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Name | CHEMBL2147920 |
---|---|
Molecular formula | C25H23F3N2O2 |
IUPAC name | (1R,14S,15R)-25-methyl-9-(trifluoromethyl)-4,25-diazahexacyclo[13.7.3.01,14.03,12.05,10.017,22]pentacosa-3,5,7,9,11,17(22),18,20-octaene-14,20-diol |
Molecular weight | 440.466 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 2 |
XlogP | 4.3 |
Synonyms | CHEMBL2220032 BDBM50391607 |
Inchi Key | CQJGLYPYRSUYPN-WXFUMESZSA-N |
Inchi ID | InChI=1S/C25H23F3N2O2/c1-30-8-7-23-13-21-15(9-17-18(25(26,27)28)3-2-4-20(17)29-21)12-24(23,32)22(30)10-14-5-6-16(31)11-19(14)23/h2-6,9,11,22,31-32H,7-8,10,12-13H2,1H3/t22-,23-,24-/m1/s1 |
PubChem CID | 71456465 |
ChEMBL | N/A |
IUPHAR | N/A |
BindingDB | 50391607 |
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 |
---|---|---|---|---|---|
48130 | Delta-type opioid receptor | P32300 | Oprd1 | Mus musculus (Mouse) | 372 |
48129 | Kappa-type opioid receptor | P41144 | OPRK1 | Cavia porcellus (Guinea pig) | 380 |
48128 | Mu-type opioid receptor | P42866 | Oprm1 | Mus musculus (Mouse) | 398 |
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