General Information of the Compound
| Compound ID |
CP0482470
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| Compound Name |
1-(benzenesulfonyl)-6-(4-methylpiperazin-1-yl)-2,3-dihydroindole
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| Structure |
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| Formula |
C19H23N3O2S
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| Molecular Weight |
357.479
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| Canonical SMILES |
CN1CCN(CC1)c1ccc2CCN(c2c1)S(=O)(=O)c1ccccc1
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| InChI |
InChI=1S/C19H23N3O2S/c1-20-11-13-21(14-12-20)17-8-7-16-9-10-22(19(16)15-17)25(23,24)18-5-3-2-4-6-18/h2-8,15H,9-14H2,1H3
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| InChIKey |
LLNWCPKEPUSMNT-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
Protein ID: PT01354, 5-hydroxytryptamine receptor 6
Protein ID: PT01005, D(2) dopamine receptor
Protein ID: PT00943, D(3) dopamine receptor