General Information of the Compound
| Compound ID |
CP0189043
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| Compound Name |
2-acetylbenzo[f]chromen-3-one
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| Structure |
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| Formula |
C15H10O3
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| Molecular Weight |
238.242
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| Canonical SMILES |
CC(=O)c1cc2c(ccc3ccccc23)oc1=O
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| InChI |
InChI=1S/C15H10O3/c1-9(16)12-8-13-11-5-3-2-4-10(11)6-7-14(13)18-15(12)17/h2-8H,1H3
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| InChIKey |
UAMPJVJAALGMNG-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
Protein ID: PT01362, Amine oxidase [flavin-containing] B
Protein ID: PT02997, Isocitrate dehydrogenase [NADP] cytoplasmic