General Information of the Compound
| Compound ID |
CP0536096
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| Compound Name |
5-(cyclohexylmethyl)-3-(3-hydroxypropoxy)chromen-4-one
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| Structure |
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| Formula |
C19H24O4
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| Molecular Weight |
316.397
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| Canonical SMILES |
OCCCOc1coc2cccc(CC3CCCCC3)c2c1=O
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| InChI |
InChI=1S/C19H24O4/c20-10-5-11-22-17-13-23-16-9-4-8-15(18(16)19(17)21)12-14-6-2-1-3-7-14/h4,8-9,13-14,20H,1-3,5-7,10-12H2
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| InChIKey |
GGLOZCROSNIDHF-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