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Name | BRN 5841483 |
---|---|
Molecular formula | C23H24N6O5S |
IUPAC name | 2-[5-[2-[[5-[(dimethylamino)methyl]furan-2-yl]methylsulfanyl]ethylamino]-2,4-dinitroanilino]benzonitrile |
Molecular weight | 496.542 |
Hydrogen bond acceptor | 10 |
Hydrogen bond donor | 2 |
XlogP | 5.0 |
Synonyms | CHEMBL106082 BDBM50004658 LS-38698 2-[5-[2-[[5-(dimethylaminomethyl)furan-2-yl]methylsulfanyl]ethylamino]-2,4-dinitroanilino]benzonitrile AC1MILJC [ Show all ] |
Inchi Key | MVJGXHDGHVCSQW-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C23H24N6O5S/c1-27(2)14-17-7-8-18(34-17)15-35-10-9-25-20-11-21(23(29(32)33)12-22(20)28(30)31)26-19-6-4-3-5-16(19)13-24/h3-8,11-12,25-26H,9-10,14-15H2,1-2H3 |
PubChem CID | 3072515 |
ChEMBL | CHEMBL106082 |
IUPHAR | N/A |
BindingDB | 50004658 |
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 |
---|---|---|---|---|---|
215065 | Muscarinic acetylcholine receptor M1 | P12657 | Chrm1 | Mus musculus (Mouse) | 460 |
215064 | Muscarinic acetylcholine receptor M2 | P10980 | Chrm2 | Rattus norvegicus (Rat) | 466 |
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