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Ligand

NameCHEMBL246461
Molecular formulaC22H32N2O4S2
IUPAC namebutyl N-[3-[4-[(dimethylamino)methyl]phenyl]-5-(2-methylpropyl)thiophen-2-yl]sulfonylcarbamate
Molecular weight452.628
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP5.4
SynonymsBDBM50221323
N-butyloxycarbonyl-3-[4-(dimethylaminomethyl)phenyl]-5-iso-butylthiophene-2-sulfonamide
Inchi KeyBWROICQNMHQTFN-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H32N2O4S2/c1-6-7-12-28-22(25)23-30(26,27)21-20(14-19(29-21)13-16(2)3)18-10-8-17(9-11-18)15-24(4)5/h8-11,14,16H,6-7,12-13,15H2,1-5H3,(H,23,25)
PubChem CID44437987
ChEMBLCHEMBL246461
IUPHARN/A
BindingDB50221323
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
34672Type-1A angiotensin II receptorP25095Agtr1Rattus norvegicus (Rat)359

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