General Information of the Compound
| Compound ID |
CP0483874
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| Compound Name |
1-[(5-phenyl-2,3-dihydro-1-benzofuran-2-yl)methyl]piperazine
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| Structure |
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| Formula |
C19H22N2O
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| Molecular Weight |
294.398
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| Canonical SMILES |
C(C1Cc2cc(ccc2O1)-c1ccccc1)N1CCNCC1
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| InChI |
InChI=1S/C19H22N2O/c1-2-4-15(5-3-1)16-6-7-19-17(12-16)13-18(22-19)14-21-10-8-20-9-11-21/h1-7,12,18,20H,8-11,13-14H2
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| InChIKey |
ALJTZVUWUVANKY-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