General Information of the Compound
| Compound ID |
CP0503949
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| Compound Name |
N-[2-(5-methoxy-1-methylindol-3-yl)-2-methylpropyl]propanamide
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| Structure |
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| Formula |
C17H24N2O2
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| Molecular Weight |
288.391
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| Canonical SMILES |
CCC(=O)NCC(C)(C)c1cn(C)c2ccc(OC)cc12
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| InChI |
InChI=1S/C17H24N2O2/c1-6-16(20)18-11-17(2,3)14-10-19(4)15-8-7-12(21-5)9-13(14)15/h7-10H,6,11H2,1-5H3,(H,18,20)
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| InChIKey |
QBJWGJIESUDHDM-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