General Information of the Compound
| Compound ID |
CP0411952
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| Compound Name |
3-[2-hydroxy-3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl]-5-methyl-5-(4-methylphenyl)imidazolidine-2,4-dione;hydrochloride
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| Structure |
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| Formula |
C25H33ClN4O4
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| Molecular Weight |
489.016
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| Canonical SMILES |
Cl.COc1ccccc1N1CCN(CC(O)CN2C(=O)NC(C)(C2=O)c2ccc(C)cc2)CC1
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| InChI |
InChI=1S/C25H32N4O4.ClH/c1-18-8-10-19(11-9-18)25(2)23(31)29(24(32)26-25)17-20(30)16-27-12-14-28(15-13-27)21-6-4-5-7-22(21)33-3;/h4-11,20,30H,12-17H2,1-3H3,(H,26,32);1H
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| InChIKey |
GQGXFFRBMBQASB-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: PT00941, 5-hydroxytryptamine receptor 7
Protein ID: PT01005, D(2) dopamine receptor