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Name | CHEMBL3220649 |
---|---|
Molecular formula | C16H22N8S |
IUPAC name | 2-[4-(3-amino-1H-1,2,4-triazol-5-yl)butyl]-1-cyano-3-(2-phenylsulfanylethyl)guanidine |
Molecular weight | 358.468 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 4 |
XlogP | 2.2 |
Synonyms | N/A |
Inchi Key | ASNXLJAURZJRJQ-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C16H22N8S/c17-12-21-16(20-10-11-25-13-6-2-1-3-7-13)19-9-5-4-8-14-22-15(18)24-23-14/h1-3,6-7H,4-5,8-11H2,(H2,19,20,21)(H3,18,22,23,24) |
PubChem CID | 90667246 |
ChEMBL | CHEMBL3220649 |
IUPHAR | N/A |
BindingDB | N/A |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
13354 | Histamine H1 receptor | P35367 | HRH1 | Homo sapiens (Human) | 487 |
13355 | Histamine H2 receptor | P25021 | HRH2 | Homo sapiens (Human) | 359 |
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