General Information of the Compound
| Compound ID |
CP0166225
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| Compound Name |
4-[2-(4-fluorophenyl)-6-methylpyrazolo[1,5-a]pyridazin-3-yl]-N-[3-(trifluoromethyl)phenyl]pyrimidin-2-amine
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| Structure |
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| Formula |
C24H16F4N6
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| Molecular Weight |
464.426
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| Canonical SMILES |
Cc1ccc2c(c(nn2n1)-c1ccc(F)cc1)-c1ccnc(Nc2cccc(c2)C(F)(F)F)n1
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| InChI |
InChI=1S/C24H16F4N6/c1-14-5-10-20-21(22(33-34(20)32-14)15-6-8-17(25)9-7-15)19-11-12-29-23(31-19)30-18-4-2-3-16(13-18)24(26,27)28/h2-13H,1H3,(H,29,30,31)
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| InChIKey |
TWQUOUJLNRGSRZ-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