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Ligand

NameCHEMBL1078533
Molecular formulaC20H28N4O3S
IUPAC name1-[4-[[4-(aminomethyl)phenyl]sulfamoyl]phenyl]-3-hexylurea
Molecular weight404.529
Hydrogen bond acceptor5
Hydrogen bond donor4
XlogP2.6
SynonymsBDBM50311097
N-(4-(aminomethyl)phenyl)-4-(3-hexylureido)benzenesulfonamide
Inchi KeyAGUXGNJNKDLAHB-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H28N4O3S/c1-2-3-4-5-14-22-20(25)23-17-10-12-19(13-11-17)28(26,27)24-18-8-6-16(15-21)7-9-18/h6-13,24H,2-5,14-15,21H2,1H3,(H2,22,23,25)
PubChem CID46882807
ChEMBLCHEMBL1078533
IUPHARN/A
BindingDB50311097
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
5231Growth hormone secretagogue receptor type 1Q92847GHSRHomo sapiens (Human)366

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