General Information of the Compound
| Compound ID |
CP0417082
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| Compound Name |
N-[2-(2-phenylphenoxy)ethyl]prop-2-en-1-amine
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| Structure |
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| Formula |
C17H19NO
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| Molecular Weight |
253.345
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| Canonical SMILES |
C=CCNCCOc1ccccc1-c1ccccc1
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| InChI |
InChI=1S/C17H19NO/c1-2-12-18-13-14-19-17-11-7-6-10-16(17)15-8-4-3-5-9-15/h2-11,18H,1,12-14H2
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| InChIKey |
SRTGERSEXJGDMR-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: PT01179, Beta-1 adrenergic receptor
Protein ID: PT01494, Beta-2 adrenergic receptor