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Name | CHEMBL557585 |
---|---|
Molecular formula | C35H45F2N3 |
IUPAC name | 1-[3-[2-(3-fluorophenyl)phenyl]propyl]-4-[2-(4-fluorophenyl)-2-(1-propan-2-ylpiperidin-4-yl)ethyl]piperazine |
Molecular weight | 545.763 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 0 |
XlogP | 7.5 |
Synonyms | BDBM50203994 (+/-)-1-[3-(30-fluorobiphenyl-2-yl)propyl]-4-[2-(4-fluorophenyl)-2-(1-isopropylpiperidin-4-yl)ethyl]piperazine trihydrochloride CHEMBL1196602 |
Inchi Key | BXMQVSMCTWXOEI-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C35H45F2N3/c1-27(2)40-19-16-30(17-20-40)35(29-12-14-32(36)15-13-29)26-39-23-21-38(22-24-39)18-6-9-28-7-3-4-11-34(28)31-8-5-10-33(37)25-31/h3-5,7-8,10-15,25,27,30,35H,6,9,16-24,26H2,1-2H3 |
PubChem CID | 44423382 |
ChEMBL | N/A |
IUPHAR | N/A |
BindingDB | 50203994 |
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 |
---|---|---|---|---|---|
35224 | D(2) dopamine receptor | P61169 | Drd2 | Rattus norvegicus (Rat) | 444 |
35221 | Delta-type opioid receptor | P33533 | Oprd1 | Rattus norvegicus (Rat) | 372 |
35222 | Histamine H1 receptor | P31390 | Hrh1 | Rattus norvegicus (Rat) | 486 |
459531 | Melanocortin receptor 4 | P32245 | MC4R | Homo sapiens (Human) | 332 |
35223 | Mu-type opioid receptor | P33535 | Oprm1 | Rattus norvegicus (Rat) | 398 |
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