General Information of the Compound
| Compound ID |
CP0447092
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| Compound Name |
N-(2-adamantyl)-N'-[(4-nitrophenyl)methoxy]oxamide
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| Structure |
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| Formula |
C19H23N3O5
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| Molecular Weight |
373.409
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| Canonical SMILES |
[O-][N+](=O)c1ccc(CONC(=O)C(=O)NC2C3CC4CC(C3)CC2C4)cc1
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| InChI |
InChI=1S/C19H23N3O5/c23-18(20-17-14-6-12-5-13(8-14)9-15(17)7-12)19(24)21-27-10-11-1-3-16(4-2-11)22(25)26/h1-4,12-15,17H,5-10H2,(H,20,23)(H,21,24)
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| InChIKey |
PUOIVAYVMZWDRK-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