General Information of the Compound
| Compound ID |
CP0461873
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| Compound Name |
1-[1-[4-(4-methylphenyl)phenyl]pentyl]piperidine
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| Structure |
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| Formula |
C23H31N
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| Molecular Weight |
321.508
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| Canonical SMILES |
CCCCC(N1CCCCC1)c1ccc(cc1)-c1ccc(C)cc1
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| InChI |
InChI=1S/C23H31N/c1-3-4-8-23(24-17-6-5-7-18-24)22-15-13-21(14-16-22)20-11-9-19(2)10-12-20/h9-16,23H,3-8,17-18H2,1-2H3
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| InChIKey |
DJBSYJYFVKILBB-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
Protein ID: PT01194, Histamine H3 receptor
Protein ID: PT01711, Histamine H4 receptor