General Information of the Compound
| Compound ID |
CP0476416
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| Compound Name |
1-[3-(4-tert-butylphenyl)propyl]-4-methylpiperidine
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| Structure |
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| Formula |
C19H31N
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| Molecular Weight |
273.464
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| Canonical SMILES |
CC1CCN(CCCc2ccc(cc2)C(C)(C)C)CC1
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| InChI |
InChI=1S/C19H31N/c1-16-11-14-20(15-12-16)13-5-6-17-7-9-18(10-8-17)19(2,3)4/h7-10,16H,5-6,11-15H2,1-4H3
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| InChIKey |
MCZPKBDABMWKID-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