General Information of the Compound
| Compound ID |
CP0538460
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| Compound Name |
N-[[1-(5-methoxy-1-methylindol-3-yl)cyclopentyl]methyl]propanamide
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| Structure |
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| Formula |
C19H26N2O2
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| Molecular Weight |
314.429
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| Canonical SMILES |
CCC(=O)NCC1(CCCC1)c1cn(C)c2ccc(OC)cc12
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| InChI |
InChI=1S/C19H26N2O2/c1-4-18(22)20-13-19(9-5-6-10-19)16-12-21(2)17-8-7-14(23-3)11-15(16)17/h7-8,11-12H,4-6,9-10,13H2,1-3H3,(H,20,22)
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| InChIKey |
ZPVYDABAGPHJMN-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