General Information of the Compound
| Compound ID |
CP0569785
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| Compound Name |
7-pent-4-ynoxy-2-phenylchromen-4-one
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| Structure |
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| Formula |
C20H16O3
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| Molecular Weight |
304.345
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| Canonical SMILES |
O=c1cc(oc2cc(OCCCC#C)ccc12)-c1ccccc1
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| InChI |
InChI=1S/C20H16O3/c1-2-3-7-12-22-16-10-11-17-18(21)14-19(23-20(17)13-16)15-8-5-4-6-9-15/h1,4-6,8-11,13-14H,3,7,12H2
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| InChIKey |
BUGNCFQSSWMTRT-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