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Name | SCHEMBL2017314 |
---|---|
Molecular formula | C48H43Cl2N3O7 |
IUPAC name | (2S)-2-[[(3S,8S)-3-[4-[(3,4-dichlorophenyl)methoxy]phenyl]-7-[(1S)-1-phenylpropyl]-3,6,8,9-tetrahydro-2H-[1,4]dioxino[2,3-g]isoquinoline-8-carbonyl]amino]-3-(4-pyridin-4-yloxyphenyl)propanoic acid |
Molecular weight | 844.786 |
Hydrogen bond acceptor | 9 |
Hydrogen bond donor | 2 |
XlogP | 7.3 |
Synonyms | US9175003, 184 CHEMBL3973195 BDBM190024 |
Inchi Key | AFWCGPRDQKWXQQ-WWKIHPBISA-N |
Inchi ID | InChI=1S/C48H43Cl2N3O7/c1-2-42(32-6-4-3-5-7-32)53-27-35-26-45-44(58-29-46(60-45)33-11-15-36(16-12-33)57-28-31-10-17-39(49)40(50)22-31)25-34(35)24-43(53)47(54)52-41(48(55)56)23-30-8-13-37(14-9-30)59-38-18-20-51-21-19-38/h3-22,25-26,41-43,46H,2,23-24,27-29H2,1H3,(H,52,54)(H,55,56)/t41-,42-,43-,46+/m0/s1 |
PubChem CID | 49804426 |
ChEMBL | CHEMBL3973195 |
IUPHAR | N/A |
BindingDB | 190024 |
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 |
---|---|---|---|---|---|
536049 | Glucagon-like peptide 1 receptor | P43220 | GLP1R | Homo sapiens (Human) | 463 |
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