General Information of the Compound
| Compound ID |
CP0423002
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| Compound Name |
1,8-Dihydroxy-2-propionyl-10H-anthracen-9-one
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| Synonyms |
1,8-Dihydroxy-2-propionyl-10H-anthracen-9-one
BDBM50060901
CHEMBL126057
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| Structure |
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| Formula |
C17H14O4
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| Molecular Weight |
282.295
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| Canonical SMILES |
CCC(=O)c1ccc2Cc3cccc(O)c3C(=O)c2c1O
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| InChI |
InChI=1S/C17H14O4/c1-2-12(18)11-7-6-10-8-9-4-3-5-13(19)14(9)17(21)15(10)16(11)20/h3-7,19-20H,2,8H2,1H3
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| InChIKey |
KGAHUIIBPUKUER-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
Clinical Information about the Compound