General Information of the Compound
| Compound ID |
CP0463145
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
tert-butyl 2-[[5-(1,1-dioxothiazinan-2-yl)-8-hydroxy-1,6-naphthyridine-7-carbonyl]amino]acetate
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C19H24N4O6S
|
||||||||||||||||||
| Molecular Weight |
436.49
|
||||||||||||||||||
| Canonical SMILES |
CC(C)(C)OC(=O)CNC(=O)c1nc(N2CCCCS2(=O)=O)c2cccnc2c1O
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C19H24N4O6S/c1-19(2,3)29-13(24)11-21-18(26)15-16(25)14-12(7-6-8-20-14)17(22-15)23-9-4-5-10-30(23,27)28/h6-8,25H,4-5,9-11H2,1-3H3,(H,21,26)
Show/Hide
|
||||||||||||||||||
| InChIKey |
ZDOVRILAODNARX-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