General Information of the Compound
| Compound ID |
CP0514877
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| Compound Name |
6-Chloro-1-(2-naphthylsulfonyl)-3-(4-ethylpiperazin-1-yl)-1H-indole
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| Structure |
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| Formula |
C24H24ClN3O2S
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| Molecular Weight |
453.995
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| Canonical SMILES |
CCN1CCN(CC1)c1cn(c2cc(Cl)ccc12)S(=O)(=O)c1ccc2ccccc2c1
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| InChI |
InChI=1S/C24H24ClN3O2S/c1-2-26-11-13-27(14-12-26)24-17-28(23-16-20(25)8-10-22(23)24)31(29,30)21-9-7-18-5-3-4-6-19(18)15-21/h3-10,15-17H,2,11-14H2,1H3
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| InChIKey |
UGQOVXDXUKSPEL-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