General Information of the Compound
| Compound ID |
CP0500383
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
US8853203, 110d
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C19H17F2N5O
|
||||||||||||||||||
| Molecular Weight |
369.375
|
||||||||||||||||||
| Canonical SMILES |
FC(F)c1cn(cn1)C1=NCC(=O)N2CCc3c(ccnc3C3CC3)C2=C1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C19H17F2N5O/c20-19(21)14-9-25(10-24-14)16-7-15-12-3-5-22-18(11-1-2-11)13(12)4-6-26(15)17(27)8-23-16/h3,5,7,9-11,19H,1-2,4,6,8H2
Show/Hide
|
||||||||||||||||||
| InChIKey |
MYSJBIKZGQCWQA-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