General Information of the Compound
| Compound ID |
CP0434356
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| Compound Name |
6-chloro-N-[3-[4-(2,3-dichlorophenyl)piperazin-1-yl]propyl]quinoline-3-sulfonamide
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| Structure |
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| Formula |
C22H23Cl3N4O2S
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| Molecular Weight |
513.878
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| Canonical SMILES |
Clc1ccc2ncc(cc2c1)S(=O)(=O)NCCCN1CCN(CC1)c1cccc(Cl)c1Cl
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| InChI |
InChI=1S/C22H23Cl3N4O2S/c23-17-5-6-20-16(13-17)14-18(15-26-20)32(30,31)27-7-2-8-28-9-11-29(12-10-28)21-4-1-3-19(24)22(21)25/h1,3-6,13-15,27H,2,7-12H2
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| InChIKey |
IJOWGZZHIHYYGB-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: PT00819, 5-hydroxytryptamine receptor 1A
Protein ID: PT00825, 5-hydroxytryptamine receptor 2A
Protein ID: PT01354, 5-hydroxytryptamine receptor 6
Protein ID: PT00941, 5-hydroxytryptamine receptor 7