General Information of the Compound
| Compound ID |
CP0390046
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| Compound Name |
ethyl 7-[(4-tert-butylphenyl)methoxy]-2-oxochromene-3-carboxylate
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| Structure |
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| Formula |
C23H24O5
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| Molecular Weight |
380.44
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| Canonical SMILES |
CCOC(=O)c1cc2ccc(OCc3ccc(cc3)C(C)(C)C)cc2oc1=O
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| InChI |
InChI=1S/C23H24O5/c1-5-26-21(24)19-12-16-8-11-18(13-20(16)28-22(19)25)27-14-15-6-9-17(10-7-15)23(2,3)4/h6-13H,5,14H2,1-4H3
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| InChIKey |
FWLMJHGQRXWNIS-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