General Information of the Compound
| Compound ID |
CP0476070
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| Compound Name |
1-(3-fluorophenyl)-3-[4-methoxy-3-(2-piperidin-1-ylethoxy)phenyl]imidazol-2-one
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| Structure |
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| Formula |
C23H26FN3O3
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| Molecular Weight |
411.477
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| Canonical SMILES |
COc1ccc(cc1OCCN1CCCCC1)-n1ccn(-c2cccc(F)c2)c1=O
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| InChI |
InChI=1S/C23H26FN3O3/c1-29-21-9-8-20(17-22(21)30-15-14-25-10-3-2-4-11-25)27-13-12-26(23(27)28)19-7-5-6-18(24)16-19/h5-9,12-13,16-17H,2-4,10-11,14-15H2,1H3
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| InChIKey |
KBWHXMDBZQWTBZ-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