General Information of the Compound
| Compound ID |
CP0006399
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| Compound Name |
2-[2-(4-methylpiperidin-1-yl)ethyl]-1H-indole
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| Structure |
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| Formula |
C16H22N2
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| Molecular Weight |
242.366
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| Canonical SMILES |
CC1CCN(CCc2cc3ccccc3[nH]2)CC1
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| InChI |
InChI=1S/C16H22N2/c1-13-6-9-18(10-7-13)11-8-15-12-14-4-2-3-5-16(14)17-15/h2-5,12-13,17H,6-11H2,1H3
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| InChIKey |
IYTDJFCDFCKMGJ-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: PT03245, Acetylcholine-binding protein
Protein ID: PT01846, Neuronal acetylcholine receptor subunit alpha-7