General Information of the Compound
| Compound ID |
CP0560408
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| Compound Name |
2,3-dichloro-N-[6-(ethylamino)-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 |
CCNc1nc(NS(=O)(=O)c2cccc(Cl)c2Cl)c2c(OC)nn(C)c2n1
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| InChI |
InChI=1S/C15H16Cl2N6O3S/c1-4-18-15-19-12(10-13(20-15)23(2)21-14(10)26-3)22-27(24,25)9-7-5-6-8(16)11(9)17/h5-7H,4H2,1-3H3,(H2,18,19,20,22)
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| InChIKey |
LPNDSPTYSSYOGH-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