General Information of the Compound
| Compound ID |
CP0445520
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| Compound Name |
7-nitro-N-(4-(piperidin-1-yl)butyl)benzo[c][1,2,5]oxadiazol-4-amine
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| Structure |
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| Formula |
C15H21N5O3
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| Molecular Weight |
319.365
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| Canonical SMILES |
[O-][N+](=O)c1ccc(NCCCCN2CCCCC2)c2nonc12
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| InChI |
InChI=1S/C15H21N5O3/c21-20(22)13-7-6-12(14-15(13)18-23-17-14)16-8-2-5-11-19-9-3-1-4-10-19/h6-7,16H,1-5,8-11H2
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| InChIKey |
XNVSEWRSQWHYRZ-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