General Information of the Compound
| Compound ID |
CP0566525
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| Compound Name |
1-[3-(4-tert-butylphenyl)propyl]piperidine
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| Structure |
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| Formula |
C18H29N
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| Molecular Weight |
259.437
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| Canonical SMILES |
CC(C)(C)c1ccc(CCCN2CCCCC2)cc1
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| InChI |
InChI=1S/C18H29N/c1-18(2,3)17-11-9-16(10-12-17)8-7-15-19-13-5-4-6-14-19/h9-12H,4-8,13-15H2,1-3H3
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| InChIKey |
PGAUEUYEVZFKMK-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