General Information of the Compound
| Compound ID |
CP0517077
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| Compound Name |
6-bromo-2,8-dioxo-3-(2H-tetrazol-5-yl)pyrano[2,3-f]chromene-9-carboxylic acid
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| Structure |
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| Formula |
C14H5BrN4O6
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| Molecular Weight |
405.12
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| Canonical SMILES |
OC(=O)c1cc2c(oc1=O)c(Br)cc1cc(-c3nnn[nH]3)c(=O)oc21
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| InChI |
InChI=1S/C14H5BrN4O6/c15-8-2-4-1-6(11-16-18-19-17-11)13(22)24-9(4)5-3-7(12(20)21)14(23)25-10(5)8/h1-3H,(H,20,21)(H,16,17,18,19)
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| InChIKey |
DZXMQNKIZBOASB-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: PT03308, G-protein coupled receptor 35