General Information of the Compound
| Compound ID |
CP0277509
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| Compound Name |
8-[3-(4-Fluoro-phenoxy)-propyl]-1-methyl-1,3,8-triaza-spiro[4.5]decan-4-one
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| Structure |
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| Formula |
C17H24FN3O2
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| Molecular Weight |
321.396
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| Canonical SMILES |
CN1CNC(=O)C11CCN(CCCOc2ccc(F)cc2)CC1
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| InChI |
InChI=1S/C17H24FN3O2/c1-20-13-19-16(22)17(20)7-10-21(11-8-17)9-2-12-23-15-5-3-14(18)4-6-15/h3-6H,2,7-13H2,1H3,(H,19,22)
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| InChIKey |
VKWSFNFKZXJUPJ-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: PT01492, 5-hydroxytryptamine receptor 2A
Protein ID: PT01480, 5-hydroxytryptamine receptor 2C