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Ligand

NameCHEMBL3735831
Molecular formulaC35H35N3O2S
IUPAC name2-[4-[[4-methyl-6-[[(2S)-2-phenylpropyl]carbamothioyl]-2-propylbenzimidazol-1-yl]methyl]phenyl]benzoic acid
Molecular weight561.744
Hydrogen bond acceptor4
Hydrogen bond donor2
XlogP7.9
SynonymsN/A
Inchi KeyAPMKQRTVQCWVSW-XMMPIXPASA-N
Inchi IDInChI=1S/C35H35N3O2S/c1-4-10-32-37-33-23(2)19-28(34(41)36-21-24(3)26-11-6-5-7-12-26)20-31(33)38(32)22-25-15-17-27(18-16-25)29-13-8-9-14-30(29)35(39)40/h5-9,11-20,24H,4,10,21-22H2,1-3H3,(H,36,41)(H,39,40)/t24-/m1/s1
PubChem CID127034904
ChEMBLCHEMBL3735831
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
This ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
521756Type-1 angiotensin II receptorP30556AGTR1Homo sapiens (Human)359

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