General Information of the Compound
| Compound ID |
CP0532247
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| Compound Name |
1-[(5-methoxy-2,3-dihydro-1-benzofuran-2-yl)methyl]-4-methylpiperazine
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| Formula |
C15H22N2O2
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| Molecular Weight |
262.353
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| Canonical SMILES |
COc1ccc2OC(CN3CCN(C)CC3)Cc2c1
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| InChI |
InChI=1S/C15H22N2O2/c1-16-5-7-17(8-6-16)11-14-10-12-9-13(18-2)3-4-15(12)19-14/h3-4,9,14H,5-8,10-11H2,1-2H3
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| InChIKey |
QOQHLGYDRGBOQK-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: PT01194, Histamine H3 receptor
Protein ID: PT01711, Histamine H4 receptor