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Name | SMR000037766 |
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Molecular formula | C20H20N4O2S |
IUPAC name | 7-benzyl-12-propan-2-yl-13-oxa-16-thia-2,4,5,7-tetrazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-8-one |
Molecular weight | 380.466 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 0 |
XlogP | 3.1 |
Synonyms | 4-benzyl-7-(propan-2-yl)-6,9-dihydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one MLS002581148 STK540071 MCULE-6218920998 AC1LD2KB [ Show all ] |
Inchi Key | AFHGDPJPBZUTBB-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C20H20N4O2S/c1-12(2)15-8-14-16(10-26-15)27-19-17(14)18(25)23(20-22-21-11-24(19)20)9-13-6-4-3-5-7-13/h3-7,11-12,15H,8-10H2,1-2H3 |
PubChem CID | 660230 |
ChEMBL | CHEMBL1532567 |
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 |
---|---|---|---|---|---|
4150 | Glucagon-like peptide 1 receptor | P43220 | GLP1R | Homo sapiens (Human) | 463 |
4151 | Neuropeptide S receptor | Q6W5P4 | NPSR1 | Homo sapiens (Human) | 371 |
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