General Information of the Compound
| Compound ID |
CP0126568
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| Compound Name |
(2-nonylphenyl)boronic acid
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| Structure |
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| Formula |
C15H25BO2
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| Molecular Weight |
248.175
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| Canonical SMILES |
CCCCCCCCCc1ccccc1B(O)O
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| InChI |
InChI=1S/C15H25BO2/c1-2-3-4-5-6-7-8-11-14-12-9-10-13-15(14)16(17)18/h9-10,12-13,17-18H,2-8,11H2,1H3
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| InChIKey |
KGZQCZWTIFBRHM-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