General Information of the Compound
| Compound ID |
CP0480252
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| Compound Name |
5-chloro-2-N-pyrimidin-5-yl-4-N-[3-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine
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| Formula |
C15H10ClF3N6
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| Molecular Weight |
366.734
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| Canonical SMILES |
FC(F)(F)c1cccc(Nc2nc(Nc3cncnc3)ncc2Cl)c1
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| InChI |
InChI=1S/C15H10ClF3N6/c16-12-7-22-14(24-11-5-20-8-21-6-11)25-13(12)23-10-3-1-2-9(4-10)15(17,18)19/h1-8H,(H2,22,23,24,25)
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| InChIKey |
FHUDSNATRGHUNK-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