General Information of the Compound
| Compound ID |
CP0448685
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| Compound Name |
3-[(1R,5R)-8-(2-hydroxy-3-phenylpropyl)-8-azabicyclo[3.2.1]octan-3-yl]phenol
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| Structure |
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| Formula |
C22H27NO2
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| Molecular Weight |
337.463
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| Canonical SMILES |
OC(CN1[C@@H]2CC[C@@H]1CC(C2)c1cccc(O)c1)Cc1ccccc1
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| InChI |
InChI=1S/C22H27NO2/c24-21-8-4-7-17(14-21)18-12-19-9-10-20(13-18)23(19)15-22(25)11-16-5-2-1-3-6-16/h1-8,14,18-20,22,24-25H,9-13,15H2/t19-,20-,22?/m1/s1
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| InChIKey |
QOOMWRCPEQBILM-JLMWTWJWSA-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