General Information of the Compound
| Compound ID |
CP0372845
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| Compound Name |
2-[(2R,6S)-6-phenyl-1,4-dioxan-2-yl]-4,5-dihydro-1H-imidazole
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| Structure |
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| Formula |
C13H16N2O2
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| Molecular Weight |
232.283
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| Canonical SMILES |
C1CN=C(N1)[C@@H]1COC[C@@H](O1)c1ccccc1
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| InChI |
InChI=1S/C13H16N2O2/c1-2-4-10(5-3-1)11-8-16-9-12(17-11)13-14-6-7-15-13/h1-5,11-12H,6-9H2,(H,14,15)/t11-,12+/m1/s1
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| InChIKey |
OQACXTOHBUWXII-NEPJUHHUSA-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: PT01650, Alpha-2A adrenergic receptor
Protein ID: PT02026, Alpha-2B adrenergic receptor
Protein ID: PT01598, Alpha-2C adrenergic receptor