General Information of the Compound
| Compound ID |
CP0546367
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| Compound Name |
N-[4-nitro-2-(12-oxo-4-oxa-1,10-diazatricyclo[7.3.1.05,13]trideca-5,7,9(13),10-tetraen-11-yl)phenyl]acetamide
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| Structure |
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| Formula |
C18H14N4O5
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| Molecular Weight |
366.333
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| Canonical SMILES |
CC(=O)Nc1ccc(cc1-c1nc2cccc3OCCn(c23)c1=O)[N+]([O-])=O
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| InChI |
InChI=1S/C18H14N4O5/c1-10(23)19-13-6-5-11(22(25)26)9-12(13)16-18(24)21-7-8-27-15-4-2-3-14(20-16)17(15)21/h2-6,9H,7-8H2,1H3,(H,19,23)
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| InChIKey |
MVXJIODJFPLDJX-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