General Information of the Compound
| Compound ID |
CP0445198
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| Compound Name |
4-(3-Phenoxy-propyl)-1H-imidazole with (0.95M)oxalic acid
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| Synonyms |
4-(3-Phenoxy-propyl)-1H-imidazole
4-(3-Phenoxy-propyl)-1H-imidazole with (0.95M)oxalic acid
4-(3-Phenoxypropyl)-1H-imidazole
BDBM50092833
CHEMBL112951
CHEMBL128923
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| Structure |
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| Formula |
C12H14N2O
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| Molecular Weight |
202.257
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| Canonical SMILES |
C(COc1ccccc1)Cc1cnc[nH]1
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| InChI |
InChI=1S/C12H14N2O/c1-2-6-12(7-3-1)15-8-4-5-11-9-13-10-14-11/h1-3,6-7,9-10H,4-5,8H2,(H,13,14)
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| InChIKey |
DOOCQHQHBHNOGX-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: PT01173, Histamine H3 receptor
Protein ID: PT01194, Histamine H3 receptor
Clinical Information about the Compound