General Information of the Compound
| Compound ID |
CP0379691
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| Compound Name |
1-(2-bromophenylsulfonyl)-3-(4-methylpiperazin-1-yl)-1H-indole
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| Structure |
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| Formula |
C19H20BrN3O2S
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| Molecular Weight |
434.359
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| Canonical SMILES |
CN1CCN(CC1)c1cn(c2ccccc12)S(=O)(=O)c1ccccc1Br
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| InChI |
InChI=1S/C19H20BrN3O2S/c1-21-10-12-22(13-11-21)18-14-23(17-8-4-2-6-15(17)18)26(24,25)19-9-5-3-7-16(19)20/h2-9,14H,10-13H2,1H3
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| InChIKey |
HJAPICCHMZJHCP-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