General Information of the Compound
| Compound ID |
CP0360909
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
5-(3,5-difluorophenyl)-3-[[3-(2-methoxyethoxy)quinolin-6-yl]methyl]triazolo[4,5-c]pyridin-4-one
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C24H19F2N5O3
|
||||||||||||||||||
| Molecular Weight |
463.444
|
||||||||||||||||||
| Canonical SMILES |
COCCOc1cnc2ccc(Cn3nnc4ccn(-c5cc(F)cc(F)c5)c(=O)c34)cc2c1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C24H19F2N5O3/c1-33-6-7-34-20-9-16-8-15(2-3-21(16)27-13-20)14-31-23-22(28-29-31)4-5-30(24(23)32)19-11-17(25)10-18(26)12-19/h2-5,8-13H,6-7,14H2,1H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
XWYFHGITNSOOBZ-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