General Information of the Compound
| Compound ID |
CP0400651
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| Compound Name |
2-(4-chloro-1,3-thiazol-2-yl)-N-(oxan-4-ylmethyl)benzamide
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| Structure |
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| Formula |
C16H17ClN2O2S
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| Molecular Weight |
336.844
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| Canonical SMILES |
Clc1csc(n1)-c1ccccc1C(=O)NCC1CCOCC1
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| InChI |
InChI=1S/C16H17ClN2O2S/c17-14-10-22-16(19-14)13-4-2-1-3-12(13)15(20)18-9-11-5-7-21-8-6-11/h1-4,10-11H,5-9H2,(H,18,20)
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| InChIKey |
OSZVNHDVASPQDS-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