General Information of the Compound
| Compound ID |
CP0410370
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
5-(2-methylsulfonyl-6-thiophen-2-ylpyrimidin-4-yl)pyrrolidin-2-one
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C13H13N3O3S2
|
||||||||||||||||||
| Molecular Weight |
323.399
|
||||||||||||||||||
| Canonical SMILES |
CS(=O)(=O)c1nc(cc(n1)-c1cccs1)C1CCC(=O)N1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C13H13N3O3S2/c1-21(18,19)13-15-9(8-4-5-12(17)14-8)7-10(16-13)11-3-2-6-20-11/h2-3,6-8H,4-5H2,1H3,(H,14,17)
Show/Hide
|
||||||||||||||||||
| InChIKey |
FOSKCKIJBAMBFX-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