General Information of the Compound
| Compound ID |
CP0013493
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| Compound Name |
N-hydroxy-6-(6-nitro-1,3-dioxobenzo[de]isoquinolin-2-yl)hexanamide
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| Structure |
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| Formula |
C18H17N3O6
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| Molecular Weight |
371.349
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| Canonical SMILES |
ONC(=O)CCCCCN1C(=O)c2cccc3c(ccc(C1=O)c23)[N+]([O-])=O
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| InChI |
InChI=1S/C18H17N3O6/c22-15(19-25)7-2-1-3-10-20-17(23)12-6-4-5-11-14(21(26)27)9-8-13(16(11)12)18(20)24/h4-6,8-9,25H,1-3,7,10H2,(H,19,22)
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| InChIKey |
BZSGIZBNTRIRIE-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