General Information of the Compound
| Compound ID |
CP0408757
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| Compound Name |
N-[(4-methoxy-2,3-dihydro-1H-phenalen-1-yl)methyl]cyclopropanecarboxamide
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| Structure |
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| Formula |
C19H21NO2
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| Molecular Weight |
295.382
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| Canonical SMILES |
COc1ccc2cccc3C(CNC(=O)C4CC4)CCc1c23
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| InChI |
InChI=1S/C19H21NO2/c1-22-17-10-8-12-3-2-4-15-14(7-9-16(17)18(12)15)11-20-19(21)13-5-6-13/h2-4,8,10,13-14H,5-7,9,11H2,1H3,(H,20,21)
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| InChIKey |
KZPDJVRYOBEHRD-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