General Information of the Compound
| Compound ID |
CP0472401
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| Compound Name |
3-(benzenesulfonyl)-5-(methoxymethyl)-7-methyl-2-methylsulfanylpyrazolo[1,5-a]pyrimidine
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| Structure |
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| Formula |
C16H17N3O3S2
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| Molecular Weight |
363.464
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| Canonical SMILES |
COCc1cc(C)n2nc(SC)c(c2n1)S(=O)(=O)c1ccccc1
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| InChI |
InChI=1S/C16H17N3O3S2/c1-11-9-12(10-22-2)17-15-14(16(23-3)18-19(11)15)24(20,21)13-7-5-4-6-8-13/h4-9H,10H2,1-3H3
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| InChIKey |
WAWIENOYLSZDBE-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