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Ligand

NameCHEMBL2017869
Molecular formulaC30H38FN3O6S
IUPAC name1-[1-[2-[2-(2-fluoroethoxy)-4-(1-methylsulfonylpiperidin-4-yl)oxyphenyl]acetyl]piperidin-4-yl]-3,4-dihydroquinolin-2-one
Molecular weight587.707
Hydrogen bond acceptor8
Hydrogen bond donor0
XlogP3.0
SynonymsALS-I-41
BDBM50380759
J3.603.231F
Inchi KeySYRRIFTXJYXCIX-UHFFFAOYSA-N
Inchi IDInChI=1S/C30H38FN3O6S/c1-41(37,38)33-17-12-25(13-18-33)40-26-8-6-23(28(21-26)39-19-14-31)20-30(36)32-15-10-24(11-16-32)34-27-5-3-2-4-22(27)7-9-29(34)35/h2-6,8,21,24-25H,7,9-20H2,1H3
PubChem CID57519948
ChEMBLCHEMBL2017869
IUPHARN/A
BindingDB50380759
DrugBankN/A

Structure

SDF download

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

Known GPCRs

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Total entries: 5
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
326490Oxytocin receptorP30559OXTRHomo sapiens (Human)389
326487Vasopressin V1a receptorP37288AVPR1AHomo sapiens (Human)418
326489Vasopressin V1a receptorQ9WTV9Avpr1aMicrotus ochrogaster (Prairie vole)420
326486Vasopressin V1b receptorP47901AVPR1BHomo sapiens (Human)424
326488Vasopressin V2 receptorP30518AVPR2Homo sapiens (Human)371

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