General Information of the Compound
| Compound ID |
CP0504563
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| Compound Name |
1-[(2R,3R)-3-hydroxy-1,2,3,4-tetrahydronaphthalen-2-yl]-4-phenylpiperidin-4-ol
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| Structure |
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| Formula |
C21H25NO2
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| Molecular Weight |
323.436
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| Canonical SMILES |
O[C@@H]1Cc2ccccc2C[C@H]1N1CCC(O)(CC1)c1ccccc1
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| InChI |
InChI=1S/C21H25NO2/c23-20-15-17-7-5-4-6-16(17)14-19(20)22-12-10-21(24,11-13-22)18-8-2-1-3-9-18/h1-9,19-20,23-24H,10-15H2/t19-,20-/m1/s1
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| InChIKey |
AJKMOSGBVDVHSL-WOJBJXKFSA-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