General Information of the Compound
| Compound ID |
CP0475987
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| Compound Name |
3-(4-methoxyphenyl)sulfonyl-N,5,7-trimethylpyrazolo[1,5-a]pyrimidin-2-amine
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| Structure |
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| Formula |
C16H18N4O3S
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| Molecular Weight |
346.412
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| Canonical SMILES |
CNc1nn2c(C)cc(C)nc2c1S(=O)(=O)c1ccc(OC)cc1
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| InChI |
InChI=1S/C16H18N4O3S/c1-10-9-11(2)20-16(18-10)14(15(17-3)19-20)24(21,22)13-7-5-12(23-4)6-8-13/h5-9H,1-4H3,(H,17,19)
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| InChIKey |
XEKXWUDGXMEULY-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