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Ligand

Name137862-87-4
Molecular formulaC24H29N5O3
IUPAC name(2R)-3-methyl-2-[pentanoyl-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]amino]butanoic acid
Molecular weight435.528
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP4.4
SynonymsAKOS026751459
DTXSID6023735
NCGC00095139-01
Valsartan related compound A RS [USP]
(2R)-3-methyl-2-[pentanoyl-[[4-[2-(2H-1,2,3,4-tetrazol-5-yl)phenyl]phenyl]methyl]amino]butanoic acid
[ Show all ]
Inchi KeyACWBQPMHZXGDFX-JOCHJYFZSA-N
Inchi IDInChI=1S/C24H29N5O3/c1-4-5-10-21(30)29(22(16(2)3)24(31)32)15-17-11-13-18(14-12-17)19-8-6-7-9-20(19)23-25-27-28-26-23/h6-9,11-14,16,22H,4-5,10,15H2,1-3H3,(H,31,32)(H,25,26,27,28)/t22-/m1/s1
PubChem CID5284633
ChEMBLCHEMBL115622
IUPHARN/A
BindingDB50282371
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
1985Type-1 angiotensin II receptorP30556AGTR1Homo sapiens (Human)359

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