General Information of the Compound
| Compound ID |
CP0525430
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-[(3R)-1-(2,6-dimethyl-3-thiophen-2-ylimidazo[1,2-b]pyridazin-8-yl)pyrrolidin-3-yl]acetamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C18H21N5OS
|
||||||||||||||||||
| Molecular Weight |
355.467
|
||||||||||||||||||
| Canonical SMILES |
CC(=O)N[C@@H]1CCN(C1)c1cc(C)nn2c(c(C)nc12)-c1cccs1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C18H21N5OS/c1-11-9-15(22-7-6-14(10-22)20-13(3)24)18-19-12(2)17(23(18)21-11)16-5-4-8-25-16/h4-5,8-9,14H,6-7,10H2,1-3H3,(H,20,24)/t14-/m1/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
KBAHWLBOZCNRIT-CQSZACIVSA-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