General Information of the Compound
| Compound ID |
CP0438167
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| Compound Name |
7-(methoxymethoxy)-2-(4-pent-4-ynoxyphenyl)-5-phenylmethoxychromen-4-one
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| Structure |
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| Formula |
C29H26O6
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| Molecular Weight |
470.521
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| Canonical SMILES |
COCOc1cc(OCc2ccccc2)c2c(c1)oc(cc2=O)-c1ccc(OCCCC#C)cc1
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| InChI |
InChI=1S/C29H26O6/c1-3-4-8-15-32-23-13-11-22(12-14-23)26-18-25(30)29-27(33-19-21-9-6-5-7-10-21)16-24(34-20-31-2)17-28(29)35-26/h1,5-7,9-14,16-18H,4,8,15,19-20H2,2H3
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| InChIKey |
ZQRJALRDLVVDMI-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