Ligand Information
| Ligand General Information | Top | |||
|---|---|---|---|---|
| Ligand ID |
LF5G2I
|
|||
| Ligand Name |
2-[4-[[4-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-6-[(3-methyl-1~{H}-pyrazol-5-yl)amino]pyrimidin-2-yl]amino]phenyl]-~{N}-(3-fluorophenyl)ethanamide
|
|||
| Synonyms |
CHEMBL5092920; 2-[4-[[4-[1-[2-(dimethylamino)ethyl]pyrazol-4-yl]-6-[(3-methyl-1~{H}-pyrazol-5-yl)amino]pyrimidin-2-yl]amino]phenyl]-~{N}-(3-fluorophenyl)ethanamide; BDBM50585626; VJH
Click to Show/Hide
|
|||
| Structure |
 |
Download2D MOL |
||
| Formula |
C29H31FN10O
|
|||
| Canonical SMILES |
CC1=CC(=NN1)NC2=NC(=NC(=C2)C3=CN(N=C3)CCN(C)C)NC4=CC=C(C=C4)CC(=O)NC5=CC(=CC=C5)F
|
|||
| InChI |
1S/C29H31FN10O/c1-19-13-27(38-37-19)35-26-16-25(21-17-31-40(18-21)12-11-39(2)3)34-29(36-26)33-23-9-7-20(8-10-23)14-28(41)32-24-6-4-5-22(30)15-24/h4-10,13,15-18H,11-12,14H2,1-3H3,(H,32,41)(H3,33,34,35,36,37,38)
|
|||
| InChIKey |
PVCJCKVFTUXUMC-UHFFFAOYSA-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.