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Name | CHEMBL308685 |
---|---|
Molecular formula | C26H36N6O3S |
IUPAC name | 1-[2-(benzenesulfonamido)ethyl]-3-cyano-2-[4-[3-(piperidin-1-ylmethyl)phenoxy]butyl]guanidine |
Molecular weight | 512.673 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 3 |
XlogP | 3.3 |
Synonyms | 1-[2-(Phenylsulfonylamino)ethyl]-2-cyano-3-[4-[3-(1-piperidinylmethyl)phenoxy]butyl]guanidine |
Inchi Key | AEEXSDDDKFLWGP-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C26H36N6O3S/c27-22-30-26(29-15-16-31-36(33,34)25-12-3-1-4-13-25)28-14-5-8-19-35-24-11-9-10-23(20-24)21-32-17-6-2-7-18-32/h1,3-4,9-13,20,31H,2,5-8,14-19,21H2,(H2,28,29,30) |
PubChem CID | 15179539 |
ChEMBL | CHEMBL308685 |
IUPHAR | N/A |
BindingDB | N/A |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
535996 | Histamine H2 receptor | P47747 | HRH2 | Cavia porcellus (Guinea pig) | 359 |
zhanglabzhanggroup.org | (734) 647-1549 | 100 Washtenaw Avenue, Ann Arbor, MI 48109-2218