General Information of the Compound
| Compound ID |
CP0482074
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| Compound Name |
7-(cyclopropylamino)-5-[6-(methylsulfonylmethyl)indol-1-yl]pyrazolo[1,5-a]pyrimidine-3-carbonitrile
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| Structure |
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| Formula |
C20H18N6O2S
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| Molecular Weight |
406.471
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| Canonical SMILES |
CS(=O)(=O)Cc1ccc2ccn(-c3cc(NC4CC4)n4ncc(C#N)c4n3)c2c1
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| InChI |
InChI=1S/C20H18N6O2S/c1-29(27,28)12-13-2-3-14-6-7-25(17(14)8-13)18-9-19(23-16-4-5-16)26-20(24-18)15(10-21)11-22-26/h2-3,6-9,11,16,23H,4-5,12H2,1H3
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| InChIKey |
PODHIPRCOHXUCL-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