Ligand Information
| Ligand General Information | Top | |||
|---|---|---|---|---|
| Ligand ID |
LLID98
|
|||
| Ligand Name |
6-Ethyl-5-{(3s)-3-[3-(Isoquinolin-5-Yl)-5-Methoxyphenyl]but-1-Yn-1-Yl}pyrimidine-2,4-Diamine
|
|||
| Synonyms |
6-Ethyl-5-{(3s)-3-[3-(Isoquinolin-5-Yl)-5-Methoxyphenyl]but-1-Yn-1-Yl}pyrimidine-2,4-Diamine; Q27452363; 1QZ
Click to Show/Hide
|
|||
| Structure |
 |
Download2D MOL |
||
| Formula |
C26H25N5O
|
|||
| Canonical SMILES |
CCC1=C(C(=NC(=N1)N)N)C#CC(C)C2=CC(=CC(=C2)C3=CC=CC4=C3C=CN=C4)OC
|
|||
| InChI |
1S/C26H25N5O/c1-4-24-23(25(27)31-26(28)30-24)9-8-16(2)18-12-19(14-20(13-18)32-3)21-7-5-6-17-15-29-11-10-22(17)21/h5-7,10-16H,4H2,1-3H3,(H4,27,28,30,31)/t16-/m1/s1
|
|||
| InChIKey |
MGLLCDAARSVGLO-MRXNPFEDSA-N
|
|||
| PubChem Compound ID | ||||
If You Find Any Error in Data or Bug in Web Service, Please Kindly Report It to Dr. Zhou and Dr. Zhang.