General Information of the Compound
| Compound ID |
CP0389223
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| Compound Name |
N-[(1-phenyl-3,4-dihydronaphthalen-2-yl)methyl]propanamide
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| Structure |
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| Formula |
C20H21NO
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| Molecular Weight |
291.394
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| Canonical SMILES |
CCC(=O)NCC1=C(c2ccccc2)c2ccccc2CC1
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| InChI |
InChI=1S/C20H21NO/c1-2-19(22)21-14-17-13-12-15-8-6-7-11-18(15)20(17)16-9-4-3-5-10-16/h3-11H,2,12-14H2,1H3,(H,21,22)
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| InChIKey |
KEHQBZVTGYIUSF-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