General Information of the Compound
| Compound ID |
CP0474974
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| Compound Name |
2,3-dichloro-N-[6-(dimethylamino)-3-methoxy-1-methylpyrazolo[3,4-d]pyrimidin-4-yl]benzenesulfonamide
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| Structure |
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| Formula |
C15H16Cl2N6O3S
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| Molecular Weight |
431.305
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| Canonical SMILES |
COc1nn(C)c2nc(nc(NS(=O)(=O)c3cccc(Cl)c3Cl)c12)N(C)C
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| InChI |
InChI=1S/C15H16Cl2N6O3S/c1-22(2)15-18-12(10-13(19-15)23(3)20-14(10)26-4)21-27(24,25)9-7-5-6-8(16)11(9)17/h5-7H,1-4H3,(H,18,19,21)
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| InChIKey |
ZOHDYXXLRJTJRV-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