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Name | CHEMBL3262638 |
---|---|
Molecular formula | C25H30ClN7O |
IUPAC name | [7-[5-chloro-4-(3,5-dimethylpyridin-2-yl)pyridin-2-yl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl]-(3,5-dimethylpiperazin-1-yl)methanone |
Molecular weight | 480.013 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 1 |
XlogP | 2.6 |
Synonyms | BDBM50013255 SCHEMBL17454991 |
Inchi Key | BTAYCTVTHRDDIF-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C25H30ClN7O/c1-15-7-16(2)24(28-9-15)19-8-22(27-10-20(19)26)32-6-5-31-13-21(30-23(31)14-32)25(34)33-11-17(3)29-18(4)12-33/h7-10,13,17-18,29H,5-6,11-12,14H2,1-4H3 |
PubChem CID | 90656298 |
ChEMBL | CHEMBL3262638 |
IUPHAR | N/A |
BindingDB | 50013255 |
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 |
---|---|---|---|---|---|
32191 | Smoothened homolog | Q99835 | SMO | Homo sapiens (Human) | 787 |
zhanglabzhanggroup.org | (734) 647-1549 | 100 Washtenaw Avenue, Ann Arbor, MI 48109-2218