General Information of the Compound
| Compound ID |
CP0555643
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| Compound Name |
5-(3,4-dimethoxyphenyl)-2-(4-methylphenyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
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| Structure |
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| Formula |
C22H18F3N3O2
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| Molecular Weight |
413.399
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| Canonical SMILES |
COc1ccc(cc1OC)-c1cc(n2nc(cc2n1)-c1ccc(C)cc1)C(F)(F)F
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| InChI |
InChI=1S/C22H18F3N3O2/c1-13-4-6-14(7-5-13)17-12-21-26-16(11-20(22(23,24)25)28(21)27-17)15-8-9-18(29-2)19(10-15)30-3/h4-12H,1-3H3
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| InChIKey |
DGPRUIMSRMFGNY-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