General Information of the Compound
| Compound ID |
CP0496793
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| Compound Name |
1-[4-(4-Chloro-benzyl)-piperidin-1-yl]-3-(naphthalen-1-yloxy)-propan-2-ol
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| Structure |
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| Formula |
C25H28ClNO2
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| Molecular Weight |
409.957
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| Canonical SMILES |
OC(COc1cccc2ccccc12)CN1CCC(Cc2ccc(Cl)cc2)CC1
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| InChI |
InChI=1S/C25H28ClNO2/c26-22-10-8-19(9-11-22)16-20-12-14-27(15-13-20)17-23(28)18-29-25-7-3-5-21-4-1-2-6-24(21)25/h1-11,20,23,28H,12-18H2
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| InChIKey |
FITAKACFIOKDJH-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