General Information of the Compound
| Compound ID |
CP0532362
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| Compound Name |
N-[3-(3-methoxyphenyl)propyl]propanamide
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| Synonyms |
BDBM50049554
CHEMBL297947
N-(3-(3-methoxyphenyl)propyl)propionamide
N-[3-(3-Methoxyphenyl)propyl]propionamide
SCHEMBL8928118
ZINC13755749
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| Structure |
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| Formula |
C13H19NO2
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| Molecular Weight |
221.3
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| Canonical SMILES |
CCC(=O)NCCCc1cccc(OC)c1
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| InChI |
InChI=1S/C13H19NO2/c1-3-13(15)14-9-5-7-11-6-4-8-12(10-11)16-2/h4,6,8,10H,3,5,7,9H2,1-2H3,(H,14,15)
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| InChIKey |
VVTCACGOXCPEPB-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: PT01843, Melatonin receptor type 1A
Protein ID: PT02174, Melatonin receptor type 1B
Clinical Information about the Compound