General Information of the Compound
| Compound ID |
CP0860969
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| Compound Name |
N-(3-(4-(3-chlorophenyl)piperazin-1-yl)propyl)quinoline-3-sulfonamide hydrochloride
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| Structure |
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| Formula |
C22H26Cl2N4O2S
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| Molecular Weight |
481.449
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| Canonical SMILES |
Cl.O=S(=O)(NCCCN1CCN(c2cccc(Cl)c2)CC1)c1cnc2ccccc2c1
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| InChI |
InChI=1S/C22H25ClN4O2S.ClH/c23-19-6-3-7-20(16-19)27-13-11-26(12-14-27)10-4-9-25-30(28,29)21-15-18-5-1-2-8-22(18)24-17-21;/h1-3,5-8,15-17,25H,4,9-14H2;1H
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| InChIKey |
GDDICSVYUBWJPU-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: PT00941, 5-hydroxytryptamine receptor 7