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Name | AC1MDGI7 |
---|---|
Molecular formula | C19H20N4O5S |
IUPAC name | 1-hexyl-4-hydroxy-N-(5-nitro-1,3-thiazol-2-yl)-2-oxoquinoline-3-carboxamide |
Molecular weight | 416.452 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 2 |
XlogP | 4.3 |
Synonyms | 1-hexyl-2-hydroxy-N-(5-nitro-1,3-thiazol-2-yl)-4-oxoquinoline-3-carboxamide BAS 00287622 ZINC100331702 3-Quinolinecarboxamide, N-(5-nitrothiazol-2-yl)-1,2-dihydro-4-hydroxy-1-hexyl-2-oxo- MCULE-1442062917 [ Show all ] |
Inchi Key | FEWIYSSZBYTYER-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C19H20N4O5S/c1-2-3-4-7-10-22-13-9-6-5-8-12(13)16(24)15(18(22)26)17(25)21-19-20-11-14(29-19)23(27)28/h5-6,8-9,11,24H,2-4,7,10H2,1H3,(H,20,21,25) |
PubChem CID | 54676511 |
ChEMBL | CHEMBL3986795 |
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 |
---|---|---|---|---|---|
537872 | Smoothened homolog | P56726 | Smo | Mus musculus (Mouse) | 793 |
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