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Name | SCHEMBL2044598 |
---|---|
Molecular formula | C47H43Cl2N5O7 |
IUPAC name | (2S)-2-[[(3S,8S)-3-[4-[(3,4-dichlorophenyl)methoxy]phenyl]-7-(2,5-dimethylpyrazole-3-carbonyl)-3,6,8,9-tetrahydro-2H-[1,4]dioxino[2,3-g]isoquinoline-8-carbonyl]amino]-3-[4-(2,3-dimethylpyridin-4-yl)phenyl]propanoic acid |
Molecular weight | 860.789 |
Hydrogen bond acceptor | 9 |
Hydrogen bond donor | 2 |
XlogP | 8.2 |
Synonyms | US9175003, 270 CHEMBL3938770 BDBM190076 |
Inchi Key | AHTIFQQLNHXTGH-FXJHBLCXSA-N |
Inchi ID | InChI=1S/C47H43Cl2N5O7/c1-26-17-41(53(4)52-26)46(56)54-23-34-22-43-42(60-25-44(61-43)32-10-12-35(13-11-32)59-24-30-7-14-37(48)38(49)18-30)21-33(34)20-40(54)45(55)51-39(47(57)58)19-29-5-8-31(9-6-29)36-15-16-50-28(3)27(36)2/h5-18,21-22,39-40,44H,19-20,23-25H2,1-4H3,(H,51,55)(H,57,58)/t39-,40-,44+/m0/s1 |
PubChem CID | 58327546 |
ChEMBL | CHEMBL3938770 |
IUPHAR | N/A |
BindingDB | 190076 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. This ligand has a partition coefficient log P greater than 5. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
536088 | Glucagon-like peptide 1 receptor | P43220 | GLP1R | Homo sapiens (Human) | 463 |
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