General Information of the Compound
| Compound ID |
CP0899059
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| Compound Name |
3-benzylchromen-4-one
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| Structure |
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| Formula |
C23H24O4
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| Molecular Weight |
364.441
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| Canonical SMILES |
O=c1c(Cc2ccc(O)cc2)coc2cccc(OCC3CCCCC3)c12
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| InChI |
InChI=1S/C23H24O4/c24-19-11-9-16(10-12-19)13-18-15-27-21-8-4-7-20(22(21)23(18)25)26-14-17-5-2-1-3-6-17/h4,7-12,15,17,24H,1-3,5-6,13-14H2
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| InChIKey |
XDUWQGKXCZPOKC-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