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Name | CHEMBL3732045 |
---|---|
Molecular formula | C27H21N3O5S |
IUPAC name | 2-(2-methoxyimidazo[2,1-b][1,3,4]thiadiazol-6-yl)-4-[(3-phenylmethoxyphenyl)methoxy]-1-benzofuran-6-ol |
Molecular weight | 499.541 |
Hydrogen bond acceptor | 8 |
Hydrogen bond donor | 1 |
XlogP | 5.8 |
Synonyms | 4-((3-(Benzyloxy)benzyl)oxy)-2-(2-methoxyimidazo[2,1-b][1,3,4]thiadiazol-6-yl)benzofuran-6-ol BQMUKADQEJFADT-UHFFFAOYSA-N SCHEMBL15359262 |
Inchi Key | BQMUKADQEJFADT-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C27H21N3O5S/c1-32-27-29-30-14-22(28-26(30)36-27)25-13-21-23(11-19(31)12-24(21)35-25)34-16-18-8-5-9-20(10-18)33-15-17-6-3-2-4-7-17/h2-14,31H,15-16H2,1H3 |
PubChem CID | 72202432 |
ChEMBL | CHEMBL3732045 |
IUPHAR | N/A |
BindingDB | N/A |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand has a partition coefficient log P greater than 5. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
522474 | Proteinase-activated receptor 4 | Q96RI0 | F2RL3 | Homo sapiens (Human) | 385 |
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