General Information of the Compound
| Compound ID |
CP0477591
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| Compound Name |
3,4-diphenyl-1,2,5-oxadiazole 2-oxide
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| Structure |
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| Formula |
C14H10N2O2
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| Molecular Weight |
238.246
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| Canonical SMILES |
[O-][n+]1onc(c1-c1ccccc1)-c1ccccc1
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| InChI |
InChI=1S/C14H10N2O2/c17-16-14(12-9-5-2-6-10-12)13(15-18-16)11-7-3-1-4-8-11/h1-10H
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| InChIKey |
KDARYXSKPCAXJL-UHFFFAOYSA-N
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| CAS |
5585-14-8
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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: PT02516, Multidrug resistance-associated protein 1