General Information of the Compound
| Compound ID |
CP0552643
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| Compound Name |
4-[1-(benzenesulfonyl)indol-3-yl]-5-ethyl-1H-imidazol-2-amine;hydrochloride
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| Structure |
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| Formula |
C19H19ClN4O2S
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| Molecular Weight |
402.907
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| Canonical SMILES |
Cl.CCc1nc(N)[nH]c1-c1cn(c2ccccc12)S(=O)(=O)c1ccccc1
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| InChI |
InChI=1S/C19H18N4O2S.ClH/c1-2-16-18(22-19(20)21-16)15-12-23(17-11-7-6-10-14(15)17)26(24,25)13-8-4-3-5-9-13;/h3-12H,2H2,1H3,(H3,20,21,22);1H
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| InChIKey |
CHDARNNFQGZMGX-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: PT00825, 5-hydroxytryptamine receptor 2A
Protein ID: PT01354, 5-hydroxytryptamine receptor 6
Protein ID: PT00941, 5-hydroxytryptamine receptor 7
Protein ID: PT01005, D(2) dopamine receptor