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Name | SCHEMBL2694924 |
---|---|
Molecular formula | C16H16N6O |
IUPAC name | 6-[4-[2-[(4S)-2-amino-4,5-dihydro-1,3-oxazol-4-yl]ethyl]anilino]pyrazine-2-carbonitrile |
Molecular weight | 308.345 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 2 |
XlogP | 1.4 |
Synonyms | US8673950, 31 CHEMBL3656504 ZINC169701171 BDBM119164 |
Inchi Key | BVKWOUZQWOJNMH-ZDUSSCGKSA-N |
Inchi ID | InChI=1S/C16H16N6O/c17-7-14-8-19-9-15(21-14)20-12-4-1-11(2-5-12)3-6-13-10-23-16(18)22-13/h1-2,4-5,8-9,13H,3,6,10H2,(H2,18,22)(H,20,21)/t13-/m0/s1 |
PubChem CID | 56967604 |
ChEMBL | CHEMBL3656504 |
IUPHAR | N/A |
BindingDB | 119164 |
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 |
---|---|---|---|---|---|
33833 | Trace amine-associated receptor 1 | Q923Y9 | Taar1 | Rattus norvegicus (Rat) | 332 |
33834 | Trace amine-associated receptor 1 | Q923Y8 | Taar1 | Mus musculus (Mouse) | 332 |
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