General Information of the Compound
| Compound ID |
CP0421830
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| Compound Name |
N-[2-(5-methoxy-7-phenyl-1H-indol-3-yl)ethyl]acetamide
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| Structure |
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| Formula |
C19H20N2O2
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| Molecular Weight |
308.381
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| Canonical SMILES |
COc1cc(-c2ccccc2)c2[nH]cc(CCNC(C)=O)c2c1
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| InChI |
InChI=1S/C19H20N2O2/c1-13(22)20-9-8-15-12-21-19-17(14-6-4-3-5-7-14)10-16(23-2)11-18(15)19/h3-7,10-12,21H,8-9H2,1-2H3,(H,20,22)
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| InChIKey |
ZTVQTJJYIPYWHJ-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