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Ligand

NameCHEMBL1554375
Molecular formulaC18H17F3N2O3S
IUPAC nameN-[(1-acetyl-2,3-dihydroindol-5-yl)methyl]-2-(trifluoromethyl)benzenesulfonamide
Molecular weight398.4
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP2.7
SynonymsMolPort-010-848-462
HMS1898D06
ZINC8599291
AKOS021734469
NCGC00134397-01
[ Show all ]
Inchi KeyADLLCWJBAJRVAT-UHFFFAOYSA-N
Inchi IDInChI=1S/C18H17F3N2O3S/c1-12(24)23-9-8-14-10-13(6-7-16(14)23)11-22-27(25,26)17-5-3-2-4-15(17)18(19,20)21/h2-7,10,22H,8-9,11H2,1H3
PubChem CID16030862
ChEMBLCHEMBL1554375
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 1
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GLASS IDNameUniProtGeneSpeciesLength
2396Relaxin receptor 1Q9HBX9RXFP1Homo sapiens (Human)757

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