General Information of the Compound
| Compound ID |
CP0847934
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| Compound Name |
5-(4-phenoxybenzamido)pentylamine hydrochloride
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| Structure |
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| Formula |
C18H23ClN2O2
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| Molecular Weight |
334.847
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| Canonical SMILES |
Cl.NCCCCCNC(=O)c1ccc(Oc2ccccc2)cc1
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| InChI |
InChI=1S/C18H22N2O2.ClH/c19-13-5-2-6-14-20-18(21)15-9-11-17(12-10-15)22-16-7-3-1-4-8-16;/h1,3-4,7-12H,2,5-6,13-14,19H2,(H,20,21);1H
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| InChIKey |
OHRFHYAPCLBOPD-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: PT03226, Trace amine-associated receptor 1
Protein ID: PT03501, Trace amine-associated receptor 1