General Information of the Compound
| Compound ID |
CP0424236
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| Compound Name |
3-[1-(furan-2-ylmethyl)-3,6-dihydro-2H-pyridin-4-yl]-1H-indole
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| Structure |
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| Formula |
C18H18N2O
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| Molecular Weight |
278.355
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| Canonical SMILES |
C(N1CCC(=CC1)c1c[nH]c2ccccc12)c1ccco1
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| InChI |
InChI=1S/C18H18N2O/c1-2-6-18-16(5-1)17(12-19-18)14-7-9-20(10-8-14)13-15-4-3-11-21-15/h1-7,11-12,19H,8-10,13H2
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| InChIKey |
YYBRTGMBVYRIBV-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: PT00819, 5-hydroxytryptamine receptor 1A
Protein ID: PT00825, 5-hydroxytryptamine receptor 2A
Protein ID: PT01005, D(2) dopamine receptor