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Name | CHEMBL3672989 |
---|---|
Molecular formula | C19H17ClF2N4O3 |
IUPAC name | 1-[2-chloro-4-[(2R)-morpholin-2-yl]phenyl]-3-[5-cyano-2-(difluoromethoxy)phenyl]urea |
Molecular weight | 422.817 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 3 |
XlogP | 2.8 |
Synonyms | SCHEMBL14151202 US9029370, 47 BDBM158253 |
Inchi Key | BZPDPMRSUULMIB-KRWDZBQOSA-N |
Inchi ID | InChI=1S/C19H17ClF2N4O3/c20-13-8-12(17-10-24-5-6-28-17)2-3-14(13)25-19(27)26-15-7-11(9-23)1-4-16(15)29-18(21)22/h1-4,7-8,17-18,24H,5-6,10H2,(H2,25,26,27)/t17-/m0/s1 |
PubChem CID | 71087095 |
ChEMBL | CHEMBL3672989 |
IUPHAR | N/A |
BindingDB | 158253 |
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 |
---|---|---|---|---|---|
467435 | Trace amine-associated receptor 1 | Q923Y9 | Taar1 | Rattus norvegicus (Rat) | 332 |
467436 | Trace amine-associated receptor 1 | Q923Y8 | Taar1 | Mus musculus (Mouse) | 332 |
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