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Name | CHEMBL528775 |
---|---|
Molecular formula | C31H35N3O5S |
IUPAC name | (2R)-3-[[4-[[4-cyclohexyl-N-[(3-methylsulfanylphenyl)carbamoyl]anilino]methyl]benzoyl]amino]-2-hydroxypropanoic acid |
Molecular weight | 561.697 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 4 |
XlogP | 5.4 |
Synonyms | BDBM50245101 SCHEMBL2651349 (R)-3-{4-[1-(4-Cyclohexylphenyl)-3-(3-methylthio)phenyl-ureidomethyl]benzoylamino}-2-hydroxypropionic acid |
Inchi Key | SYWXLIGCTNVJDM-MUUNZHRXSA-N |
Inchi ID | InChI=1S/C31H35N3O5S/c1-40-27-9-5-8-25(18-27)33-31(39)34(26-16-14-23(15-17-26)22-6-3-2-4-7-22)20-21-10-12-24(13-11-21)29(36)32-19-28(35)30(37)38/h5,8-18,22,28,35H,2-4,6-7,19-20H2,1H3,(H,32,36)(H,33,39)(H,37,38)/t28-/m1/s1 |
PubChem CID | 10144347 |
ChEMBL | CHEMBL528775 |
IUPHAR | N/A |
BindingDB | 50245101 |
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 |
---|---|---|---|---|---|
326616 | Gastric inhibitory polypeptide receptor | P48546 | GIPR | Homo sapiens (Human) | 466 |
326615 | Glucagon receptor | P47871 | GCGR | Homo sapiens (Human) | 477 |
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