Ligand Information
| Ligand General Information | Top | |||
|---|---|---|---|---|
| Ligand ID |
LBZ6G5
|
|||
| Ligand Name |
(3s,4s,5r)-3-(4-Amino-3-Bromo-5-Fluorobenzyl)-5-{[3-(1,1-Difluoroethyl)benzyl]amino}tetrahydro-2h-Thiopyran-4-Ol 1,1-Dioxide
|
|||
| Synonyms |
CHEMBL2047891; (3s,4s,5r)-3-(4-Amino-3-Bromo-5-Fluorobenzyl)-5-{[3-(1,1-Difluoroethyl)benzyl]amino}tetrahydro-2h-Thiopyran-4-Ol 1,1-Dioxide; BDBM50386527; Q27451085; 0GS
Click to Show/Hide
|
|||
| Structure |
 |
Download2D MOL |
||
| Formula |
C21H24BrF3N2O3S
|
|||
| Canonical SMILES |
CC(C1=CC=CC(=C1)CNC2CS(=O)(=O)CC(C2O)CC3=CC(=C(C(=C3)Br)N)F)(F)F
|
|||
| InChI |
1S/C21H24BrF3N2O3S/c1-21(24,25)15-4-2-3-12(6-15)9-27-18-11-31(29,30)10-14(20(18)28)5-13-7-16(22)19(26)17(23)8-13/h2-4,6-8,14,18,20,27-28H,5,9-11,26H2,1H3/t14-,18+,20+/m1/s1
|
|||
| InChIKey |
QBRKIXCNLLQOPH-WNYOCNMUSA-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.