General Information of the Compound
| Compound ID |
CP0442709
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| Compound Name |
4-(4-Chloro-phenyl)-1-(4-hydroxy-4-phenyl-butyl)-piperidin-4-ol
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| Structure |
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| Formula |
C21H26ClNO2
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| Molecular Weight |
359.897
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| Canonical SMILES |
OC(CCCN1CCC(O)(CC1)c1ccc(Cl)cc1)c1ccccc1
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| InChI |
InChI=1S/C21H26ClNO2/c22-19-10-8-18(9-11-19)21(25)12-15-23(16-13-21)14-4-7-20(24)17-5-2-1-3-6-17/h1-3,5-6,8-11,20,24-25H,4,7,12-16H2
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| InChIKey |
QOXZWRNEYHCQOU-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