Ligand Information
| Ligand General Information | Top | |||
|---|---|---|---|---|
| Ligand ID |
LE4X9D
|
|||
| Ligand Name |
(3r)-1-{[1-(5-Fluoro-2-{[4-(2-Hydroxyethoxy)-3,5-Dimethylphenyl]amino}pyrimidin-4-Yl)-4-Methyl-1h-Pyrrol-3-Yl]methyl}pyrrolidin-3-Ol
|
|||
| Synonyms |
(3r)-1-{[1-(5-Fluoro-2-{[4-(2-Hydroxyethoxy)-3,5-Dimethylphenyl]amino}pyrimidin-4-Yl)-4-Methyl-1h-Pyrrol-3-Yl]methyl}pyrrolidin-3-Ol; SCHEMBL1327274; Q27467450; X4G
Click to Show/Hide
|
|||
| Structure |
 |
Download2D MOL |
||
| Formula |
C24H30FN5O3
|
|||
| Canonical SMILES |
CC1=CC(=CC(=C1OCCO)C)NC2=NC=C(C(=N2)N3C=C(C(=C3)CN4CCC(C4)O)C)F
|
|||
| InChI |
1S/C24H30FN5O3/c1-15-8-19(9-16(2)22(15)33-7-6-31)27-24-26-10-21(25)23(28-24)30-11-17(3)18(13-30)12-29-5-4-20(32)14-29/h8-11,13,20,31-32H,4-7,12,14H2,1-3H3,(H,26,27,28)/t20-/m1/s1
|
|||
| InChIKey |
OSONANZITXBMIW-HXUWFJFHSA-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.