General Information of the Compound
| Compound ID |
CP0544907
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| Compound Name |
7-(3-methoxyanilino)-3-methyl-2-methylsulfonylpyrazolo[1,5-a]pyrimidine-6-carboxamide
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| Structure |
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| Formula |
C16H17N5O4S
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| Molecular Weight |
375.41
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| Canonical SMILES |
COc1cccc(Nc2c(cnc3c(C)c(nn23)S(C)(=O)=O)C(N)=O)c1
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| InChI |
InChI=1S/C16H17N5O4S/c1-9-14-18-8-12(13(17)22)15(21(14)20-16(9)26(3,23)24)19-10-5-4-6-11(7-10)25-2/h4-8,19H,1-3H3,(H2,17,22)
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| InChIKey |
MOOZDAGZHYGSDK-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