General Information of the Compound
| Compound ID |
CP0552650
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| Compound Name |
5-methyl-4-(3-piperidin-1-ylpropoxy)-2-pyridin-4-yl-1,3-thiazole
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| Structure |
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| Formula |
C17H23N3OS
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| Molecular Weight |
317.458
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| Canonical SMILES |
Cc1sc(nc1OCCCN1CCCCC1)-c1ccncc1
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| InChI |
InChI=1S/C17H23N3OS/c1-14-16(19-17(22-14)15-6-8-18-9-7-15)21-13-5-12-20-10-3-2-4-11-20/h6-9H,2-5,10-13H2,1H3
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| InChIKey |
GPGSUYXBQJXNIB-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