General Information of the Compound
| Compound ID |
CP0418911
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| Compound Name |
1-[3-(4-tert-Butylphenoxy)propyl]-4-piperidino-piperidine
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| Structure |
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| Formula |
C23H38N2O
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| Molecular Weight |
358.57
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| Canonical SMILES |
CC(C)(C)c1ccc(OCCCN2CCC(CC2)N2CCCCC2)cc1
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| InChI |
InChI=1S/C23H38N2O/c1-23(2,3)20-8-10-22(11-9-20)26-19-7-14-24-17-12-21(13-18-24)25-15-5-4-6-16-25/h8-11,21H,4-7,12-19H2,1-3H3
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| InChIKey |
IMNMJGPBEDHBCW-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