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Name | ethyl 2-[4-(cyanomethyl)-3-oxo-3,4-dihydro-2-quinoxalinyl]acetate |
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Molecular formula | C14H13N3O3 |
IUPAC name | ethyl 2-[4-(cyanomethyl)-3-oxoquinoxalin-2-yl]acetate |
Molecular weight | 271.276 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 0 |
XlogP | 1.1 |
Synonyms | 478041-11-1 Oprea1_851276 BDBM52697 HMS2687J20 2-[4-(cyanomethyl)-3-oxo-2-quinoxalinyl]acetic acid ethyl ester [ Show all ] |
Inchi Key | AASGCGWCHGCYQQ-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C14H13N3O3/c1-2-20-13(18)9-11-14(19)17(8-7-15)12-6-4-3-5-10(12)16-11/h3-6H,2,8-9H2,1H3 |
PubChem CID | 5181996 |
ChEMBL | CHEMBL1529516 |
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 |
---|---|---|---|---|---|
491 | Relaxin receptor 1 | Q9HBX9 | RXFP1 | Homo sapiens (Human) | 757 |
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