General Information of the Compound
| Compound ID |
CP0480662
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| Compound Name |
3-[2-hydroxy-3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl]-5,5-diphenylimidazolidine-2,4-dione;hydrochloride
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| Structure |
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| Formula |
C29H33ClN4O4
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| Molecular Weight |
537.06
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| Canonical SMILES |
Cl.COc1ccccc1N1CCN(CC(O)CN2C(=O)NC(C2=O)(c2ccccc2)c2ccccc2)CC1
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| InChI |
InChI=1S/C29H32N4O4.ClH/c1-37-26-15-9-8-14-25(26)32-18-16-31(17-19-32)20-24(34)21-33-27(35)29(30-28(33)36,22-10-4-2-5-11-22)23-12-6-3-7-13-23;/h2-15,24,34H,16-21H2,1H3,(H,30,36);1H
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| InChIKey |
ALDWMTGDTLFJRU-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