General Information of the Compound
| Compound ID |
CP0900297
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| Compound Name |
4-Benzyl-1-[4-(3-piperidin-1-yl-propoxy)-benzyl]-piperidine
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| Structure |
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| Formula |
C27H38N2O
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| Molecular Weight |
406.614
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| Canonical SMILES |
c1ccc(CC2CCN(Cc3ccc(OCCCN4CCCCC4)cc3)CC2)cc1
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| InChI |
InChI=1S/C27H38N2O/c1-3-8-24(9-4-1)22-25-14-19-29(20-15-25)23-26-10-12-27(13-11-26)30-21-7-18-28-16-5-2-6-17-28/h1,3-4,8-13,25H,2,5-7,14-23H2
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| InChIKey |
SRZKSKAKSQZZRQ-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