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Name | CHEMBL455214 |
---|---|
Molecular formula | C32H29F4N3O7 |
IUPAC name | (2R)-3-[[4-[[4-(cyclohexen-1-yl)-N-[(2,2,4,4-tetrafluoro-1,3-benzodioxin-6-yl)carbamoyl]anilino]methyl]benzoyl]amino]-2-hydroxypropanoic acid |
Molecular weight | 643.592 |
Hydrogen bond acceptor | 11 |
Hydrogen bond donor | 4 |
XlogP | 5.1 |
Synonyms | BDBM50245099 SCHEMBL2665510 (R)-3-{4-[1-(4-Cyclohex-1-enylphenyl)-3-(2,2,4,4-tetrafluoro-4H-benzo[1,3]dioxin-6-yl)ureidomethyl]benzoylamino}-2-hydroxypropionic acid |
Inchi Key | SPYNVKYBDKGKEH-AREMUKBSSA-N |
Inchi ID | InChI=1S/C32H29F4N3O7/c33-31(34)25-16-23(12-15-27(25)45-32(35,36)46-31)38-30(44)39(24-13-10-21(11-14-24)20-4-2-1-3-5-20)18-19-6-8-22(9-7-19)28(41)37-17-26(40)29(42)43/h4,6-16,26,40H,1-3,5,17-18H2,(H,37,41)(H,38,44)(H,42,43)/t26-/m1/s1 |
PubChem CID | 10168348 |
ChEMBL | CHEMBL455214 |
IUPHAR | N/A |
BindingDB | 50245099 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand has more than 10 hydrogen bond acceptor. 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 |
---|---|---|---|---|---|
320376 | Gastric inhibitory polypeptide receptor | P48546 | GIPR | Homo sapiens (Human) | 466 |
320375 | Glucagon receptor | P47871 | GCGR | Homo sapiens (Human) | 477 |
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