General Information of the Compound
| Compound ID |
CP0918724
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| Compound Name |
3-(3,4-Dihydroxy-phenyl)-1-(2,4,6-trimethyl-phenyl)-propenone
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| Structure |
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| Formula |
C18H18O3
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| Molecular Weight |
282.339
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| Canonical SMILES |
Cc1cc(C)c(C(=O)/C=C/c2ccc(O)c(O)c2)c(C)c1
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| InChI |
InChI=1S/C18H18O3/c1-11-8-12(2)18(13(3)9-11)16(20)7-5-14-4-6-15(19)17(21)10-14/h4-10,19,21H,1-3H3/b7-5+
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| InChIKey |
KQWCHFICGLBIJY-FNORWQNLSA-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