General Information of the Compound
| Compound ID |
CP0267141
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| Compound Name |
4-[2-(4-fluorophenyl)pyrazolo[1,5-a]pyridazin-3-yl]-N-[3-(trifluoromethyl)phenyl]pyrimidin-2-amine
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| Structure |
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| Formula |
C23H14F4N6
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| Molecular Weight |
450.399
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| Canonical SMILES |
Fc1ccc(cc1)-c1nn2ncccc2c1-c1ccnc(Nc2cccc(c2)C(F)(F)F)n1
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| InChI |
InChI=1S/C23H14F4N6/c24-16-8-6-14(7-9-16)21-20(19-5-2-11-29-33(19)32-21)18-10-12-28-22(31-18)30-17-4-1-3-15(13-17)23(25,26)27/h1-13H,(H,28,30,31)
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| InChIKey |
UPZQSWMQDHIVQJ-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