Ligand Information
| Ligand General Information | Top | |||
|---|---|---|---|---|
| Ligand ID |
L9U2ZB
|
|||
| Ligand Name |
N'-(5-Chloro-1,3-Benzodioxol-4-Yl)-N-(3-Morpholin-4-Ylphenyl)pyrimidine-2,4-Diamine
|
|||
| Synonyms |
N'-(5-Chloro-1,3-Benzodioxol-4-Yl)-N-(3-Morpholin-4-Ylphenyl)pyrimidine-2,4-Diamine; 2vx0; CHEMBL255874; SCHEMBL21067864; 2,4-Pyrimidine derivative, 31; BDBM25229; DB07255; 4-N-(5-chloro-2H-1,3-benzodioxol-4-yl)-2-N-[3-(morpholin-4-yl)phenyl]pyrimidine-2,4-diamine; Q27096481; 7X7
Click to Show/Hide
|
|||
| Structure |
 |
Download2D MOL |
||
| Formula |
C21H20ClN5O3
|
|||
| Canonical SMILES |
C1COCCN1C2=CC=CC(=C2)NC3=NC=CC(=N3)NC4=C(C=CC5=C4OCO5)Cl
|
|||
| InChI |
1S/C21H20ClN5O3/c22-16-4-5-17-20(30-13-29-17)19(16)25-18-6-7-23-21(26-18)24-14-2-1-3-15(12-14)27-8-10-28-11-9-27/h1-7,12H,8-11,13H2,(H2,23,24,25,26)
|
|||
| InChIKey |
PNEWIQAEGKQNCE-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.