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Name | CHEMBL377843 |
---|---|
Molecular formula | C32H28F4N4 |
IUPAC name | 3-[4-[6-(cyclopropylmethyl)-2-[5-fluoro-6-(trifluoromethyl)-1H-benzimidazol-2-yl]-6-azaspiro[2.5]octan-2-yl]phenyl]benzonitrile |
Molecular weight | 544.598 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 1 |
XlogP | 7.1 |
Synonyms | BDBM50186834 SCHEMBL14502088 4''-[6-cyclopropylmethyl-1-(5-fluoro-6-trifluoromethyl-1H-benzoimidazol-2-yl)-6-aza-spiro[2.5]oct-1-yl]-biphenyl-3-carbonitrile |
Inchi Key | LDNCQUAOPIRLNF-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C32H28F4N4/c33-26-16-28-27(15-25(26)32(34,35)36)38-29(39-28)31(19-30(31)10-12-40(13-11-30)18-20-4-5-20)24-8-6-22(7-9-24)23-3-1-2-21(14-23)17-37/h1-3,6-9,14-16,20H,4-5,10-13,18-19H2,(H,38,39) |
PubChem CID | 11635274 |
ChEMBL | CHEMBL377843 |
IUPHAR | N/A |
BindingDB | 50186834 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. This ligand has a partition coefficient log P greater than 5. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
184752 | Melanin-concentrating hormone receptor 1 | Q8JZL2 | Mchr1 | Mus musculus (Mouse) | 353 |
184753 | Melanin-concentrating hormone receptor 1 | Q99705 | MCHR1 | Homo sapiens (Human) | 422 |
184754 | Melanin-concentrating hormone receptor 2 | Q969V1 | MCHR2 | Homo sapiens (Human) | 340 |
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