Ligand Information
| Ligand General Information | Top | |||
|---|---|---|---|---|
| Ligand ID |
LJR8B2
|
|||
| Ligand Name |
(2R,3R)-2-azanyl-1-[4-[[4-[2-[4-(hydroxymethyl)phenyl]ethynyl]phenyl]methyl]piperidin-1-yl]-4-methylsulfonyl-3-oxidanyl-butan-1-one
|
|||
| Synonyms |
CHEMBL4756867; (2R,3R)-2-azanyl-1-[4-[[4-[2-[4-(hydroxymethyl)phenyl]ethynyl]phenyl]methyl]piperidin-1-yl]-4-methylsulfonyl-3-oxidanyl-butan-1-one; BDBM50549080; FY9
Click to Show/Hide
|
|||
| Structure |
 |
Download2D MOL |
||
| Formula |
C26H32N2O5S
|
|||
| Canonical SMILES |
CS(=O)(=O)CC(C(C(=O)N1CCC(CC1)CC2=CC=C(C=C2)C#CC3=CC=C(C=C3)CO)N)O
|
|||
| InChI |
1S/C26H32N2O5S/c1-34(32,33)18-24(30)25(27)26(31)28-14-12-22(13-15-28)16-21-8-4-19(5-9-21)2-3-20-6-10-23(17-29)11-7-20/h4-11,22,24-25,29-30H,12-18,27H2,1H3/t24-,25+/m0/s1
|
|||
| InChIKey |
RNBZGRMVKCFVJP-LOSJGSFVSA-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.