General Information of the Compound
| Compound ID |
CP0853828
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| Compound Name |
[7-(2-Dimethylamino-ethyl)-5-methyl-3-phenylsulfonylpyrazolo[1,5-a]pyrimidin-2-yl]-methyl-amine
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| Structure |
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| Formula |
C18H23N5O2S
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| Molecular Weight |
373.482
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| Canonical SMILES |
CNc1nn2c(CCN(C)C)cc(C)nc2c1S(=O)(=O)c1ccccc1
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| InChI |
InChI=1S/C18H23N5O2S/c1-13-12-14(10-11-22(3)4)23-18(20-13)16(17(19-2)21-23)26(24,25)15-8-6-5-7-9-15/h5-9,12H,10-11H2,1-4H3,(H,19,21)
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| InChIKey |
VOZZCVHFQBTLIB-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