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Ligand

NameCHEMBL605971
Molecular formulaC22H22N4O2S
IUPAC name(3R)-1-(2-methyl-3-naphthalen-1-ylsulfonylindazol-5-yl)pyrrolidin-3-amine
Molecular weight406.504
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP3.3
SynonymsBDBM50308172
SCHEMBL12622501
(3R)-1-[2-Methyl-3-(naphthalen-1-ylsulfonyl)-2H-indazol-5-yl]pyrrolidin-3-amine
Inchi KeyAUNJSZUSKBJRIJ-MRXNPFEDSA-N
Inchi IDInChI=1S/C22H22N4O2S/c1-25-22(29(27,28)21-8-4-6-15-5-2-3-7-18(15)21)19-13-17(9-10-20(19)24-25)26-12-11-16(23)14-26/h2-10,13,16H,11-12,14,23H2,1H3/t16-/m1/s1
PubChem CID45378934
ChEMBLCHEMBL605971
IUPHARN/A
BindingDB50308172
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
148055-hydroxytryptamine receptor 2BP41595HTR2BHomo sapiens (Human)481
148045-hydroxytryptamine receptor 6P50406HTR6Homo sapiens (Human)440

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