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Name | CHEMBL3115379 |
---|---|
Molecular formula | C22H26F3N3O2 |
IUPAC name | 2-[3-(2,2-dimethylpropoxy)phenyl]-1-[8-(trifluoromethyl)-1,2,3,5-tetrahydropyrido[2,3-e][1,4]diazepin-4-yl]ethanone |
Molecular weight | 421.464 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 1 |
XlogP | 4.5 |
Synonyms | BDBM50447486 |
Inchi Key | IMAASOWDRHBKJH-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C22H26F3N3O2/c1-21(2,3)14-30-17-6-4-5-15(11-17)12-19(29)28-10-9-26-20-16(13-28)7-8-18(27-20)22(23,24)25/h4-8,11H,9-10,12-14H2,1-3H3,(H,26,27) |
PubChem CID | 76336002 |
ChEMBL | CHEMBL3115379 |
IUPHAR | N/A |
BindingDB | 50447486 |
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 |
---|---|---|---|---|---|
136474 | Bombesin receptor subtype-3 | O54798 | Brs3 | Mus musculus (Mouse) | 399 |
136475 | Bombesin receptor subtype-3 | P32247 | BRS3 | Homo sapiens (Human) | 399 |
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