General Information of the Compound
| Compound ID |
CP0202859
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| Compound Name |
2-(3,4-dimethoxyphenyl)benzo[h]chromen-4-one
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| Structure |
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| Formula |
C21H16O4
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| Molecular Weight |
332.355
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| Canonical SMILES |
COc1ccc(cc1OC)-c1cc(=O)c2ccc3ccccc3c2o1
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| InChI |
InChI=1S/C21H16O4/c1-23-18-10-8-14(11-20(18)24-2)19-12-17(22)16-9-7-13-5-3-4-6-15(13)21(16)25-19/h3-12H,1-2H3
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| InChIKey |
QDZQDIUUJDAORK-UHFFFAOYSA-N
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| CAS |
14756-24-2
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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: PT01546, ATP-dependent translocase ABCB1
Protein ID: PT02718, Broad substrate specificity ATP-binding cassette transporter ABCG2
Protein ID: PT02516, Multidrug resistance-associated protein 1