General Information of the Compound
| Compound ID |
CP0457237
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| Compound Name |
2-methyl-2-[4-(3-oxobenzo[f]chromene-2-carbonyl)phenoxy]propanoic acid
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| Structure |
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| Formula |
C24H18O6
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| Molecular Weight |
402.402
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| Canonical SMILES |
CC(C)(Oc1ccc(cc1)C(=O)c1cc2c(ccc3ccccc23)oc1=O)C(O)=O
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| InChI |
InChI=1S/C24H18O6/c1-24(2,23(27)28)30-16-10-7-15(8-11-16)21(25)19-13-18-17-6-4-3-5-14(17)9-12-20(18)29-22(19)26/h3-13H,1-2H3,(H,27,28)
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| InChIKey |
RPBBYNCCUZQDHT-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