General Information of the Compound
| Compound ID |
CP0548176
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| Compound Name |
2,8-dioxo-3-(2H-tetrazol-5-yl)pyrano[2,3-f]chromene-9-carbonitrile
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| Structure |
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| Formula |
C14H5N5O4
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| Molecular Weight |
307.225
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| Canonical SMILES |
O=c1oc2ccc3cc(-c4nnn[nH]4)c(=O)oc3c2cc1C#N
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| InChI |
InChI=1S/C14H5N5O4/c15-5-7-4-8-10(22-13(7)20)2-1-6-3-9(12-16-18-19-17-12)14(21)23-11(6)8/h1-4H,(H,16,17,18,19)
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| InChIKey |
PNPXXABRYCUHBX-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