General Information of the Compound
| Compound ID |
CP0390180
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| Compound Name |
5-[(4-bromophenyl)methoxy]-N-methyl-N-[2-(1-methylindol-3-yl)ethyl]-4-oxochromene-2-carboxamide
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| Structure |
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| Formula |
C29H25BrN2O4
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| Molecular Weight |
545.433
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| Canonical SMILES |
CN(CCc1cn(C)c2ccccc12)C(=O)c1cc(=O)c2c(OCc3ccc(Br)cc3)cccc2o1
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| InChI |
InChI=1S/C29H25BrN2O4/c1-31(15-14-20-17-32(2)23-7-4-3-6-22(20)23)29(34)27-16-24(33)28-25(8-5-9-26(28)36-27)35-18-19-10-12-21(30)13-11-19/h3-13,16-17H,14-15,18H2,1-2H3
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| InChIKey |
PWCZFIOETPHZFX-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: PT02718, Broad substrate specificity ATP-binding cassette transporter ABCG2