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Name | CHEMBL3400276 |
---|---|
Molecular formula | C31H36N2O3 |
IUPAC name | ethyl 4-[4-[[(2S,3S)-2-amino-3-methylpentyl]-[(1R,2R)-2-phenylcyclopropanecarbonyl]amino]phenyl]benzoate |
Molecular weight | 484.64 |
Hydrogen bond acceptor | 4 |
Hydrogen bond donor | 1 |
XlogP | 5.8 |
Synonyms | BDBM50065937 |
Inchi Key | GOHJUGNDVLPAMF-AGMJPXHESA-N |
Inchi ID | InChI=1S/C31H36N2O3/c1-4-21(3)29(32)20-33(30(34)28-19-27(28)24-9-7-6-8-10-24)26-17-15-23(16-18-26)22-11-13-25(14-12-22)31(35)36-5-2/h6-18,21,27-29H,4-5,19-20,32H2,1-3H3/t21-,27-,28+,29+/m0/s1 |
PubChem CID | 118727685 |
ChEMBL | CHEMBL3400276 |
IUPHAR | N/A |
BindingDB | 50065937 |
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 |
---|---|---|---|---|---|
445685 | Probable G-protein coupled receptor 88 | Q9GZN0 | GPR88 | Homo sapiens (Human) | 384 |
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