General Information of the Compound
| Compound ID |
CP0513512
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| Compound Name |
N-heptyl-5-methyl-N-(3-methylphenyl)-4-nitro-1,2-oxazole-3-carboxamide
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| Formula |
C19H25N3O4
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| Molecular Weight |
359.426
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| Canonical SMILES |
CCCCCCCN(C(=O)c1noc(C)c1[N+]([O-])=O)c1cccc(C)c1
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| InChI |
InChI=1S/C19H25N3O4/c1-4-5-6-7-8-12-21(16-11-9-10-14(2)13-16)19(23)17-18(22(24)25)15(3)26-20-17/h9-11,13H,4-8,12H2,1-3H3
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| InChIKey |
DCNKDQOZMJFEQN-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