General Information of the Compound
| Compound ID |
CP0673256
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| Compound Name |
2-{[(6,8-Dibromo-2-ethoxy-4-oxo-2H-chromen-3(4H)-ylidene)methyl]amino}benzenesulfonamide
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| Structure |
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| Formula |
C18H16Br2N2O5S
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| Molecular Weight |
532.21
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| Canonical SMILES |
CCOC1Oc2c(Br)cc(Br)cc2C(=O)/C1=C\Nc1ccccc1S(N)(=O)=O
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| InChI |
InChI=1S/C18H16Br2N2O5S/c1-2-26-18-12(9-22-14-5-3-4-6-15(14)28(21,24)25)16(23)11-7-10(19)8-13(20)17(11)27-18/h3-9,18,22H,2H2,1H3,(H2,21,24,25)/b12-9+
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| InChIKey |
ZNXCDQRTVIERBN-FMIVXFBMSA-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