General Information of the Compound
| Compound ID |
CP0031166
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| Compound Name |
(E)-1-(2-Hydroxy-4-methoxy-phenyl)-3-phenyl-propenone
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| Structure |
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| Formula |
C16H14O3
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| Molecular Weight |
254.285
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| Canonical SMILES |
COc1ccc(C(=O)\C=C\c2ccccc2)c(O)c1
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| InChI |
InChI=1S/C16H14O3/c1-19-13-8-9-14(16(18)11-13)15(17)10-7-12-5-3-2-4-6-12/h2-11,18H,1H3/b10-7+
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| InChIKey |
GUNGQVJAKLIYDG-JXMROGBWSA-N
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| CAS |
39273-61-5
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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: PT02718, Broad substrate specificity ATP-binding cassette transporter ABCG2
Protein ID: PT06109, Geminin