General Information of the Compound
| Compound ID |
CP0392840
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| Compound Name |
4-Amino-1-[4-(4-fluoro-phenyl)-4-oxo-butyl]-piperidine-4-carboxylic acid amide
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| Structure |
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| Formula |
C16H22FN3O2
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| Molecular Weight |
307.369
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| Canonical SMILES |
NC(=O)C1(N)CCN(CCCC(=O)c2ccc(F)cc2)CC1
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| InChI |
InChI=1S/C16H22FN3O2/c17-13-5-3-12(4-6-13)14(21)2-1-9-20-10-7-16(19,8-11-20)15(18)22/h3-6H,1-2,7-11,19H2,(H2,18,22)
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| InChIKey |
OMSVQOBVPYMBNV-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