General Information of the Compound
| Compound ID |
CP0408350
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| Compound Name |
2-(benzenesulfonyl)-7-(3-methoxyanilino)-3-methylpyrazolo[1,5-a]pyrimidine-6-carboxamide
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| Structure |
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| Formula |
C21H19N5O4S
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| Molecular Weight |
437.481
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| Canonical SMILES |
COc1cccc(Nc2c(cnc3c(C)c(nn23)S(=O)(=O)c2ccccc2)C(N)=O)c1
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| InChI |
InChI=1S/C21H19N5O4S/c1-13-19-23-12-17(18(22)27)20(24-14-7-6-8-15(11-14)30-2)26(19)25-21(13)31(28,29)16-9-4-3-5-10-16/h3-12,24H,1-2H3,(H2,22,27)
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| InChIKey |
RRKOMNZJZUGUEB-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