General Information of the Compound
| Compound ID |
CP0853831
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| Compound Name |
[7-(2-amino-ethyl)-3-benzenesulfonyl-5-methyl-pyrazolo-[1,5-a]pyrimidin-2-yl]-methyl-amine
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| Structure |
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| Formula |
C16H19N5O2S
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| Molecular Weight |
345.428
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| Canonical SMILES |
CNc1nn2c(CCN)cc(C)nc2c1S(=O)(=O)c1ccccc1
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| InChI |
InChI=1S/C16H19N5O2S/c1-11-10-12(8-9-17)21-16(19-11)14(15(18-2)20-21)24(22,23)13-6-4-3-5-7-13/h3-7,10H,8-9,17H2,1-2H3,(H,18,20)
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| InChIKey |
YQQXAJIXOUQTMW-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