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Ligand

NameCHEMBL470856
Molecular formulaC27H33ClN2O4S2
IUPAC name4-[4-[2-[[(2R)-2-hydroxy-2-phenylethyl]amino]ethyl]phenyl]-N-methylsulfonyl-2-propan-2-ylsulfanylbenzamide;hydrochloride
Molecular weight549.141
Hydrogen bond acceptor6
Hydrogen bond donor4
XlogPNone
SynonymsSCHEMBL4584432
Inchi KeyVATXXVNKLANBME-UQIIZPHYSA-N
Inchi IDInChI=1S/C27H32N2O4S2.ClH/c1-19(2)34-26-17-23(13-14-24(26)27(31)29-35(3,32)33)21-11-9-20(10-12-21)15-16-28-18-25(30)22-7-5-4-6-8-22;/h4-14,17,19,25,28,30H,15-16,18H2,1-3H3,(H,29,31);1H/t25-;/m0./s1
PubChem CID42626404
ChEMBLCHEMBL470856
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
Partition coefficient log P of this ligand is not available.

Known GPCRs

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Total entries: 4
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
350396Beta-1 adrenergic receptorP08588ADRB1Homo sapiens (Human)477
350397Beta-2 adrenergic receptorP07550ADRB2Homo sapiens (Human)413
350398Beta-3 adrenergic receptorP13945ADRB3Homo sapiens (Human)408
350399Beta-3 adrenergic receptorO02662ADRB3Canis lupus familiaris (Dog)405

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