General Information of the Compound
| Compound ID |
CP0352675
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| Compound Name |
4-bromanyl-N-[3-(4-ethylpiperazin-1-yl)-1,4-bis(oxidanylidene)naphthalen-2-yl]benzenesulfonamide
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| Structure |
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| Formula |
C22H22BrN3O4S
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| Molecular Weight |
504.406
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| Canonical SMILES |
CCN1CCN(CC1)C1=C(NS(=O)(=O)c2ccc(Br)cc2)C(=O)c2ccccc2C1=O
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| InChI |
InChI=1S/C22H22BrN3O4S/c1-2-25-11-13-26(14-12-25)20-19(21(27)17-5-3-4-6-18(17)22(20)28)24-31(29,30)16-9-7-15(23)8-10-16/h3-10,24H,2,11-14H2,1H3
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| InChIKey |
AWRKOVBQJOYUJX-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