General Information of the Compound
| Compound ID |
CP0436364
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(R)-3-ethyl-4-isobutyl-10-(trifluoromethyl)-3,4-dihydro-2H-[1,4]oxazino[2,3-f]quinolin-8(7H)-one
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C18H21F3N2O2
|
||||||||||||||||||
| Molecular Weight |
354.372
|
||||||||||||||||||
| Canonical SMILES |
CC[C@@H]1COc2c(ccc3[nH]c(=O)cc(c23)C(F)(F)F)N1CC(C)C
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C18H21F3N2O2/c1-4-11-9-25-17-14(23(11)8-10(2)3)6-5-13-16(17)12(18(19,20)21)7-15(24)22-13/h5-7,10-11H,4,8-9H2,1-3H3,(H,22,24)/t11-/m1/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
MXLDOEZNFXTHCZ-LLVKDONJSA-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