General Information of the Compound
| Compound ID |
CP0569165
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
3-(4-benzylpiperazin-1-yl)sulfonyl-6-(5-fluoropyridin-3-yl)imidazo[1,2-b]pyridazine
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C22H21FN6O2S
|
||||||||||||||||||
| Molecular Weight |
452.515
|
||||||||||||||||||
| Canonical SMILES |
Fc1cncc(c1)-c1ccc2ncc(n2n1)S(=O)(=O)N1CCN(Cc2ccccc2)CC1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C22H21FN6O2S/c23-19-12-18(13-24-14-19)20-6-7-21-25-15-22(29(21)26-20)32(30,31)28-10-8-27(9-11-28)16-17-4-2-1-3-5-17/h1-7,12-15H,8-11,16H2
Show/Hide
|
||||||||||||||||||
| InChIKey |
RNQHURUFSWZBCD-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