General Information of the Compound
| Compound ID |
CP0495334
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| Compound Name |
N-(2-chloro-5-fluorophenyl)-2-(3,5-dimethylpyrazol-1-yl)-6-methylpyrimidin-4-amine
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| Structure |
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| Formula |
C16H15ClFN5
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| Molecular Weight |
331.782
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| Canonical SMILES |
Cc1cc(C)n(n1)-c1nc(C)cc(Nc2cc(F)ccc2Cl)n1
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| InChI |
InChI=1S/C16H15ClFN5/c1-9-7-15(20-14-8-12(18)4-5-13(14)17)21-16(19-9)23-11(3)6-10(2)22-23/h4-8H,1-3H3,(H,19,20,21)
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| InChIKey |
RJKGYBOMYOKJJV-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