General Information of the Compound
| Compound ID |
CP0578212
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| Compound Name |
4-N-(3-chloro-4-fluorophenyl)-6-(3,5-dimethylpyrazol-1-yl)pyrimidine-2,4-diamine
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| Structure |
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| Formula |
C15H14ClFN6
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| Molecular Weight |
332.77
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| Canonical SMILES |
Cc1cc(C)n(n1)-c1cc(Nc2ccc(F)c(Cl)c2)nc(N)n1
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| InChI |
InChI=1S/C15H14ClFN6/c1-8-5-9(2)23(22-8)14-7-13(20-15(18)21-14)19-10-3-4-12(17)11(16)6-10/h3-7H,1-2H3,(H3,18,19,20,21)
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| InChIKey |
ADEJDCHMTWJEJA-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