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Ligand

NameCHEMBL29730
Molecular formulaC36H35N7O3S
IUPAC name4-methylsulfinyl-N-[3-[[4-[2-(1-methyltetrazol-5-yl)phenyl]phenyl]methyl]-4-oxoquinazolin-6-yl]-N-pentylbenzamide
Molecular weight645.782
Hydrogen bond acceptor8
Hydrogen bond donor0
XlogP5.2
SynonymsBDBM50284657
4-Methanesulfinyl-N-{3-[2''-(1-methyl-1H-tetrazol-5-yl)-biphenyl-4-ylmethyl]-4-oxo-3,4-dihydro-quinazolin-6-yl}-N-pentyl-benzamide
Inchi KeyAKFWPKUOGSKYLT-UHFFFAOYSA-N
Inchi IDInChI=1S/C36H35N7O3S/c1-4-5-8-21-43(35(44)27-15-18-29(19-16-27)47(3)46)28-17-20-33-32(22-28)36(45)42(24-37-33)23-25-11-13-26(14-12-25)30-9-6-7-10-31(30)34-38-39-40-41(34)2/h6-7,9-20,22,24H,4-5,8,21,23H2,1-3H3
PubChem CID44277653
ChEMBLCHEMBL29730
IUPHARN/A
BindingDB50284657
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
7502Type-1 angiotensin II receptorP34976AGTR1Oryctolagus cuniculus (Rabbit)359

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