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Name | CHEMBL452310 |
---|---|
Molecular formula | C31H31Cl2N3O5 |
IUPAC name | (2R)-3-[[4-[[4-(cyclohexen-1-yl)-N-[(3,5-dichlorophenyl)carbamoyl]anilino]methyl]benzoyl]amino]-2-methoxypropanoic acid |
Molecular weight | 596.505 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 3 |
XlogP | 5.9 |
Synonyms | BDBM50244504 SCHEMBL2665502 (R)-3-{4-[1-(4-Cyclohex-1-enylphenyl)-3-(3,5-dichlorophenyl)ureidomethyl]benzoylamino}-2-methoxypropionic acid |
Inchi Key | GIRRFIIUMQOFBL-MUUNZHRXSA-N |
Inchi ID | InChI=1S/C31H31Cl2N3O5/c1-41-28(30(38)39)18-34-29(37)23-9-7-20(8-10-23)19-36(31(40)35-26-16-24(32)15-25(33)17-26)27-13-11-22(12-14-27)21-5-3-2-4-6-21/h5,7-17,28H,2-4,6,18-19H2,1H3,(H,34,37)(H,35,40)(H,38,39)/t28-/m1/s1 |
PubChem CID | 10145290 |
ChEMBL | CHEMBL452310 |
IUPHAR | N/A |
BindingDB | 50244504 |
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 |
---|---|---|---|---|---|
97505 | Gastric inhibitory polypeptide receptor | P48546 | GIPR | Homo sapiens (Human) | 466 |
97507 | Glucagon receptor | P47871 | GCGR | Homo sapiens (Human) | 477 |
97506 | Glucagon-like peptide 1 receptor | P43220 | GLP1R | Homo sapiens (Human) | 463 |
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