General Information of the Compound
| Compound ID |
CP0535558
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| Compound Name |
2-Butyl-1,8-dihydroxy-10H-anthracen-9-one
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| Structure |
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| Formula |
C18H18O3
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| Molecular Weight |
282.339
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| Canonical SMILES |
CCCCc1ccc2Cc3cccc(O)c3C(=O)c2c1O
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| InChI |
InChI=1S/C18H18O3/c1-2-3-5-11-8-9-13-10-12-6-4-7-14(19)15(12)18(21)16(13)17(11)20/h4,6-9,19-20H,2-3,5,10H2,1H3
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| InChIKey |
DLRVAHCNVVWDMI-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