General Information of the Compound
| Compound ID |
CP0895259
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| Compound Name |
5-(4-{2-[2-(2-Ethoxy-ethoxy)-ethoxy]-ethoxy}-[1,2,5]thiadiazol-3-yl)-1-methyl-1,2,3,6-tetrahydro-pyridine hydrochloride
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| Structure |
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| Formula |
C16H28ClN3O4S
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| Molecular Weight |
393.937
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| Canonical SMILES |
CCOCCOCCOCCOc1nsnc1C1=CCCN(C)C1.Cl
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| InChI |
InChI=1S/C16H27N3O4S.ClH/c1-3-20-7-8-21-9-10-22-11-12-23-16-15(17-24-18-16)14-5-4-6-19(2)13-14;/h5H,3-4,6-13H2,1-2H3;1H
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| InChIKey |
XFADLLPVYYOQBX-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