General Information of the Compound
| Compound ID |
CP0953100
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
Rac-3-(((6-(aminomethyl)pyrimidin-4-yl)oxy)methyl)-N-((3-methyl-2-oxooxazolidin-5-yl)methyl)benzamide Trifluoroacetate
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C20H22F3N5O6
|
||||||||||||||||||
| Molecular Weight |
485.419
|
||||||||||||||||||
| Canonical SMILES |
CN1CC(CNC(=O)c2cccc(COc3cc(CN)ncn3)c2)OC1=O.O=C(O)C(F)(F)F
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C18H21N5O4.C2HF3O2/c1-23-9-15(27-18(23)25)8-20-17(24)13-4-2-3-12(5-13)10-26-16-6-14(7-19)21-11-22-16;3-2(4,5)1(6)7/h2-6,11,15H,7-10,19H2,1H3,(H,20,24);(H,6,7)
Show/Hide
|
||||||||||||||||||
| InChIKey |
KRODAXVYQCINMA-UHFFFAOYSA-N
|
||||||||||||||||||
| 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
|
||||||||||||||||||
| Click to Show/Hide the External Link(s) of This Compound | |||||||||||||||||||
| PubChem ID | |||||||||||||||||||
| ChEMBL ID | |||||||||||||||||||
Map of Molecular Bioactivity Related to the Compound
|
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 |
|
|---|
Table of Molecular Bioactivities Related to the Compound