General Information of the Compound
| Compound ID |
CP0482199
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| Compound Name |
1-[3-[4-(2-methylbutan-2-yl)phenoxy]propyl]pyrrolidine
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| Structure |
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| Formula |
C18H29NO
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| Molecular Weight |
275.436
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| Canonical SMILES |
CCC(C)(C)c1ccc(OCCCN2CCCC2)cc1
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| InChI |
InChI=1S/C18H29NO/c1-4-18(2,3)16-8-10-17(11-9-16)20-15-7-14-19-12-5-6-13-19/h8-11H,4-7,12-15H2,1-3H3
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| InChIKey |
KMJZIGCXRSSFHL-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