General Information of the Compound
| Compound ID |
CP0559392
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| Compound Name |
3-(4-Fluoro-phenyl)-2-(4-methanesulfonyl-phenyl)-5,6,7-trimethyl-pyrazolo[1,5-a]pyrimidine
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| Structure |
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| Formula |
C22H20FN3O2S
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| Molecular Weight |
409.486
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| Canonical SMILES |
Cc1nc2c(c(nn2c(C)c1C)-c1ccc(cc1)S(C)(=O)=O)-c1ccc(F)cc1
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| InChI |
InChI=1S/C22H20FN3O2S/c1-13-14(2)24-22-20(16-5-9-18(23)10-6-16)21(25-26(22)15(13)3)17-7-11-19(12-8-17)29(4,27)28/h5-12H,1-4H3
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| InChIKey |
SUZXNODIMMRFSK-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