General Information of the Compound
| Compound ID |
CP0495911
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| Compound Name |
1-(3-(2,6-dibromo-4-(piperidin-1-ylmethyl)phenoxy)propyl)piperidine
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| Structure |
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| Formula |
C20H30Br2N2O
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| Molecular Weight |
474.281
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| Canonical SMILES |
Brc1cc(CN2CCCCC2)cc(Br)c1OCCCN1CCCCC1
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| InChI |
InChI=1S/C20H30Br2N2O/c21-18-14-17(16-24-10-5-2-6-11-24)15-19(22)20(18)25-13-7-12-23-8-3-1-4-9-23/h14-15H,1-13,16H2
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| InChIKey |
LHICIPDDOYLSSA-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