General Information of the Compound
| Compound ID |
CP0549491
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| Compound Name |
1-butyl-1-[(4-hydroxyphenyl)methyl]-2,3-dihydroinden-5-ol
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| Formula |
C20H24O2
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| Molecular Weight |
296.41
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| Canonical SMILES |
CCCCC1(Cc2ccc(O)cc2)CCc2cc(O)ccc12
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| InChI |
InChI=1S/C20H24O2/c1-2-3-11-20(14-15-4-6-17(21)7-5-15)12-10-16-13-18(22)8-9-19(16)20/h4-9,13,21-22H,2-3,10-12,14H2,1H3
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| InChIKey |
IXWZFIJZJHJHJO-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