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Ligand

NameCID 10029477
Molecular formulaC27H38N4O4S
IUPAC name5-(aminomethyl)-3-[(1S,2S,4R)-7,7-dimethyl-1-(spiro[1,2-dihydroindene-3,4'-piperidine]-1'-ylsulfonylmethyl)-2-bicyclo[2.2.1]heptanyl]imidazolidine-2,4-dione
Molecular weight514.685
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP3.3
SynonymsN/A
Inchi KeyAOHLYYLXWGWSJO-KZVAKWDOSA-N
Inchi IDInChI=1S/C27H38N4O4S/c1-25(2)19-8-10-27(25,22(15-19)31-23(32)21(16-28)29-24(31)33)17-36(34,35)30-13-11-26(12-14-30)9-7-18-5-3-4-6-20(18)26/h3-6,19,21-22H,7-17,28H2,1-2H3,(H,29,33)/t19-,21?,22+,27-/m1/s1
PubChem CID10029477
ChEMBLCHEMBL130905
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
10252Oxytocin receptorP70536OxtrRattus norvegicus (Rat)388
10251Vasopressin V2 receptorQ00788Avpr2Rattus norvegicus (Rat)371

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