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Name | CHEMBL1651721 |
---|---|
Molecular formula | C23H26N6O2S2 |
IUPAC name | 5-amino-N-tert-butyl-2-methylsulfanyl-4-[3-[[2-oxo-2-(prop-2-ynylamino)ethyl]amino]phenyl]thieno[2,3-d]pyrimidine-6-carboxamide |
Molecular weight | 482.621 |
Hydrogen bond acceptor | 8 |
Hydrogen bond donor | 4 |
XlogP | 4.0 |
Synonyms | BDBM50335467 5-amino-N-tert-butyl-2-(methylthio)-4-(3-(2-oxo-2-(prop-2-ynylamino)ethylamino)phenyl)thieno[2,3-d]pyrimidine-6-carboxamide |
Inchi Key | OBTDWDIYUNCNGX-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C23H26N6O2S2/c1-6-10-25-15(30)12-26-14-9-7-8-13(11-14)18-16-17(24)19(20(31)29-23(2,3)4)33-21(16)28-22(27-18)32-5/h1,7-9,11,26H,10,12,24H2,2-5H3,(H,25,30)(H,29,31) |
PubChem CID | 53322111 |
ChEMBL | CHEMBL1651721 |
IUPHAR | N/A |
BindingDB | 50335467 |
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 |
---|---|---|---|---|---|
237342 | Follicle-stimulating hormone receptor | P23945 | FSHR | Homo sapiens (Human) | 695 |
237341 | Lutropin-choriogonadotropic hormone receptor | P22888 | LHCGR | Homo sapiens (Human) | 699 |
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