General Information of the Compound
| Compound ID |
CP0580037
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(2S)-2-[[2-[(4S)-2-oxo-4-(trifluoromethyl)-1,3-oxazolidin-3-yl]-5,6-dihydroimidazo[1,2-d][1,4]benzoxazepin-9-yl]amino]butanamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C19H20F3N5O4
|
||||||||||||||||||
| Molecular Weight |
439.394
|
||||||||||||||||||
| Canonical SMILES |
CC[C@H](Nc1ccc2-c3nc(cn3CCOc2c1)N1[C@@H](COC1=O)C(F)(F)F)C(N)=O
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C19H20F3N5O4/c1-2-12(16(23)28)24-10-3-4-11-13(7-10)30-6-5-26-8-15(25-17(11)26)27-14(19(20,21)22)9-31-18(27)29/h3-4,7-8,12,14,24H,2,5-6,9H2,1H3,(H2,23,28)/t12-,14-/m0/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
AFIWRMSGZOGOIP-JSGCOSHPSA-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 | |||||||||||||||||||
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