General Information of the Compound
| Compound ID |
CP0457265
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| Compound Name |
1-(2-Acetyl-benzyloxy)-8-hydroxy-10H-anthracen-9-one
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| Structure |
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| Formula |
C23H18O4
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| Molecular Weight |
358.393
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| Canonical SMILES |
CC(=O)c1ccccc1COc1cccc2Cc3cccc(O)c3C(=O)c12
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| InChI |
InChI=1S/C23H18O4/c1-14(24)18-9-3-2-6-17(18)13-27-20-11-5-8-16-12-15-7-4-10-19(25)21(15)23(26)22(16)20/h2-11,25H,12-13H2,1H3
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| InChIKey |
KLQHQSJAKDECEH-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