General Information of the Compound
| Compound ID |
CP0469838
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| Compound Name |
N-[4-[[[2-(1-adamantyl)acetyl]amino]methyl]phenyl]-N'-methoxy-N,N'-dimethyloxamide
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| Structure |
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| Formula |
C24H33N3O4
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| Molecular Weight |
427.545
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| Canonical SMILES |
CON(C)C(=O)C(=O)N(C)c1ccc(CNC(=O)CC23CC4CC(CC(C4)C2)C3)cc1
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| InChI |
InChI=1S/C24H33N3O4/c1-26(22(29)23(30)27(2)31-3)20-6-4-16(5-7-20)15-25-21(28)14-24-11-17-8-18(12-24)10-19(9-17)13-24/h4-7,17-19H,8-15H2,1-3H3,(H,25,28)
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| InChIKey |
MGUCVXNORXBADA-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