General Information of the Compound
| Compound ID |
CP0356724
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| Compound Name |
7-prop-2-ynoxychromen-2-one
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| Structure |
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| Formula |
C12H8O3
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| Molecular Weight |
200.193
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| Canonical SMILES |
O=c1ccc2ccc(OCC#C)cc2o1
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| InChI |
InChI=1S/C12H8O3/c1-2-7-14-10-5-3-9-4-6-12(13)15-11(9)8-10/h1,3-6,8H,7H2
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| InChIKey |
IEHFVZKMAOKFTR-UHFFFAOYSA-N
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| CAS |
67268-42-2
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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