General Information of the Compound
| Compound ID |
CP0409954
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-(4-methyl-1,3-thiazol-2-yl)-6-(1-phenylethenyl)thieno[2,3-d]pyrimidin-4-amine
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C18H14N4S2
|
||||||||||||||||||
| Molecular Weight |
350.472
|
||||||||||||||||||
| Canonical SMILES |
Cc1csc(n1)-c1nc(N)c2cc(sc2n1)C(=C)c1ccccc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C18H14N4S2/c1-10-9-23-18(20-10)16-21-15(19)13-8-14(24-17(13)22-16)11(2)12-6-4-3-5-7-12/h3-9H,2H2,1H3,(H2,19,21,22)
Show/Hide
|
||||||||||||||||||
| InChIKey |
DFBNAUSKOWYPSJ-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
Protein ID: PT00840, Adenosine receptor A1
Protein ID: PT00862, Adenosine receptor A2a