General Information of the Compound
| Compound ID |
CP0501706
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| Compound Name |
1-(2-(4-chlorobenzyloxy)-5-bromobenzyl)-4-(4-bromophenyl)piperidin-4-ol
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| Structure |
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| Formula |
C25H24Br2ClNO2
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| Molecular Weight |
565.733
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| Canonical SMILES |
OC1(CCN(Cc2cc(Br)ccc2OCc2ccc(Cl)cc2)CC1)c1ccc(Br)cc1
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| InChI |
InChI=1S/C25H24Br2ClNO2/c26-21-5-3-20(4-6-21)25(30)11-13-29(14-12-25)16-19-15-22(27)7-10-24(19)31-17-18-1-8-23(28)9-2-18/h1-10,15,30H,11-14,16-17H2
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| InChIKey |
SLOFYNKFMWLYJA-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