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Ligand

NameCHEMBL165541
Molecular formulaC34H42N4O4S
IUPAC name6-amino-N-[2-[4-[(2-butyl-4-oxo-6-propan-2-ylquinazolin-3-yl)methyl]phenyl]phenyl]sulfonylhexanamide
Molecular weight602.794
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP5.3
Synonyms4''-(2-Butyl-6-isopropyl-4-oxo-4H-quinazolin-3-ylmethyl)-biphenyl-2-sulfonic acid (6-amino-hexanoyl)-amide
BDBM50282437
Inchi KeyAPDGVEGUUYCZSS-UHFFFAOYSA-N
Inchi IDInChI=1S/C34H42N4O4S/c1-4-5-13-32-36-30-20-19-27(24(2)3)22-29(30)34(40)38(32)23-25-15-17-26(18-16-25)28-11-8-9-12-31(28)43(41,42)37-33(39)14-7-6-10-21-35/h8-9,11-12,15-20,22,24H,4-7,10,13-14,21,23,35H2,1-3H3,(H,37,39)
PubChem CID44379184
ChEMBLCHEMBL165541
IUPHARN/A
BindingDB50282437
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
10865Type-1 angiotensin II receptorP34976AGTR1Oryctolagus cuniculus (Rabbit)359
10864Type-2 angiotensin II receptorP35351Agtr2Rattus norvegicus (Rat)363

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