Ligand Information
Ligand General Information | Top | |||
---|---|---|---|---|
Ligand ID |
L2HYJ3
|
|||
Ligand Name |
US10875851, Example 114
|
|||
Synonyms |
SCHEMBL21571152; BDBM476458; US10875851, Example 114; (2S)-1-(N,3-dicyclohexyl-D-alanyl)-4- [(4R,5S)-4-methyl-5-phenyl-4,5- dihydro-1,3-oxazol-2-yl]-N-(thiophen- 2-ylmethyl)piperazine-2-carboxamide
Click to Show/Hide
|
|||
Structure |
Download2D MOL |
|||
Formula |
C35H49N5O3S
|
|||
Canonical SMILES |
CC1C(OC(=N1)N2CCN(C(C2)C(=O)NCC3=CC=CS3)C(=O)C(CC4CCCCC4)NC5CCCCC5)C6=CC=CC=C6
|
|||
InChI |
1S/C35H49N5O3S/c1-25-32(27-14-7-3-8-15-27)43-35(37-25)39-19-20-40(31(24-39)33(41)36-23-29-18-11-21-44-29)34(42)30(22-26-12-5-2-6-13-26)38-28-16-9-4-10-17-28/h3,7-8,11,14-15,18,21,25-26,28,30-32,38H,2,4-6,9-10,12-13,16-17,19-20,22-24H2,1H3,(H,36,41)/t25-,30-,31+,32-/m1/s1
|
|||
InChIKey |
CTYNKFLWABFRHE-BESSAKRQSA-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.