C14H13ClN4OS/c1-9(20)19(8-14-16-7-13(15)18(14)2)11-3-4-12-10(5-11)6-17-21-12/h3-7H,8H2,1-2H3
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| InChIKey |
XWFSGNBBXQZLJK-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