General Information of the Compound
| Compound ID |
CP0495451
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| Compound Name |
5-hydroxy-1-(4-hydroxy-2-methyl-5-propan-2-ylphenyl)-6-phenylhexan-3-one
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| Structure |
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| Formula |
C22H28O3
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| Molecular Weight |
340.463
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| Canonical SMILES |
CC(C)c1cc(CCC(=O)CC(O)Cc2ccccc2)c(C)cc1O
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| InChI |
InChI=1S/C22H28O3/c1-15(2)21-13-18(16(3)11-22(21)25)9-10-19(23)14-20(24)12-17-7-5-4-6-8-17/h4-8,11,13,15,20,24-25H,9-10,12,14H2,1-3H3
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| InChIKey |
NQYADSJKSXBBQH-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
Protein ID: PT02148, Transient receptor potential cation channel subfamily A member 1
Protein ID: PT02183, Transient receptor potential cation channel subfamily V member 1