General Information of the Compound
| Compound ID |
CP0571133
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| Compound Name |
4-N-(3-chlorophenyl)-6-(3,5-dimethylpyrazol-1-yl)pyrimidine-2,4-diamine
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| Structure |
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| Formula |
C15H15ClN6
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| Molecular Weight |
314.78
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| Canonical SMILES |
Cc1cc(C)n(n1)-c1cc(Nc2cccc(Cl)c2)nc(N)n1
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| InChI |
InChI=1S/C15H15ClN6/c1-9-6-10(2)22(21-9)14-8-13(19-15(17)20-14)18-12-5-3-4-11(16)7-12/h3-8H,1-2H3,(H3,17,18,19,20)
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| InChIKey |
WKORTUOTAZLKMS-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