General Information of the Compound
| Compound ID |
CP0411835
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| Compound Name |
6-(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 |
OCCCOc1coc2ccc(CC3CCCCC3)cc2c1=O
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| InChI |
InChI=1S/C19H24O4/c20-9-4-10-22-18-13-23-17-8-7-15(12-16(17)19(18)21)11-14-5-2-1-3-6-14/h7-8,12-14,20H,1-6,9-11H2
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| InChIKey |
NDQRUZJKWKIUME-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