General Information of the Compound
| Compound ID |
CP0550027
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| Compound Name |
N-[4-[(1-adamantylcarbamoylamino)methyl]phenyl]-N'-methoxyoxamide
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| Structure |
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| Formula |
C21H28N4O4
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| Molecular Weight |
400.479
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| Canonical SMILES |
CONC(=O)C(=O)Nc1ccc(CNC(=O)NC23CC4CC(CC(C4)C2)C3)cc1
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| InChI |
InChI=1S/C21H28N4O4/c1-29-25-19(27)18(26)23-17-4-2-13(3-5-17)12-22-20(28)24-21-9-14-6-15(10-21)8-16(7-14)11-21/h2-5,14-16H,6-12H2,1H3,(H,23,26)(H,25,27)(H2,22,24,28)
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| InChIKey |
LHAGWMYHEOQUKH-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