General Information of the Compound
| Compound ID |
CP0676878
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
6-((1-(2-(3-fluoro-6-methoxy-1,5-naphthyridin-4-yl)-2-oxoethyl)-2-oxabicyclo[2.2.2]octan-4-ylamino)methyl)-2H-pyrido[3,2-b][1,4]oxazin-3(4H)-one
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C26H26FN5O5
|
||||||||||||||||||
| Molecular Weight |
507.522
|
||||||||||||||||||
| Canonical SMILES |
COc1ccc2ncc(F)c(C(=O)CC34CCC(NCc5ccc6c(n5)NC(=O)CO6)(CC3)CO4)c2n1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C26H26FN5O5/c1-35-21-5-3-17-23(32-21)22(16(27)12-28-17)18(33)10-26-8-6-25(7-9-26,14-37-26)29-11-15-2-4-19-24(30-15)31-20(34)13-36-19/h2-5,12,29H,6-11,13-14H2,1H3,(H,30,31,34)
Show/Hide
|
||||||||||||||||||
| InChIKey |
BKDPVDLFRZUFJD-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 | |||||||||||||||||||