General Information of the Compound
| Compound ID |
CP0431366
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| Compound Name |
N-[2-(3,5-dimethylpyrazol-1-yl)-6-(3-methylphenyl)pyrimidin-4-yl]acetamide
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| Structure |
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| Formula |
C18H19N5O
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| Molecular Weight |
321.384
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| Canonical SMILES |
CC(=O)Nc1cc(nc(n1)-n1nc(C)cc1C)-c1cccc(C)c1
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| InChI |
InChI=1S/C18H19N5O/c1-11-6-5-7-15(8-11)16-10-17(19-14(4)24)21-18(20-16)23-13(3)9-12(2)22-23/h5-10H,1-4H3,(H,19,20,21,24)
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| InChIKey |
XVIGYFVDOGOBDS-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