General Information of the Compound
| Compound ID |
CP0378895
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| Compound Name |
1-[4-methoxy-3-(2-piperidin-1-ylethoxy)phenyl]-3-[4-methyl-3-(trifluoromethyl)phenyl]imidazolidin-2-one
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| Structure |
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| Formula |
C25H30F3N3O3
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| Molecular Weight |
477.527
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| Canonical SMILES |
COc1ccc(cc1OCCN1CCCCC1)N1CCN(C1=O)c1ccc(C)c(c1)C(F)(F)F
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| InChI |
InChI=1S/C25H30F3N3O3/c1-18-6-7-19(16-21(18)25(26,27)28)30-12-13-31(24(30)32)20-8-9-22(33-2)23(17-20)34-15-14-29-10-4-3-5-11-29/h6-9,16-17H,3-5,10-15H2,1-2H3
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| InChIKey |
YLNIWEXPAFDSQT-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: PT01019, 5-hydroxytryptamine receptor 2B
Protein ID: PT00939, 5-hydroxytryptamine receptor 2C