General Information of the Compound
| Compound ID |
CP0942275
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| Compound Name |
N,N'-bis(4-fluorophenyl)-N''-(pyrimidin-4-ylmethyl)-1,3,5-triazine-2,4,6-triamine
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| Structure |
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| Formula |
C20H16F2N8
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| Molecular Weight |
406.4
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| Canonical SMILES |
Fc1ccc(Nc2nc(NCc3ccncn3)nc(Nc3ccc(F)cc3)n2)cc1
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| InChI |
InChI=1S/C20H16F2N8/c21-13-1-5-15(6-2-13)26-19-28-18(24-11-17-9-10-23-12-25-17)29-20(30-19)27-16-7-3-14(22)4-8-16/h1-10,12H,11H2,(H3,24,26,27,28,29,30)
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| InChIKey |
ATUMXVMZTWWOIR-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