General Information of the Compound
| Compound ID |
CP0496640
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| Compound Name |
1-Methyl-5-(4-pentyloxy-[1,2,5]thiadiazol-3-yl)-1,2,3,6-tetrahydro-pyridine
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| Structure |
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| Formula |
C13H21N3OS
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| Molecular Weight |
267.398
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| Canonical SMILES |
CCCCCOc1nsnc1C1=CCCN(C)C1
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| InChI |
InChI=1S/C13H21N3OS/c1-3-4-5-9-17-13-12(14-18-15-13)11-7-6-8-16(2)10-11/h7H,3-6,8-10H2,1-2H3
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| InChIKey |
JJWIFEIHNQNTLK-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