General Information of the Compound
| Compound ID |
CP0552649
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| Compound Name |
N,N-dimethyl-3-[(5-methyl-2-pyridin-4-yl-1,3-thiazol-4-yl)oxy]propan-1-amine
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| Structure |
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| Formula |
C14H19N3OS
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| Molecular Weight |
277.393
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| Canonical SMILES |
CN(C)CCCOc1nc(sc1C)-c1ccncc1
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| InChI |
InChI=1S/C14H19N3OS/c1-11-13(18-10-4-9-17(2)3)16-14(19-11)12-5-7-15-8-6-12/h5-8H,4,9-10H2,1-3H3
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| InChIKey |
XLYSEJAKCUCQGH-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