General Information of the Compound
| Compound ID |
CP0480525
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| Compound Name |
10-[3-(3,4-Dimethoxy-phenyl)-propionyl]-1,8-dihydroxy-10H-anthracen-9-one
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| Structure |
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| Formula |
C25H22O6
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| Molecular Weight |
418.445
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| Canonical SMILES |
COc1ccc(CCC(=O)C2c3cccc(O)c3C(=O)c3c(O)cccc23)cc1OC
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| InChI |
InChI=1S/C25H22O6/c1-30-20-12-10-14(13-21(20)31-2)9-11-19(28)22-15-5-3-7-17(26)23(15)25(29)24-16(22)6-4-8-18(24)27/h3-8,10,12-13,22,26-27H,9,11H2,1-2H3
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| InChIKey |
QCYXAWAWQQGZIC-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