General Information of the Compound
| Compound ID |
CP0491924
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| Compound Name |
2-[4-(4-fluorophenoxy)-3-iodophenyl]-N-methylethanamine
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| Structure |
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| Formula |
C15H15FINO
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| Molecular Weight |
371.193
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| Canonical SMILES |
CNCCc1ccc(Oc2ccc(F)cc2)c(I)c1
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| InChI |
InChI=1S/C15H15FINO/c1-18-9-8-11-2-7-15(14(17)10-11)19-13-5-3-12(16)4-6-13/h2-7,10,18H,8-9H2,1H3
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| InChIKey |
JENBSUFCESWJDB-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: PT03501, Trace amine-associated receptor 1
Protein ID: PT03226, Trace amine-associated receptor 1