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Name | SCHEMBL2522770 |
---|---|
Molecular formula | C29H43N3O3 |
IUPAC name | (2S,3S)-2-amino-3-methyl-N-[(2R)-2-[4-(2-methylpentoxy)phenyl]-2-[[(2S)-2-phenylpropanoyl]amino]ethyl]pentanamide |
Molecular weight | 481.681 |
Hydrogen bond acceptor | 4 |
Hydrogen bond donor | 3 |
XlogP | 5.6 |
Synonyms | CHEMBL3717315 (2S,3S)-2-amino-3-methyl-N-((2R)-2-(4-(2-methylpentyloxy)phenyl)-2-((S)-2-phenylpropanamido)ethyl)pentanamide KQUKOBIYBROAEB-KWPBYZGPSA-N |
Inchi Key | KQUKOBIYBROAEB-KWPBYZGPSA-N |
Inchi ID | InChI=1S/C29H43N3O3/c1-6-11-20(3)19-35-25-16-14-24(15-17-25)26(18-31-29(34)27(30)21(4)7-2)32-28(33)22(5)23-12-9-8-10-13-23/h8-10,12-17,20-22,26-27H,6-7,11,18-19,30H2,1-5H3,(H,31,34)(H,32,33)/t20?,21-,22-,26-,27-/m0/s1 |
PubChem CID | 51354738 |
ChEMBL | CHEMBL3717315 |
IUPHAR | N/A |
BindingDB | N/A |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand has a partition coefficient log P greater than 5. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
526486 | Probable G-protein coupled receptor 88 | Q9GZN0 | GPR88 | Homo sapiens (Human) | 384 |
zhanglabzhanggroup.org | (734) 647-1549 | 100 Washtenaw Avenue, Ann Arbor, MI 48109-2218