Ligand Information
| Ligand General Information | Top | |||
|---|---|---|---|---|
| Ligand ID |
L4A9TJ
|
|||
| Ligand Name |
(2r)-2-[(1-Aminoisoquinolin-6-Yl)amino]-2-[3-Ethoxy-4-(Propan-2-Yloxy)phenyl]-N-(3-Sulfamoylbenzyl)ethanamide
|
|||
| Synonyms |
(2r)-2-[(1-Aminoisoquinolin-6-Yl)amino]-2-[3-Ethoxy-4-(Propan-2-Yloxy)phenyl]-N-(3-Sulfamoylbenzyl)ethanamide; 4ng9; SCHEMBL14008647; Q27453068; 2KE
Click to Show/Hide
|
|||
| Structure |
 |
Download2D MOL |
||
| Formula |
C29H33N5O5S
|
|||
| Canonical SMILES |
CCOC1=C(C=CC(=C1)C(C(=O)NCC2=CC(=CC=C2)S(=O)(=O)N)NC3=CC4=C(C=C3)C(=NC=C4)N)OC(C)C
|
|||
| InChI |
1S/C29H33N5O5S/c1-4-38-26-16-21(8-11-25(26)39-18(2)3)27(34-22-9-10-24-20(15-22)12-13-32-28(24)30)29(35)33-17-19-6-5-7-23(14-19)40(31,36)37/h5-16,18,27,34H,4,17H2,1-3H3,(H2,30,32)(H,33,35)(H2,31,36,37)/t27-/m1/s1
|
|||
| InChIKey |
SPHDBMSKHYVTNQ-HHHXNRCGSA-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.