General Information of the Compound
| Compound ID |
CP0443608
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| Compound Name |
N-[4-[6-(ethylamino)pyrimidin-4-yl]-1,3-thiazol-2-yl]-4-fluoro-N-methylbenzamide
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| Structure |
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| Formula |
C17H16FN5OS
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| Molecular Weight |
357.414
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| Canonical SMILES |
CCNc1cc(ncn1)-c1csc(n1)N(C)C(=O)c1ccc(F)cc1
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| InChI |
InChI=1S/C17H16FN5OS/c1-3-19-15-8-13(20-10-21-15)14-9-25-17(22-14)23(2)16(24)11-4-6-12(18)7-5-11/h4-10H,3H2,1-2H3,(H,19,20,21)
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| InChIKey |
VIMZQOMKOLTMJN-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
Protein ID: PT01994, Metabotropic glutamate receptor 1
Protein ID: PT00854, Metabotropic glutamate receptor 5