General Information of the Compound
| Compound ID |
CP0404564
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| Compound Name |
2-benzhydryloxy-3-(4-benzylpiperidin-1-yl)propan-1-ol
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| Structure |
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| Formula |
C28H33NO2
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| Molecular Weight |
415.577
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| Canonical SMILES |
OCC(CN1CCC(Cc2ccccc2)CC1)OC(c1ccccc1)c1ccccc1
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| InChI |
InChI=1S/C28H33NO2/c30-22-27(21-29-18-16-24(17-19-29)20-23-10-4-1-5-11-23)31-28(25-12-6-2-7-13-25)26-14-8-3-9-15-26/h1-15,24,27-28,30H,16-22H2
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| InChIKey |
CPOIFTHUTWZTPZ-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